*HEADER    PEPTIDE-BINDING PROTEIN                 01-FEB-07   2OQS              
*TITLE     STRUCTURE OF THE HDLG/SAP97 PDZ2 IN COMPLEX WITH HPV-18               
*TITLE    2 PAPILLOMAVIRUS E6 PEPTIDE                                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DISKS LARGE HOMOLOG 1;                                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SECOND PDZ DOMAIN, RESIDUES 318-406;                       
*COMPND   5 SYNONYM: SYNAPSE-ASSOCIATED PROTEIN 97, SAP-97, HDLG;                
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: C-TERMINAL HPV-18 E6 PEPTIDE;                              
*COMPND   9 CHAIN: B;                                                            
*COMPND  10 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: DLG1;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET30A(+);                                
*SOURCE  10 MOL_ID: 2;                                                           
*SOURCE  11 SYNTHETIC: YES;                                                      
*SOURCE  12 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN HOMO                
*SOURCE  13 SAPIENS (HUMAN)                                                      
*KEYWDS    HPV E6, HDLG PDZ DOMAIN, PROTEIN-PEPTIDE COMPLEX, PEPTIDE-            
*KEYWDS   2 BINDING PROTEIN                                                      
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    Y.LIU, J.D.BALEJA, G.D.HENRY, R.S.HEGDE                               
*REVDAT   1   04-SEP-07 2OQS    0                                                



! NOE constraints for the structure calculation of hDLG_PDZ2 in complex with 18E6CT peptide

! HPV 18 E6 C-terminal peptide (R301R302E303T304Q305V306)  
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
! R301              intermolecular NOE= 6    
assign (resid 301 and name HG# and segid B) (resid 23 and name HN and segid A) 4.00 2.00 2.00 ! R301HG#-N-HN (0.55 117.00 8.26) 
assign (resid 301 and name HB# and segid B) (resid 23 and name HN and segid A) 4.00 2.00 2.00 ! R301HG#-N-HN (1.79 117.00 8.26) 
assign (resid 301 and name HD# and segid B) (resid 23 and name HN and segid A) 4.00 2.00 2.00 ! R301HD#-N-HN (3.76 117.00 8.26) 
assign (resid 301 and name HA and segid B) (resid 23 and name HA and segid A) 4.00 2.00 2.00 !  4.47 4.02
assign (resid 301 and name HA and segid B) (resid 24 and name HN and segid A) 4.00 2.00 2.00 !  4.506 10.22
assign (resid 301 and name HB# and segid B) (resid 24 and name HN and segid A) 4.00 2.00 2.00 !  1.78 10.22
! R302              intermolecular NOE= 2   HA=4.16    HB#=1.68?
assign (resid 302 and name HA and segid B) (resid 22 and name HB# and segid A) 3.58 1.80 1.80 !  4.164 2.49
assign (resid 302 and name HD# and segid B) (resid 67 and name HD2 and segid A) 3.50 1.50 1.80 !  2.81, 6.377
assign (resid 302 and name HG# and segid B) (resid 67 and name HD2 and segid A) 3.50 1.50 1.50 !  1.00, 6.377
assign (resid 302 and name HA and segid B) (resid 302 and name HB# and segid B) 3.58 1.80 1.80 !  4.164 1.681
assign (resid 302 and name HA and segid B) (resid 302 and name HD# and segid B) 4.18 2.00 1.80 !  4.173 3.093
assign (resid 302 and name HA and segid B) (resid 302 and name HG# and segid B) 3.69 1.90 1.80 !  4.168 1.565
assign (resid 302 and name HD# and segid B) (resid 302 and name HB# and segid B) 4.31 2.00 1.80 !  3.092 1.68
assign (resid 302 and name HD# and segid B) (resid 302 and name HG# and segid B) 4.27 2.40 1.50 !  3.09 1.549
assign (resid 302 and name HA and segid B) (resid 303 and name HN and segid B) 4.00 2.00 2.00 !  4.166 8.132
assign (resid 302 and name HG# and segid B) (resid 303 and name HA and segid B) 4.50 2.50 2.00 !  1.02 5.29
! E303     suppose HB1=1.759; HB2=1.688; HG1=1.948; HG2=1.866    intermolecular NOE= 7 
assign (resid 303 and name HA and segid B) (resid 15 and name HB2 and segid A) 4.50 1.50 2.00 ! 2-E3HA-I16HD1 5.294 3.45
assign (resid 303 and name HA and segid B) (resid 15 and name HB1 and segid A) 4.50 1.50 2.00 ! 2-E3HA-S15HB2 5.293 3.37
assign (resid 303 and name HA and segid B) (resid 16 and name HD1# and segid A) 4.50 1.50 1.00 ! 2-E3HA-S15HB2 5.293 0.26
assign (resid 303 and name HG1 and segid B) (resid 17 and name HA and segid A) 4.50 1.50 2.00 ! 2-E3HA-S15HB1 5.294 3.45
assign (resid 303 and name HG2 and segid B) (resid 17 and name HA and segid A) 4.50 1.50 2.00 ! 2-E3HA-S15HB2 5.293 3.37
assign (resid 303 and name HA and segid B) (resid 17 and name HN and segid A) 3.40 1.50 2.00 ! E303HA/G18HA1-A17HN 5.29 8.998
assign (resid 303 and name HA and segid B) (resid 17 and name HA and segid A) 2.52 0.60 1.00 ! A17HA-2-E3HA 5.03 5.294
assign (resid 303 and name HA and segid B) (resid 17 and name HB# and segid A) 2.62 0.80 1.50 ! A17HB#-2-E3HA 1.163 5.293
assign (resid 303 and name HA and segid B) (resid 67 and name HD2 and segid A) 4.70 2.00 1.50 ! very weak! E303HA/G18HA1-H67HD2 5.294 6.377
assign (resid 303 and name HA and segid B) (resid 67 and name HE1 and segid A) 3.31 1.00 1.00 ! !E303HA/G18HA1-H67HE1 5.295 7.612
assign (resid 303 and name HG# and segid B) (resid 67 and name HE1 and segid A) 4.50 2.50 1.00 ! ! E303HA/G18HA1-H67HE1 1.95 7.617
assign (resid 303 and name HB# and segid B) (resid 67 and name HE1 and segid A) 4.50 2.00 1.00 ! !E303HA/G18HA1-H67HE1 1.756 7.612
assign (resid 303 and name HB1 and segid B) (resid 303 and name HA and segid B) 2.61 0.80 1.50 ! 2-E3HB1-HA 1.759 5.293
assign (resid 303 and name HB2 and segid B) (resid 303 and name HA and segid B) 2.46 0.60 1.50 ! 2-E3HB2-HA 1.688 5.294
assign (resid 303 and name HG1 and segid B) (resid 303 and name HA and segid B) 2.68 0.80 1.50 ! 2-E3HG1-HA 1.948 5.294
assign (resid 303 and name HG2 and segid B) (resid 303 and name HA and segid B) 2.82 1.00 1.50 ! 2-E3HG3-HA 1.866 5.293
assign (resid 303 and name HA and segid B) (resid 304 and name HG2# and segid B) 4.00 1.00 2.00 ! 2-E3HB1-HA 1.759 5.293
! T304   intermolecular NOE= 21 
assign (resid 304 and name HG2# and segid B) (resid 15 and name HA and segid A) 3.13 1.00 1.50 !  1.1 5.708
assign (resid 304 and name HB and segid B) (resid 16 and name HD1# and segid A) 2.49 0.80 1.50 ! I16HD1#-2-T4HB 0.268 3.451
assign (resid 304 and name HG2# and segid B) (resid 16 and name HD1# and segid A) 4.00 2.00 1.50 !  1.10 0.265
assign (resid 304 and name HA and segid B) (resid 67 and name HE1 and segid A) 3.50 1.70 1.50 ! 2-T4HA-H67HE1 4.23 7.613
assign (resid 304 and name HB and segid B) (resid 67 and name HD2 and segid A) 2.91 1.00 1.40 ! 2-T4HB-H67HD2 3.453 6.378
assign (resid 304 and name HB and segid B) (resid 67 and name HE1 and segid A) 2.53 0.80 1.50 ! 2-T4HB-H67HE1 3.453 7.613
assign (resid 304 and name HG2# and segid B) (resid 67 and name HE1 and segid A) 2.17 0.37 2.02 ! 2-T4HG#-H67HE1 1.081 7.604
assign (resid 304 and name HG2# and segid B) (resid 67 and name HD2 and segid A) 3.00 1.20 2.00 ! 2-T4HB-H67HD2 1.107 6.378
assign (resid 304 and name HG2# and segid B) (resid 71 and name HA and segid A) 3.50 1.50 2.00 ! 71HA-304HG2#   1.10 3.453
assign (resid 304 and name HB and segid B) (resid 71 and name HG2# and segid A) 3.67 1.87 2.00 ! 71HA-304HG2#   0.549 3.453
assign (resid 304 and name HA and segid B) (resid 304 and name HB and segid B) 2.50 0.80 1.00 ! 2-T4HA-HB 4.474 3.455
assign (resid 304 and name HG2# and segid B) (resid 304 and name HA and segid B) 2.86 1.00 0.70 ! 2-T4HG2#-HA 1.1 4.466
assign (resid 304 and name HG2# and segid B) (resid 304 and name HB and segid B) 2.00 0.25 0.70 ! 2-T4HG#-HB 1.1 3.452
assign (resid 304 and name HA and segid B) (resid 304 and name HN and segid B) 4.00 2.00 2.00 !  4.229 7.873
assign (resid 304 and name HG2# and segid B) (resid 306 and name HG2# and segid B) 3.00 1.00 1.50 !  -0.179 1.1
! Q305  intermolecular NOE= 12   HA=4.531
assign (resid 305 and name HA and segid B) (resid 15 and name HA and segid A) 2.00 0.26 1.00 !  4.531 5.707
assign (resid 305 and name HB1 and segid B) (resid 15 and name HA and segid A) 4.50 2.50 1.50 !  5.709 1.75
assign (resid 305 and name HB2 and segid B) (resid 15 and name HA and segid A) 4.50 2.50 1.50 !  5.709 1.571
assign (resid 305 and name HA and segid B) (resid 15 and name HB2 and segid A) 4.35 2.50 1.22 !  4.533 3.408
assign (resid 305 and name HA and segid B) (resid 15 and name HB1 and segid A) 4.50 2.50 1.73 !  4.533 3.361
assign (resid 305 and name HA and segid B) (resid 15 and name HN and segid A) 2.44 0.64 2.00 !  4.538 8.602
assign (resid 305 and name HG1 and segid B) (resid 15 and name HA and segid A) 2.83 1.00 1.00 ! 2-Q5HG1-S15HA 2.116 5.706
assign (resid 305 and name HG2 and segid B) (resid 15 and name HA and segid A) 2.60 0.80 1.30 ! 2-Q5HG3-S15HA 1.997 5.708
assign (resid 305 and name HB# and segid B) (resid 15 and name HB1 and segid A) 4.50 2.50 1.50 !  1.75  3.36
assign (resid 305 and name HG1 and segid B) (resid 37 and name HD1# and segid A) 3.00 1.00 2.00 ! 2-Q5HG3-I37HD1# 2.116 0.468
assign (resid 305 and name HG2 and segid B) (resid 37 and name HD1# and segid A) 3.00 1.00 1.50 ! 2-Q5HG3-I37HD1# 1.997 0.468
assign (resid 305 and name HA and segid B) (resid 305 and name HB1 and segid B) 4.02 2.50 1.00!  4.532 1.752
assign (resid 305 and name HA and segid B) (resid 305 and name HB2 and segid B) 3.92 2.00 1.00!  4.526 1.561
assign (resid 305 and name HA and segid B) (resid 305 and name HG1 and segid B)  4.50 2.50 1.70 ! 2-Q5HG1-HA 2.119 4.534
assign (resid 305 and name HA and segid B) (resid 305 and name HG2 and segid B) 4.07 2.00 1.50!  4.532 2.003
assign (resid 305 and name HA and segid B) (resid 306 and name HG2# and segid B) 4.50 2.00 1.50!  4.53 -0.182
! V306  switch to HG2#=-0.179 HG1#=0.488 TO CONSISTENT WITH THE MODEL!   intermolecular NOE= 25 
assign (resid 306 and name HN and segid B) (resid 14 and name HN and segid A) 3.50 1.16 1.50 !(9.057  118.3 7.74)
assign (resid 306 and name HG2# and segid B) (resid 14 and name HN and segid A) 3.50 1.16 1.50 !  (-0.18 118.3 7.74)
assign (resid 306 and name HG2# and segid B) (resid 14 and name HA and segid A) 3.50 1.16 1.50 !  4.987 -0.18
assign (resid 306 and name HG2# and segid B) (resid 14 and name HD# and segid A) 2.38 0.60 1.00 ! 2-V6HG2#-F14HD# -0.179 6.613
assign (resid 306 and name HG2# and segid B) (resid 14 and name HN and segid A) 3.13 1.00 1.48 ! 2V6HG2#-F14N-HN (-0.20 118.20 7.74) 45700000
assign (resid 306 and name HG2# and segid B) (resid 14 and name HE# and segid A) 2.08 0.27 1.00 ! 2-V6HG2#-F14HE# -0.18 
assign (resid 306 and name HG2# and segid B) (resid 14 and name HZ and segid A) 2.08 0.27 1.60 ! 2-V6HG2#-F14HE# -0.18 6.69
assign (resid 306 and name HG1# and segid B) (resid 15 and name HN and segid A) 4.00 1.00 2.00 ! 2-V6HG1#-S15HN 0.488 8.602
assign (resid 306 and name HG2# and segid B) (resid 15 and name HN and segid A) 4.00 1.00 1.00 ! 2-V6HG1#-S15HN -0.179 8.602
assign (resid 306 and name HG1# and segid B) (resid 15 and name HA and segid A) 2.86 1.00 2.00 ! 2-V6HG1#-S15HA 0.488 5.707
assign (resid 306 and name HG2# and segid B) (resid 15 and name HA and segid A) 2.80 1.00 1.00 ! 2-V6HG2#-S15HA -0.179 5.708
assign (resid 306 and name HG2# and segid B) (resid 15 and name HB2 and segid A) 4.50 2.00 1.00! 2-V6HG2#-S15HB1 -0.179 3.44
assign (resid 306 and name HG2# and segid B) (resid 15 and name HB2 and segid A) 4.50 2.00 1.50! 2-V6HG2#-S15HB1 -0.179 3.40
assign (resid 306 and name HG2# and segid B) (resid 15 and name HN and segid A) 3.50 1.80 1.50 !  -0.179 8.6
assign (resid 306 and name HB and segid B) (resid 16 and name HN and segid A) 5.00 3.00 1.50 ! 2V6HB-I16N-HN (1.88 114.10 8.56) 3277351
assign (resid 306 and name HG2# and segid B) (resid 16 and name HN and segid A) 3.19 1.30 1.50 ! 2V6HG2#-I16N-HN (-0.22 114.15 8.55) 40900000
assign (resid 306 and name HG2# and segid B) (resid 16 and name HD1# and segid A) 2.63 0.70 1.33 ! 2-V6HG2#-I16HD1# -0.182 0.266
assign (resid 306 and name HG2# and segid B) (resid 16 and name HA and segid A) 3.45 1.65 1.46 !  -0.178 5.622
assign (resid 306 and name HG2# and segid B) (resid 16 and name HD1# and segid A) 3.50 1.50 1.50 !  -0.178 0.26
assign (resid 306 and name HG2# and segid B) (resid 16 and name HG1# and segid A) 3.50 1.50 1.50 !  -0.178 1.52
assign (resid 306 and name HG2# and segid B) (resid 74 and name HA and segid A) 2.99 1.20 1.80 ! 2-V6HG2#-L74HA -0.179 3.783
assign (resid 306 and name HG2# and segid B) (resid 74 and name HN and segid A) 3.18 1.30 1.80 ! 2-V6HG2#-L74HN -0.18 7.791
assign (resid 306 and name HG2# and segid B) (resid 74 and name HD2# and segid A) 3.20 1.40 1.80 ! 2-V6HG2#-L74HN -0.18 0.98
assign (resid 306 and name HG1# and segid B) (resid 74 and name HD2# and segid A) 3.20 1.40 1.80 ! 2-V6HG2#-L74HN 0.495 0.98
assign (resid 306 and name HG1# and segid B) (resid 75 and name HN and segid A) 3.50 1.00 2.00 ! 2-V6HG2#-K75HN 0.495 8.50
assign (resid 306 and name HG2# and segid B) (resid 305 and name HB1 and segid B) 2.26 0.40 2.30 ! 2-V6HG2#-2-Q5HB1 -0.179 1.748
assign (resid 306 and name HA and segid B) (resid 306 and name HN and segid B) 4.50 2.50 1.70 ! 2-V6HA-HN 4.515 8.87
assign (resid 306 and name HB and segid B) (resid 306 and name HA and segid B) 2.31 0.50 0.70 ! 2-V6HB-HA 1.854 4.172
assign (resid 306 and name HB and segid B) (resid 306 and name HG1# and segid B) 4.50 2.50 1.70 ! 2-V6HB-HG1# 1.846 0.488
assign (resid 306 and name HG1# and segid B) (resid 306 and name HA and segid B) 2.29 0.49 1.30 ! 2-V6HG1#-HA 0.496 4.173
assign (resid 306 and name HG1# and segid B) (resid 306 and name HG2# and segid B) 4.50 2.50 1.70 ! 2-V6HG1#-HG2# 0.493 -0.183
assign (resid 306 and name HG2# and segid B) (resid 306 and name HA and segid B) 2.68 0.81 1.33 ! 2-V6HG2#-HA -0.179 4.172
assign (resid 306 and name HG2# and segid B) (resid 306 and name HB and segid B) 2.20 0.40 1.27 ! 2-V6HG2#-HB -0.179 1.854
assign (resid 306 and name HG2# and segid B) (resid 306 and name HN and segid B) 3.50 1.80 1.50 ! 2-V6HG2#-HN -0.19 8.88
assign (resid 306 and name HG1# and segid B) (resid 71 and name HA and segid A) 3.00 1.20 1.50 ! 2-V6HG2#-L74HN 0.494 2.95
assign (resid 306 and name HG2# and segid B) (resid 71 and name HA and segid A) 3.00 1.20 2.00 ! 2-V6HG2#-V71HA -0.178 2.951
assign (resid 306 and name HG1# and segid B) (resid 74 and name HA and segid A) 3.00 1.20 2.50 ! 2-V6HG2#-L74HA 0.494 3.783
assign (resid 306 and name HG1# and segid B) (resid 75 and name HE# and segid A) 3.00 1.20 1.50 ! 2-V6HG2#-L74HN 0.494 2.72
assign (resid 306 and name HG1# and segid B) (resid 304 and name HB and segid B) 3.00 1.20 1.50 ! 2-V6HG2#-T304HB 0.494 3.45

! HDLG PDZ2 domain (the residues from 318 to 406 with a GlySer link to His6 tag)

!M1   HA=3.92, HB=2.10, 1.80; HG=2.19, 2.33
assign (resid 1 and name HA and segid A) (resid 2 and name HA and segid A) 3.50 1.00 1.50 ! 3.913 5.154 
assign (resid 1 and name HA and segid A) ((resid 2 and name HB# and segid A) or (resid 2 and name HG# and segid A)) 3.50 1.50 2.50 ! 3.913 1.92
! E2
assign (resid 2 and name HA and segid A) (resid 2 and name HB# and segid A) 4.04 2.00 1.00 !  5.157 2.061
assign (resid 2 and name HA and segid A) (resid 2 and name HN and segid A) 4.92 2.50 1.00 ! E2HA-N-HN (5.19 127.30 8.89) 3056645
assign (resid 2 and name HB# and segid A) (resid 2 and name HN and segid A) 3.88 2.00 1.55 ! E2HB#-N-HN (1.90 127.30 8.91) 12605822
assign (resid 2 and name HA and segid A) (resid 3 and name HA and segid A) 5.00 3.00 2.00 !  5.145 4.097
assign (resid 2 and name HA and segid A) (resid 3 and name HN and segid A) 2.04 0.26 1.00 ! E2HA-I3N-HN (5.19 126.10 8.97) 594000000
assign (resid 2 and name HB# and segid A) (resid 3 and name HN and segid A) 2.44 0.66 1.00 ! E2HB#-I3N-HN (1.93 126.20 8.97) 205000000
assign (resid 2 and name HA and segid A) (resid 82 and name HD# and segid A) 4.50 2.50 1.80 !  5.145 7.01
assign (resid 2 and name HB# and segid A) (resid 82 and name HD# and segid A) 3.50 1.50 1.50 !  2.06 7.01
assign (resid 2 and name HG# and segid A) (resid 82 and name HD# and segid A) 3.50 1.50 1.50 !  1.97 7.01
assign (resid 2 and name HA and segid A) (resid 83 and name HN and segid A) 4.00 2.00 1.50 !L83HB1-E2HA  5.15 9.386
assign (resid 2 and name HA and segid A) (resid 83 and name HB1 and segid A) 5.00 2.00 1.50 !L83HB1-E2HA  1.603 5.153
assign (resid 2 and name HA and segid A) (resid 84 and name HN and segid A) 4.50 2.50 1.50 ! 
assign (resid 2 and name HA and segid A) (resid 84 and name HB# and segid A) 4.59 2.50 1.50 !  5.151 1.602
assign (resid 2 and name HA and segid A) (resid 84 and name HG1 and segid A) 5.00 3.00 2.00 !  5.152 1.464
assign (resid 2 and name HA and segid A) (resid 84 and name HG2 and segid A) 4.86 3.00 1.50 !  5.154 1.388
assign (resid 2 and name HA and segid A) (resid 84 and name HA and segid A) 2.46 0.60 1.50 ! K84HA-E2HA  4.952 5.153
assign (resid 2 and name HB1 and segid A) (resid 84 and name HA and segid A) 4.97 3.00 2.00 !K84HA-E2HB1  4.953 2.058
assign (resid 2 and name HB2 and segid A) (resid 84 and name HA and segid A) 5.04 3.00 2.00 !K84HA-E2HB2  4.953 1.823
assign (resid 2 and name HG2 and segid A) (resid 84 and name HA and segid A) 5.09 3.00 2.00 !K84HA-E2HG2  4.951 1.911
! I3 
assign (resid 3 and name HB and segid A) (resid 3 and name HA and segid A) 4.21 2.00 1.00 !  1.406 4.097
assign (resid 3 and name HD1# and segid A) (resid 3 and name HA and segid A) 4.54 2.50 1.91 !  0.528 4.091
assign (resid 3 and name HG2# and segid A) (resid 3 and name HA and segid A) 3.93 2.00 1.68 !  0.664 4.091
assign (resid 3 and name HA and segid A) (resid 3 and name HN and segid A) 2.69 1.00 1.00 ! I3HA-N-HN (4.09 126.20 8.97) 114000000
assign (resid 3 and name HG2# and segid A) (resid 3 and name HN and segid A) 2.00 0.26 1.80 ! I3?HD1#-I3N-HN (0.61 126.20 8.96) 789000000
assign (resid 3 and name HB and segid A) (resid 3 and name HN and segid A) 2.06 0.27 1.00 ! I3HB-N-HN (1.42 126.20 8.97) 567000000
assign (resid 3 and name HG1# and segid A) (resid 3 and name HN and segid A) 2.63 0.80 1.35 ! I3HG2#-N-HN (1.16 126.20 8.97) 130000000
assign (resid 3 and name HA and segid A) (resid 4 and name HA and segid A) 5.00 2.00 2.00 !  K4HA-I3HA 4.866 4.097
assign (resid 3 and name HA and segid A) (resid 4 and name HN and segid A) 2.20 0.40 1.00 ! I3HA-K4N-HN (4.12 129.20 8.42) 828000000
assign (resid 3 and name HG2# and segid A) (resid 4 and name HN and segid A) 2.19 0.27 1.50 ! I3HG2#/HD1#-K4N-HN (0.66 129.20 8.42) 395000000
assign (resid 3 and name HB and segid A) (resid 4 and name HN and segid A) 2.00 0.26 2.50 !mixed  I3?HB/K4HG#?-K4N-HN (1.43 129.20 8.42) 804000000
assign (resid 3 and name HN and segid A) (resid 83 and name HN and segid A) 3.50 1.50 1.50 ! G21?HN/L83-I3N-HN (9.411 126.10 8.97) 5299884
assign (resid 3 and name HD1# and segid A) (resid 83 and name HN and segid A) 4.50 2.50 2.00 ! I3HD1#-L83HN 0.523 9.367
assign (resid 3 and name HB and segid A) (resid 83 and name HN and segid A) 2.72 1.00 1.70 ! L5HB1/I3HB-L83HN 1.411 9.385
assign (resid 3 and name HD1# and segid A) (resid 85 and name HA and segid A) 4.00 2.16 2.00 !  0.535 5.058
! K4                   
assign (resid 4 and name HA and segid A) (resid 4 and name HB1 and segid A) 3.66 1.50 1.50 !  4.866 1.512
assign (resid 4 and name HA and segid A) (resid 4 and name HB2 and segid A) 3.68 1.50 1.50 !  4.862 1.402
assign (resid 4 and name HA and segid A) (resid 4 and name HG# and segid A) 3.62 1.50 1.50 !  4.869 0.641
assign (resid 4 and name HA and segid A) (resid 4 and name HN and segid A) 2.00 0.25 1.36 ! K4HA-N-HN (4.83 129.11 8.42) 1120000000
assign (resid 4 and name HG# and segid A) (resid 4 and name HN and segid A) 2.00 0.26 2.50!mixed  I3?HB/K4HG#?-K4N-HN (1.43 129.20 8.42) 804000000
assign (resid 4 and name HA and segid A) (resid 5 and name HN and segid A) 2.42 0.60 1.20 ! K4HA-L5HN 4.869 8.94
assign (resid 4 and name HB# and segid A) (resid 82 and name HD# and segid A) 3.50 1.50 1.80 ! K4?HB#/L83HG-L83HN 1.400 9.386
! L5             HD##=0.75      
assign (resid 5 and name HA and segid A) (resid 5 and name HN and segid A) 2.22 0.48 1.20 ! L5HA-N-HN (4.69 125.40 8.93) 364000000
assign (resid 5 and name HB1 and segid A) (resid 5 and name HN and segid A) 2.50 0.70 1.50 ! L5HB1-N-HN (1.42 125.40 8.93) 763000000
assign (resid 5 and name HB2 and segid A) (resid 5 and name HN and segid A) 2.24 0.44 1.50 ! L5HB2-HN 1.073 8.937
assign (resid 5 and name HD## and segid A) (resid 5 and name HN and segid A) 2.04 0.26 2.50 ! L5HD##-N-HN (0.63 125.40 8.93) 608000000
assign (resid 5 and name HD## and segid A) (resid 42 and name HA and segid A) 3.00 2.00 2.00 !  0.76 4.144
assign (resid 5 and name HD## and segid A) (resid 45 and name HB1 and segid A) 3.50 1.49 1.50 !  0.753 2.633
assign (resid 5 and name HD## and segid A) (resid 45 and name HB2 and segid A) 3.50 1.49 1.50 !  0.753 2.30
assign (resid 5 and name HD## and segid A) (resid 45 and name HN and segid A) 2.46 0.60 2.40  ! L5HD2#?/HG2#-D45N-HN (0.72 117.04 7.37) 193000000
assign (resid 5 and name HA and segid A) (resid 81 and name HG1# and segid A) 3.20 1.00 2.00 !  4.669 0.751
assign (resid 5 and name HA and segid A) (resid 81 and name HZ and segid A) 4.00 1.00 1.00 !  4.669 7.19
assign (resid 5 and name HN and segid A) (resid 83 and name HN and segid A) 3.20 1.00 2.00 !  8.94 8.39
! I6              
assign (resid 6 and name HA and segid A) (resid 6 and name HG2# and segid A) 4.88 2.00 1.50 !  1.282 4.314
assign (resid 6 and name HA and segid A) (resid 6 and name HB and segid A) 3.50 1.70 1.50 !  4.321 1.552
assign (resid 6 and name HA and segid A) (resid 6 and name HG2# and segid A) 3.08 1.30 1.00 !  4.32 0.613
assign (resid 6 and name HB and segid A) (resid 6 and name HN and segid A) 2.00 0.25 2.03 ! I6HB#-N-HN (1.54 121.70 8.11) 1280000000
assign ((resid 6 and name HD1# and segid A) or (resid 6 and name HG2# and segid A)) (resid 6 and name HN and segid A) 2.00 0.25 1.50! I6HD1#-N-HN (0.66 121.70 8.10) 1370000000
assign ((resid 6 and name HD1# and segid A) or (resid 6 and name HG2# and segid A)) (resid 7 and name HN and segid A) 2.36 0.29 1.31 ! I6HD1#-K7N-HN (0.61 127.70 8.46) 253000000
assign (resid 6 and name HN and segid A) (resid 7 and name HN and segid A) 3.09 1.20 1.50 ! I6HN-K7N-HN (8.10 127.64 8.49) 49400000
assign (resid 6 and name HA and segid A) (resid 7 and name HN and segid A) 2.12 0.27 0.60 ! I6HA-K7N-HN (4.35 127.70 8.48) 480000000
assign (resid 6 and name HG1# and segid A) (resid 7 and name HN and segid A) 3.50 1.00 1.50 ! I6HG1#-K7N-HN (0.80 127.64 8.49) 
assign (resid 6 and name HD1# and segid A) (resid 7 and name HN and segid A) 3.50 1.00 1.50 ! I6HG1#-K7N-HN (0.80 127.64 8.49) 
assign ((resid 6 and name HD1# and segid A) or (resid 6 and name HG2# and segid A)) (resid 80 and name HZ and segid A) 2.10 0.27 1.28 ! I6HD1#-F80HZ 0.634 7.185
assign (resid 6 and name HG2# and segid A) (resid 80 and name HE# and segid A) 3.00 1.00 1.50 ! I6HD1#-F80HD# 1.28 6.99
assign (resid 6 and name HG1# and segid A) (resid 80 and name HZ and segid A) 2.67 0.80 1.33 ! I6?HG1#-F80HZ 0.778 7.189
assign (resid 6 and name HB and segid A) (resid 80 and name HZ and segid A) 3.00 1.20 2.00 !  1.531 7.184
assign (resid 6 and name HA and segid A) (resid 80 and name HZ and segid A) 2.93 1.00 1.00 !  V81HA/I6HA -F80hz 4.319 7.189
assign ((resid 6 and name HD1# and segid A) or (resid 6 and name HG2# and segid A)) (resid 80 and name HE# and segid A) 3.00 0.50 1.50 ! I6HD1#-F80HE# 0.634 6.99
assign (resid 6 and name HD1# and segid A) (resid 80 and name HE# and segid A) 3.00 1.00 1.50 ! I6HD1#-F80HE# 0.634 6.99
assign (resid 6 and name HG1# and segid A) (resid 80 and name HE# and segid A) 3.00 1.00 1.50 ! I6HD1#/V81HG1#-F80HE# 0.78 6.99
assign (resid 6 and name HG2# and segid A) (resid 80 and name HE# and segid A) 3.00 1.00 1.50 ! I6HD1#-F80HE# 1.28 6.99
! K7      suppose HA=3.54, HB2=1.677,HB2=1.33 ; HD#=1.13;HG??1=1.415 HG#=0.92; HE#=2.77            
assign (resid 7 and name HB1 and segid A) (resid 7 and name HA and segid A) 2.00 0.25 1.00 ! K7HB1-HA 1.677 3.548
assign (resid 7 and name HB2 and segid A) (resid 7 and name HA and segid A) 2.00 0.24 1.00 ! K7HB2-HA 1.332 3.538
assign (resid 7 and name HG# and segid A) (resid 7 and name HE# and segid A) 3.07 1.00 2.18 !  1.415 2.767
assign (resid 7 and name HD# and segid A) (resid 7 and name HE# and segid A) 3.68 1.80 2.35 !  1.13 2.762
assign (resid 7 and name HE# and segid A) (resid 7 and name HA and segid A) 5.05 2.00 2.00 !  2.762 3.536
assign (resid 7 and name HB1 and segid A) (resid 7 and name HN and segid A) 4.05 2.25 1.20 ! K7HB1-N-HN (1.66 127.70 8.48)
assign (resid 7 and name HB2 and segid A) (resid 7 and name HN and segid A) 2.10 0.27 1.29 ! K7HB2-N-HN (1.33 127.70 8.48)
assign (resid 7 and name HA and segid A) (resid 7 and name HN and segid A) 2.47 0.29 1.32 ! K7HA-N-HN (3.54 127.63 8.48)
assign (resid 7 and name HA and segid A) (resid 8 and name HN and segid A) 2.10 0.25 1.26 ! K7HA-G8N-HN(3.54 112.85 7.38)
assign (resid 7 and name HG# and segid A) (resid 8 and name HN and segid A) 2.00 0.26 3.00 ! K7HB2?-G8N-HN (1.42 112.88 7.38)
assign (resid 7 and name HE# and segid A) (resid 8 and name HN and segid A) 2.20 0.24 1.25 ! K7HE#-G8N-HN (2.78 112.80 7.39) 
assign (resid 7 and name HN and segid A) (resid 8 and name HN and segid A) 4.00 2.00 1.50 !  very week ! K7HN-G8N-HN (8.55 113.00 7.38) 
assign (resid 7 and name HE# and segid A) (resid 11 and name HN and segid A) 3.50 1.00 2.00 !  2.65/2.92  7.87+0.13
assign (resid 7 and name HE# and segid A) (resid 11 and name HA2 and segid A) 2.29 0.28 2.10 !  2.768 3.339  NOE-131
assign (resid 7 and name HE# and segid A) (resid 11 and name HA1 and segid A) 4.44 2.00 2.25 !  G11HA1-K7HE# 4.441 2.765
assign (resid 7 and name HE# and segid A) (resid 11 and name HA2 and segid A) 3.95 2.00 2.20 !  G11HA2-K7HE# 3.344 2.767
assign (resid 7 and name HD# and segid A) (resid 11 and name HA2 and segid A) 3.50 1.50 2.20 !  G11HA2-K7HE# 3.344 1.41
assign (resid 7 and name HG# and segid A) (resid 11 and name HA2 and segid A) 3.50 1.50 2.20 !  G11HA2-K7HE# 3.344 0.92/0.59
assign (resid 7 and name HN and segid A) (resid 79 and name HA and segid A) 3.50 1.50 2.50  ! K7HN-D79HN (4.00 127.7 8.48) 
assign (resid 7 and name HN and segid A) (resid 80 and name HA and segid A) 3.50 1.50 2.00  ! K7HN-F80HA (4.85 127.7 8.48) 
! G8    HA1= 3.897; HA2=4.557              
assign (resid 8 and name HA2 and segid A) (resid 8 and name HN and segid A) 4.32 2.50 1.50! G8HA2-N-HN (4.577 113.25 7.40) 
assign (resid 8 and name HA1 and segid A) (resid 8 and name HN and segid A) 3.80 2.00 1.23 ! G8HA2-N-HN (3.908 112.88 7.38) 
assign (resid 8 and name HA1 and segid A) (resid 9 and name HD1 and segid A) 4.50 2.50 1.70 !  3.893 3.665
assign (resid 8 and name HA1 and segid A) (resid 9 and name HD2 and segid A) 4.50 2.50 1.70 !  3.893 3.533
assign (resid 8 and name HA2 and segid A) (resid 9 and name HD1 and segid A) 4.50 2.50 1.70 !  4.554 3.661
assign (resid 8 and name HA2 and segid A) (resid 9 and name HD2 and segid A) 4.50 2.50 1.70 !  4.556 3.533
assign (resid 8 and name HA2 and segid A) (resid 9 and name HB# and segid A) 4.50 2.50 1.80 !  4.551 1.928
assign (resid 8 and name HN and segid A) (resid 11 and name HN and segid A) 4.69 2.80 1.50 ! G8HN-G11N-HN (7.424 108.22 7.81)
! P9                   
assign (resid 9 and name HA and segid A) (resid 9 and name HD2 and segid A) 4.68 2.50 2.00 !  4.22 3.535
assign (resid 9 and name HB1 and segid A) (resid 9 and name HA and segid A) 2.38 0.29 1.00! P9?HB1-HA 2.282 4.22
assign (resid 9 and name HB1 and segid A) (resid 9 and name HD1 and segid A) 4.89 2.50 1.50 !  2.29 3.662
assign (resid 9 and name HB1 and segid A) (resid 9 and name HD2 and segid A) 4.91 2.50 1.50 !  2.29 3.532
assign (resid 9 and name HB2 and segid A) (resid 9 and name HA and segid A) 2.74 1.00 1.00  ! P9?HB2-HA 1.929 4.221
assign (resid 9 and name HB2 and segid A) (resid 9 and name HD1 and segid A) 3.67 1.80 1.50 !  1.921 3.665
assign (resid 9 and name HB2 and segid A) (resid 9 and name HD2 and segid A) 2.00 0.25 1.00 !  1.929 3.534
assign (resid 9 and name HG# and segid A) (resid 9 and name HA and segid A) 2.53 0.60 2.20 !  1.789 4.22
! K10                   
assign (resid 10 and name HB1 and segid A) (resid 10 and name HA and segid A) 2.00 0.24 1.50 ! K10HB1-HA 1.91 4.373
assign (resid 10 and name HB2 and segid A) (resid 10 and name HA and segid A) 2.00 0.24 1.50 ! K10HB2-HA 1.554 4.365
assign (resid 10 and name HB1 and segid A) (resid 10 and name HE# and segid A) 2.86 1.00 1.80 ! K10HB1-HE# 1.899 2.801
assign (resid 10 and name HB2 and segid A) (resid 10 and name HE# and segid A) 3.79 2.00 1.80 !  1.537 2.803
assign (resid 10 and name HD# and segid A) (resid 10 and name HB1 and segid A) 3.71 2.00 2.20 !  1.173 1.905
assign (resid 10 and name HD# and segid A) (resid 10 and name HA and segid A) 5.05 3.00 2.30 !  1.173 4.373
assign (resid 10 and name HG# and segid A) (resid 10 and name HB1 and segid A) 3.96 2.00 1.80 !  1.271 1.902
assign (resid 10 and name HG# and segid A) (resid 10 and name HA and segid A) 5.00 3.00 2.30 !  1.279 4.37
assign (resid 10 and name HB# and segid A) (resid 11 and name HN and segid A) 4.43 2.63 1.80 ! K10?HB#-G11N-HN (1.439 108.28 7.82) 405000000
assign (resid 10 and name HN and segid A) (resid 11 and name HN and segid A) 4.50 2.50 1.70 ! K10HN-?-063HN (8.352 108.60 7.82) 6229438
! G11               HA2=3.34, HA1=4.44     
assign (resid 11 and name HA1 and segid A) (resid 11 and name HN and segid A) 3.70 1.90 0.98 ! G11HA1-N-HN (4.384 108.27 7.82) 899000000
assign (resid 11 and name HA2 and segid A) (resid 11 and name HN and segid A) 3.55 1.75 1.00 ! G11HA2-N-HN (3.331 108.27 7.82) 769000000
assign (resid 11 and name HN and segid A) (resid 12 and name HN and segid A) 4.95 3.13 1.50 ! L12HN-G11N-HN (11.685 108.11 7.83) 94900000
assign (resid 11 and name HA1 and segid A) (resid 12 and name HN and segid A) 4.49 2.69 1.50 ! G11HA1-L12N-HN (4.454 129.95 11.67) 307000000
assign (resid 11 and name HA2 and segid A) (resid 12 and name HN and segid A) 4.66 2.86 1.50 ! G11HA2-L12N-HN (3.328 129.97 11.67) 196000000
! L12                HD2#=0.74,CD2=23.4;  HD1#=0.63
assign (resid 12 and name HA and segid A) (resid 12 and name HN and segid A) 3.00 1.17 1.00 ! L12HA-N-HN (4.133 129.91 11.67) 117000000
assign (resid 12 and name HB# and segid A) (resid 12 and name HN and segid A) 4.26 2.00 1.80 ! L12HB#-N-HN (1.33 129.94 11.67) 95300000
assign (resid 12 and name HG and segid A) (resid 12 and name HN and segid A) 4.47 2.00 1.50 ! L12HB1-N-HN (1.515 129.92 11.67) 277000000
assign (resid 12 and name HD2# and segid A) (resid 12 and name HN and segid A) 4.82 2.54 2.20 ! L12HD##-N-HN (0.709 129.96 11.67) 213000000
assign (resid 12 and name HA and segid A) (resid 12 and name HB# and segid A) 3.02 1.00 2.10 !  4.14 1.358
assign (resid 12 and name HB# and segid A) (resid 13 and name HA2 and segid A) 4.60 2.50 1.50 !  G13HA2-L12HB# 3.755 1.356
assign (resid 12 and name HD2# and segid A) (resid 13 and name HN and segid A) 4.80 2.50 2.28 ! L12HD##-G13N-HN (0.726 106.26 9.09) 141000000
assign (resid 12 and name HB# and segid A) (resid 13 and name HN and segid A) 4.58 2.79 2.25 ! L12?HB#-G13N-HN (1.31 106.26 9.09) 118000000
assign (resid 12 and name HN and segid A) (resid 13 and name HN and segid A) 3.50 1.70 1.50 ! L12HN-G13N-HN (11.651 106.27 9.09) strong and correct!
! G13  suppose HA1=3.77, HA2=4.299 based on the model
assign (resid 13 and name HA1 and segid A) (resid 13 and name HN and segid A) 4.00 2.00 1.50 ! G13HA1-N-HN (4.299 106.29 9.09) 315000000
assign (resid 13 and name HA2 and segid A) (resid 13 and name HN and segid A) 4.04 2.24 1.50 ! G13HA2-N-HN (3.772 106.25 9.09) 322000000
assign (resid 13 and name HA1 and segid A) (resid 14 and name HN and segid A) 4.00 2.00 1.50 ! G13HA1-F14N-HN (4.287 118.30 7.74) 106000000
assign (resid 13 and name HA2 and segid A) (resid 14 and name HN and segid A) 4.19 2.00 1.50 ! G13HA2-F14N-HN (3.767 117.90 7.74) 111000000
assign (resid 13 and name HN and segid A) (resid 14 and name HN and segid A) 3.90 2.10 1.65 ! F14HN-G13N-HN (7.749 106.27 9.10) 349000000
assign (resid 13 and name HA1 and segid A) (resid 37 and name HN and segid A) 3.00 1.00 1.50 ! G13HA1-I37HN (4.299 126.7  7.79)
assign (resid 13 and name HA2 and segid A) (resid 37 and name HN and segid A) 3.00 1.00 1.50 ! G13HA2-I37HN (3.772 126.7 7.79)
assign (resid 13 and name HA1 and segid A) (resid 37 and name HB and segid A) 3.00 1.00 1.50 ! G13HA1-I37HB 4.299 1.581 
assign (resid 13 and name HA2 and segid A) (resid 37 and name HB and segid A) 3.00 1.00 1.50 ! G13HA2-I37HB 3.772 1.581
assign (resid 13 and name HA1 and segid A) (resid 37 and name HG1# and segid A) 3.50 1.00 1.50 ! G13HA1-I37HG1# 4.299 1.12 
assign (resid 13 and name HA2 and segid A) (resid 37 and name HG1# and segid A) 3.50 1.00 1.50 ! G13HA2-I37HG1# 3.772 1.12
assign (resid 13 and name HN and segid A) (resid 37 and name HG2# and segid A) 3.50 1.00 2.00 ! G13HA1-I37HG1# 9.09 0.70
assign (resid 13 and name HA1 and segid A) (resid 37 and name HG2# and segid A) 3.50 1.00 1.50 ! G13HA1-I37HG1# 4.299 0.70
assign (resid 13 and name HA2 and segid A) (resid 37 and name HG2# and segid A) 3.50 1.00 1.50 ! G13HA2-I37HG1# 3.772 0.70
assign (resid 13 and name HA1 and segid A) (resid 37 and name HD1# and segid A) 3.50 1.00 1.50 ! G13HA1-I37HB 4.299 0.47
assign (resid 13 and name HA2 and segid A) (resid 37 and name HD1# and segid A) 3.50 1.00 1.50 ! G13HA2-I37HB 3.772 0.47

! F14  HB1 and HB2 were stereoassigned! HA=4.96, HB1=3.397; HB2=2.87   
assign (resid 14 and name HA and segid A) (resid 14 and name HN and segid A) 4.37 2.00 1.50 ! F14HA-N-HN (4.929 118.20 7.72) 920000000
assign (resid 14 and name HB2 and segid A) (resid 14 and name HN and segid A) 3.70 1.90 1.50 ! F14HB2-N-HN (2.848 118.20 7.73) 188000000
assign (resid 14 and name HD# and segid A) (resid 14 and name HN and segid A) 4.77 2.00 1.50 ! F14HD#-N-HN (6.638 118.36 7.73) 293000000
!assign (resid 14 and name HZ and segid A) (resid 14 and name HN and segid A) 4.75 1.00 1.00 ! F14HZ?-N-HN (6.96 118.20 7.73) 585000000
assign (resid 14 and name HA and segid A) (resid 14 and name HB1 and segid A) 2.93 1.00 1.00 ! F14HB1-HA 3.398 4.985
assign (resid 14 and name HA and segid A) (resid 14 and name HB2 and segid A) 3.89 2.00 1.50 !  4.987 2.871
assign (resid 14 and name HA and segid A) (resid 14 and name HD# and segid A) 2.32 0.50 2.70 ! F14HA-HD# 4.986 6.614
assign (resid 14 and name HA and segid A) (resid 14 and name HE# and segid A) 3.01 1.00 2.80 ! F14HA-HE# 4.986 6.728
assign (resid 14 and name HB1 and segid A) (resid 14 and name HD# and segid A) 2.07 0.27 2.70 ! F14HB1-HD# 3.397 6.613
assign (resid 14 and name HB1 and segid A) (resid 14 and name HE# and segid A) 2.64 1.00 2.70 ! F14HB1-HE# 3.398 6.727
assign (resid 14 and name HB2 and segid A) (resid 14 and name HA and segid A) 3.08 1.00 1.50 ! F14HB2-HA 2.87 4.985
assign (resid 14 and name HB2 and segid A) (resid 14 and name HD# and segid A) 1.98 0.26 2.70 ! F14HB2-HD# 2.865 6.614
assign (resid 14 and name HB2 and segid A) (resid 14 and name HE# and segid A) 2.76 1.00 2.70 ! F14HB2-HE# 2.87 6.726
assign (resid 14 and name HA and segid A) (resid 15 and name HA and segid A) 3.20 1.40 1.50 ! F14HA-S15HA 4.987 5.704
assign (resid 14 and name HA and segid A) (resid 15 and name HN and segid A) 2.22 0.48 1.00! F14HA-S15HN 4.986 8.601
assign (resid 14 and name HB2 and segid A) (resid 15 and name HN and segid A) 2.42 0.60 1.00 ! F14HB2-S15HN 2.87 8.602
assign (resid 14 and name HD# and segid A) (resid 15 and name HA and segid A) 3.50 1.50 2.40 !  6.615 5.705
assign (resid 14 and name HD# and segid A) (resid 15 and name HN and segid A) 2.50 0.60 2.40! F14HD#-S15HN 6.614 8.6
assign (resid 14 and name HE# and segid A) (resid 15 and name HN and segid A) 3.50 1.00 2.40 ! F14HE#-S15HN 6.723 8.6
assign (resid 14 and name HD# and segid A) (resid 16 and name HA and segid A) 2.98 1.00 2.40 ! I16HA-F14HD# 5.625 6.614
assign (resid 14 and name HE# and segid A) (resid 16 and name HA and segid A) 2.92 1.00 2.40 ! I16HA-F14HE# 5.622 6.727
assign (resid 14 and name HD# and segid A) (resid 16 and name HD1# and segid A) 3.07 1.00 2.40 ! I16HD1#-F14HD 0.268 6.612
assign (resid 14 and name HE# and segid A) (resid 16 and name HD1# and segid A) 2.66 0.80 2.40 ! I16HD1#-F14HE# 0.268 6.723
assign (resid 14 and name HD# and segid A) (resid 33 and name HA and segid A) 2.82 1.00 2.70 ! V33HA-F14HD 4.455 6.54
assign (resid 14 and name HD# and segid A) (resid 33 and name HA and segid A) 2.66 0.86 2.70 ! V33HA-F14HD# 4.461 6.614
assign (resid 14 and name HD# and segid A) (resid 33 and name HG1# and segid A) 3.50 1.50 2.40 .50 ! V33HA-F14HD# 0.649 6.614
assign (resid 14 and name HD# and segid A) (resid 33 and name HG2# and segid A) 3.50 1.50 2.40 ! V33HG2#-F14HD# 0.549 6.614
assign (resid 14 and name HE# and segid A) (resid 33 and name HA and segid A) 3.20 1.20 2.40 ! V33HA-F14HD# 4.461 6.73
assign (resid 14 and name HA and segid A) (resid 36 and name HA and segid A) 2.66 0.80 1.00 ! F14HA-I36HA 4.987 4.237
assign (resid 14 and name HB1 and segid A) (resid 36 and name HA and segid A) 3.50 1.50 1.50 ! F14HB1-I36HA 3.397 4.236
assign (resid 14 and name HA and segid A) (resid 36 and name HD1# and segid A) 4.23 2.00 1.40 !  4.987 0.358
assign (resid 14 and name HA and segid A) (resid 36 and name HG2# and segid A) 4.34 2.00 1.50 !  4.99 0.78
assign (resid 14 and name HA and segid A) (resid 36 and name HG1# and segid A) 4.24 2.00 1.50 !  4.987 0.96
assign (resid 14 and name HD# and segid A) (resid 36 and name HA and segid A) 2.72 0.92 2.40 ! I36HA-F14HD# 4.239 6.613
assign (resid 14 and name HD# and segid A) (resid 36 and name HD1#  and segid A) 2.55 0.60 2.40 ! K75HG#-F14HD# 0.361 6.614
assign (resid 14 and name HB1 and segid A) (resid 36 and name HD1# and segid A) 4.55 2.50 1.98 !I36HD1-F14HB1  0.358 3.399
assign (resid 14 and name HB2 and segid A) (resid 36 and name HD1# and segid A) 4.36 2.00 1.50 !I36HD1-F14HB2  0.361 2.869
assign (resid 14 and name HD# and segid A) (resid 36 and name HG2# and segid A) 2.65 0.89 2.40 ! I36HG2#-F14HD# 0.792 6.612
assign (resid 14 and name HD# and segid A) (resid 36 and name HG1# and segid A) 3.00 1.00 2.40  ! I36HG#-F14HD# 0.967 6.612
assign (resid 14 and name HE# and segid A) (resid 36 and name HD1# and segid A) 3.16 1.00 2.40 ! K75HG#-F14HE# 0.364 6.727
assign (resid 14 and name HA and segid A) (resid 37 and name HD1# and segid A) 3.50 1.50 2.00 ! K75HG#-F14HE# 0.471 4.985
assign (resid 14 and name HA and segid A) (resid 37 and name HN and segid A) 3.50 1.50 1.00 ! I37HN-F14HA (4.97 126.7 7.64) 
assign (resid 14 and name HE# and segid A) (resid 41 and name HB# and segid A)  2.18 0.27 2.40 !A41HB#-f14HE#  1.534 6.72
assign (resid 14 and name HD# and segid A) (resid 41 and name HB# and segid A)  2.50 0.27 2.40 !A41HB#-F14HD#  1.534 6.14
assign (resid 14 and name HD# and segid A) (resid 42 and name HA and segid A) 2.52 0.60 2.40 ! A42/K75HA-F14HD# 4.129 6.614
assign (resid 14 and name HD# and segid A) (resid 42 and name HB# and segid A) 2.00 0.24 3.00 ! A42HB#-F14HD 1.352 6.614
assign (resid 14 and name HE# and segid A) (resid 42 and name HB# and segid A) 2.00 0.25 2.60 ! A42HB#-F14HE# 1.356 6.724
assign (resid 14 and name HB1 and segid A) (resid 48 and name HD2# and segid A) 3.50 1.00 2.00 !  3.396 -0.358
assign (resid 14 and name HB2 and segid A) (resid 48 and name HD2# and segid A) 3.50 1.00 2.00 ! L48HD2#-F14HB2 -0.359 2.87
assign (resid 14 and name HE# and segid A) (resid 48 and name HD2# and segid A) 2.50 0.70 2.40 ! L48HD2#-F14HE# -0.359 6.722
assign (resid 14 and name HD# and segid A) (resid 48 and name HD2# and segid A) 2.50 0.70 2.40 ! L48HD2#-F14HE# -0.359 6.17
assign (resid 14 and name HZ and segid A) (resid 48 and name HD2# and segid A) 3.00 1.00 2.40 ! L48HD2#-F14HE# -0.359 6.69
assign (resid 14 and name HE# and segid A) (resid 48 and name HB# and segid A) 2.50 0.70 2.40 ! L48HB#-F14HE# 1.10 6.17
assign (resid 14 and name HZ and segid A) (resid 48 and name HB# and segid A) 3.50 1.00 2.40 ! L48HB#-F14HZ 1.10 6.69
assign (resid 14 and name HE# and segid A) (resid 54 and name HD1# and segid A) 2.50 0.70 2.40 ! L48HD2#-F14HE# 6.722 0.698
! S15    HN has a very slow exchange rate in D2O, suppose HB2=3.41   HB1=3.358   chi=60             
assign (resid 15 and name HA and segid A) (resid 15 and name HB2 and segid A) 3.90 2.00 1.00 !  5.709 3.409
assign (resid 15 and name HA and segid A) (resid 15 and name HB1 and segid A) 4.04 2.00 1.00 !  5.707 3.364
assign (resid 15 and name HA and segid A) (resid 15 and name HN and segid A) 2.66 0.70 1.00 ! S15HA-HN 5.708 8.603
assign (resid 15 and name HB2 and segid A) (resid 15 and name HA and segid A) 2.50 0.70 1.00 ! S15HB1-HA 3.41 5.707
assign (resid 15 and name HB1 and segid A) (resid 15 and name HA and segid A) 2.40 0.55 1.00 ! S15HB2-HA 3.358 5.707
assign (resid 15 and name HB2 and segid A) (resid 15 and name HN and segid A) 2.08 0.27 1.50 ! S15HB1-HN 3.393 8.601
assign (resid 15 and name HA and segid A) (resid 16 and name HG2# and segid A) 2.25 0.28 1.50 ! I16HG2#-S15HA 0.797 5.707
assign (resid 15 and name HA and segid A) (resid 16 and name HA and segid A) 4.33 2.50 1.50 ! S15HA-I16HA 5.705 5.623
assign (resid 15 and name HB# and segid A) (resid 34 and name HB and segid A) 4.00 2.00 2.30 !  3.363 4.038
assign (resid 15 and name HB# and segid A) (resid 34 and name HN and segid A) 4.50 2.00 1.50 ! S15/F14HB1-T34N-HN (3.409 118.73 8.79) 95500000
assign (resid 15 and name HN and segid A) (resid 35 and name HB# and segid A) 3.00 1.00 2.00 ! K35HB1/HB2-S15HN  1.50/1.58 8.601 ! it is true?
assign (resid 15 and name HN and segid A) (resid 35 and name HN and segid A) 4.23 2.00 1.50 ! K35HN-S15N-HN (7.113 113.86 8.57) 317000000
!assign (resid 15 and name HA and segid A) (resid 35 and name HN and segid A) 4.50 2.50 1.70 ! S15HA-K35N-HN (5.652 120.41 7.07) 1767769
assign (resid 15 and name HB# and segid A) (resid 35 and name HN and segid A) 4.34 2.00 1.50 ! S15HB#-K35N-HN (3.416 120.50 7.08) 366000000
assign (resid 15 and name HA and segid A) (resid 35 and name HB# and segid A) 3.50 1.50 1.80 ! I35HB1/HB2-S15HB1  1.50/1.58 5.71  ! it is true?
assign (resid 15 and name HB# and segid A) (resid 35 and name HB# and segid A) 3.50 1.50 1.80 ! I35HB1/HB2-S15HB1  1.50 3.36! 
assign (resid 15 and name HB# and segid A) (resid 35 and name HG# and segid A) 3.50 1.50 1.80 ! I35HB1/HB2-S15HB1  1.10 3.36! 
assign (resid 15 and name HN and segid A) (resid 36 and name HA and segid A) 3.00 1.00 1.50 ! I36HA-S15HN  4.24 8.601
assign (resid 15 and name HN and segid A) (resid 36 and name HG2# and segid A) 4.76 2.00 1.80 ! I36HG2#-S15HN  0.784 8.601
assign (resid 15 and name HN and segid A) (resid 36 and name HG1# and segid A) 3.00 1.00 1.80 ! weak !I36HG12-S15HN  0.964 8.602
assign (resid 15 and name HN and segid A) (resid 37 and name HN and segid A) 3.33 1.50 1.50 ! I37HN-S15N-HN (7.706 114.00 8.58) 2720000000
! I16                 HD1#=0.268    HG2#=0.793  
assign (resid 16 and name HB and segid A) (resid 16 and name HA and segid A) 2.20 0.27 1.00 ! I16HB-HA 1.7 5.622
assign (resid 16 and name HD1# and segid A) (resid 16 and name HA and segid A) 2.60 0.80 1.60 ! I16HD1#-HA 0.268 5.622
assign (resid 16 and name HD1# and segid A) (resid 16 and name HB and segid A) 2.05 0.26 1.50 ! I16HD1#-HB 0.268 1.7
assign (resid 16 and name HD1# and segid A) (resid 16 and name HG11 and segid A) 2.02 0.26 1.50  ! I16HD1#-HG11 0.269 1.52
assign (resid 16 and name HG1# and segid A) (resid 16 and name HA and segid A) 2.81 1.00 1.50  ! I16HG11-HA 1.517 5.622
assign (resid 16 and name HG2# and segid A) (resid 16 and name HA and segid A) 2.10 0.27 1.50  ! I16HG2#-HA 0.791 5.622
assign (resid 16 and name HA and segid A) (resid 16 and name HN and segid A) 3.80 2.00 1.50 ! I16HA-N-HN (5.671 114.04 8.56) 801000000
assign (resid 16 and name HB and segid A) (resid 16 and name HN and segid A) 4.04 2.00 1.50 ! I16HB-N-HN (1.492 114.10 8.57) 293000000
assign (resid 16 and name HD1# and segid A) (resid 16 and name HN and segid A) 4.70 3.00 1.94 ! I16HD1#-N-HN (0.262 113.90 8.57) 71200000
assign (resid 16 and name HG2# and segid A) (resid 16 and name HN and segid A) 3.70 1.50 1.99 ! I16HG2#-N-HN (0.686 114.00 8.57) 2210000000
assign (resid 16 and name HN and segid A) (resid 17 and name HN and segid A) 5.00 2.00 1.50 ! I16/G18HN-A17N-HN (8.591 
assign (resid 16 and name HA and segid A) (resid 17 and name HA and segid A) 3.12 1.00 1.50 ! A17HA-I16HA 5.03 5.622
assign (resid 16 and name HB and segid A) (resid 17 and name HA and segid A) 4.73 3.00 1.50 !  5.028 1.7
assign (resid 16 and name HG11 and segid A) (resid 17 and name HA and segid A) 5.00 2.00 2.00 !  5.026 1.524
assign (resid 16 and name HA and segid A) (resid 17 and name HB# and segid A) 2.74 1.00 1.50  ! A17HB#-I16HA 1.161 5.621
assign (resid 16 and name HA and segid A) (resid 17 and name HN and segid A) 2.09 0.27 1.00 ! I16HA-A17HN 5.621 8.998
assign (resid 16 and name HB and segid A) (resid 17 and name HN and segid A) 2.33 0.50 1.00 ! I16HB-A17HN 1.7 8.998
assign (resid 16 and name HD1# and segid A) (resid 17 and name HN and segid A) 2.84 1.00 1.50 ! I16HD1#-A17HN 0.267 8.998
assign (resid 16 and name HG1# and segid A) (resid 17 and name HN and segid A) 2.38 0.29 1.80 ! I16HG11-A17HN 1.506 8.984
assign (resid 16 and name HG2# and segid A) (resid 17 and name HN and segid A) 2.77 1.00 1.50 ! I16HG2#-A17HN 0.793 8.998
assign (resid 16 and name HA and segid A) (resid 31 and name HD1# and segid A) 5.00 3.00 2.00 !  5.624 0.376
assign (resid 16 and name HD1# and segid A) (resid 31 and name HA and segid A) 5.00 3.00 2.00 ! I31HA-I16HD1#  4.604 0.269
assign (resid 16 and name HA and segid A) (resid 31 and name HG2# and segid A) 2.39 0.60 1.50 ! I31HG2#-I16HA 0.706 5.622
assign (resid 16 and name HA and segid A) (resid 32 and name HN and segid A) 3.50 1.00 1.50 ! I16HA-Y32HN 5.621 8.271
assign (resid 16 and name HA and segid A) (resid 33 and name HN and segid A) 2.24 0.40 2.00 ! I16HA-V33HN 5.622 8.60
assign (resid 16 and name HA and segid A) (resid 33 and name HA and segid A) 2.40 0.40 1.00 ! V33HA-I16HA 4.461 5.622
assign (resid 16 and name HD1# and segid A) (resid 33 and name HA and segid A) 4.90 3.00 1.50 !V33HA-I16HD1#  4.464 0.268
assign (resid 16 and name HA and segid A) (resid 33 and name HG1# and segid A) 2.43 0.60 1.60 !  V33HG1#-I16HA 0.638 5.622
assign (resid 16 and name HA and segid A) (resid 33 and name HG2# and segid A) 3.00 1.21 1.60 !V71HG2#-I16HA  0.545 5.621! V33 HG# 0.55, 0.64
assign (resid 16 and name HA and segid A) (resid 67 and name HE1 and segid A) 2.99 1.00 2.00 ! I16HA-H67HE1 5.622 7.613
assign (resid 16 and name HB and segid A) (resid 67 and name HE1 and segid A) 3.00 1.00 2.00 ! I16HA-H67HE1 1.70 7.613  ! new added
assign (resid 16 and name HD1# and segid A) (resid 67 and name HD2 and segid A) 2.94 1.00 1.50  ! I16HD1#-H67HD2 0.267 6.377
assign (resid 16 and name HD1# and segid A) (resid 67 and name HE1 and segid A) 2.31 0.50 1.90 ! I16HD1#-H67HE1 0.268 7.612
assign (resid 16 and name HG1# and segid A) (resid 67 and name HE1 and segid A) 2.19 0.40 1.80 ! I16HG11-H67HE1 1.519 7.611
assign (resid 16 and name HD1# and segid A) (resid 70 and name HA and segid A) 2.52 0.60 2.70 ! I16HD1#-A70HA 0.268 3.738
assign (resid 16 and name HD1# and segid A) (resid 71 and name HA and segid A) 2.37 0.60 1.50 ! I16HD1#-V71HA 0.268 2.952
assign (resid 16 and name HD1# and segid A) (resid 71 and name HN and segid A) 2.54 0.80 2.30! I16HD#-V71HN 0.268 8.223
assign (resid 16 and name HD1# and segid A) (resid 74 and name HN and segid A) 2.88 1.08 1.70 ! I16HD1#-L74HN 0.267 7.789
! A17   HN has very slow exchange rate in D2O
assign (resid 17 and name HA and segid A) (resid 17 and name HB# and segid A) 3.28 1.40 1.00 !  5.033 1.165
assign (resid 17 and name HA and segid A) (resid 17 and name HN and segid A) 2.61 0.80 1.00 ! A17HA-HN 5.033 8.997
assign (resid 17 and name HB# and segid A) (resid 17 and name HN and segid A) 2.40 0.70 1.50 ! A17HB#-HN 1.164 8.998
assign (resid 17 and name HB# and segid A) (resid 18 and name HA2 and segid A) 4.00 2.00 1.50 ! A17HB#-G18HA2 1.191 5.223
assign (resid 17 and name HA and segid A) (resid 18 and name HN and segid A) 4.29 2.00 1.50 ! A17HA-G18N-HN (5.045 106.18 8.55) 368000000
assign (resid 17 and name HB# and segid A) (resid 18 and name HN and segid A) 3.97 2.00 2.19 ! A17HB#-G18N-A17HN (1.175 106.24 8.55) 565000000
assign (resid 17 and name HB# and segid A) (resid 24 and name HD2 and segid A) 2.85 1.00 2.00 ! A17HB#-H24HD2? 1.164 5.958
assign (resid 17 and name HB# and segid A) (resid 24 and name HE1 and segid A) 2.41 0.60 1.31 ! A17HB#-H24HE1? 1.164 7.521
assign (resid 17 and name HN and segid A) (resid 31 and name HA and segid A) 3.30 1.00 1.50 ! I31HA-A17HN 4.602 8.998
assign (resid 17 and name HN and segid A) (resid 31 and name HG2# and segid A) 2.15 0.27 1.00 ! I31HG2#-A17HN 0.708 8.997
assign (resid 17 and name HB# and segid A) (resid 31 and name HA and segid A) 3.50 1.50 1.50 ! I31HA-A17HN 1.16  4.602 
assign (resid 17 and name HB# and segid A) (resid 32 and name HA and segid A) 3.50 1.50 2.00! I31HA-A17HN 1.16  5.23
assign (resid 17 and name HB# and segid A) (resid 32 and name HD# and segid A) 3.54 1.50 2.85 !  1.166 6.817
assign (resid 17 and name HB# and segid A) (resid 32 and name HE# and segid A) 4.54 2.50 2.85 !  1.166 6.54  ! new added
assign (resid 17 and name HB# and segid A) (resid 32 and name HN and segid A) 3.28 1.40 1.42 ! A17HB#-Y32HN 1.168 8.274
assign (resid 17 and name HN and segid A) (resid 32 and name HN and segid A) 2.79 1.00 1.00 ! A17HN-Y32HN 8.998 8.271
assign (resid 17 and name HN and segid A) (resid 32 and name HB# and segid A) 3.50 1.50 1.50 ! Y32HB#-A17HN 8.993 2.43/1.79
assign (resid 17 and name HN and segid A) (resid 33 and name HA and segid A) 3.00 1.20 1.50 ! Y32HD#-A17HN 6.816 8.993
assign (resid 17 and name HN and segid A) (resid 34 and name HG2# and segid A) 3.00 1.00 1.50 ! Y32HD#-A17HN 0.63 8.993
assign (resid 17 and name HB# and segid A) (resid 34 and name HG2# and segid A) 3.00 1.00 1.50 ! T34HG2#-A17HB# 0.63 1.16  
assign (resid 17 and name HA and segid A) (resid 67 and name HE1 and segid A) 2.00 0.25 1.00 ! A17HA-H67HE1 5.03 7.613
assign (resid 17 and name HB# and segid A) (resid 67 and name HE1 and segid A) 2.50 0.80 1.50 ! A17HB#-H67HE1 1.164 7.613
assign (resid 17 and name HN and segid A) (resid 67 and name HE1 and segid A) 2.98 1.00 1.50 ! A17HN-H67HE1 8.997 7.612
! G18    HA2= 5.235, HA1 = 4.472 
assign (resid 18 and name HA1 and segid A) (resid 18 and name HN and segid A) 3.00 1.20 1.00 ! G18HA2-N-HN (4.464 106.23 8.55) 285000000
assign (resid 18 and name HA2 and segid A) (resid 18 and name HN and segid A) 3.00 1.00 1.50 ! G18HA1-N-HN (5.287 106.18 8.56) 72600000
assign (resid 18 and name HA1 and segid A) (resid 19 and name HN and segid A) 3.89 2.00 1.50 ! G18?HA2-G19N-HN (4.68 107.62 6.35) 319000000 !correct and mix with others!
assign (resid 18 and name HA2 and segid A) (resid 19 and name HN and segid A) 4.41 2.50 1.50 ! G18HA1-G19N-HN (5.274 107.60 6.34) 530000000
assign (resid 18 and name HN and segid A) (resid 19 and name HN and segid A) 4.00 2.00 1.50 ! G18HN-G19N-HN (8.603 107.58 6.34) 
assign (resid 18 and name HA2 and segid A) (resid 24 and name HB2 and segid A) 3.00 1.00 1.50 !weak! 5.235 2.947
assign (resid 18 and name HA2 and segid A) (resid 24 and name HB1 and segid A) 3.00 1.00 2.00 ! weak H24HB1-G18HA1 3.016 5.234
assign (resid 18 and name HN and segid A) (resid 24 and name HB# and segid A) 4.84 2.00 2.28 ! H24HB#-G18N-HN (2.95 106.17 8.55) 163000000
assign (resid 18 and name HA2 and segid A) (resid 31 and name HD1# and segid A) 2.89 1.00 1.30 ! I31HD1#-Y32HA/G18HA1 0.378 5.233
assign (resid 18 and name HA1 and segid A) (resid 67 and name HE1 and segid A) 3.50 1.50 2.50 ! weak G18HA2-H67HE1 4.466 7.612
assign (resid 18 and name HA2 and segid A) (resid 67 and name HE1 and segid A) 3.50 1.50 2.50 ! weak G18HA2-H67HE1 5.29 7.612
! G19         suppose HA1=4.376 HA2=3.929      ( switch to    HA2=4.376 HA1=3.929  then switch back)
assign (resid 19 and name HA# and segid A) (resid 19 and name HN and segid A) 3.48 1.70 1.50 ! G19HA1-HN 4.382 6.38
assign (resid 19 and name HA# and segid A) (resid 20 and name HN and segid A) 4.04 2.00 1.50 ! G19HA1-V20N-HN (4.44 121.90 8.63) 349000000
assign (resid 19 and name HA# and segid A) (resid 22 and name HN and segid A) 3.48 1.70 1.50 ! 
assign (resid 19 and name HN and segid A) (resid 31 and name HG2# and segid A) 4.50 1.50 2.00 ! very weak peak,I31HG2#-G19N-HN (0.706 107.60 6.35) 
assign (resid 19 and name HN and segid A) (resid 31 and name HD1# and segid A) 4.50 1.50 2.00 ! very weak peak,I31HG2#-G19N-HN (0.36 107.60 6.35) 
! V20      HG1#=0.725, HG2#=0.68          !   
assign (resid 20 and name HB and segid A) (resid 20 and name HA and segid A) 2.38 0.60 1.00 ! V20HB-HA 1.386 3.462
assign (resid 20 and name HG## and segid A) (resid 20 and name HA and segid A) 3.09 1.00 1.38 !  0.709 3.46
assign (resid 20 and name HB and segid A) (resid 20 and name HN and segid A) 3.50 1.50 1.50 ! V20HB-N-HN (1.381 122.00 8.63) true!
assign (resid 20 and name HG2# and segid A) (resid 20 and name HN and segid A) 3.81 2.00 1.50 ! V20HG##-N-HN (0.685 122.00 8.63) 459000000
assign (resid 20 and name HA and segid A) (resid 21 and name HN and segid A) 3.54 1.50 1.50 ! V20HA-G21N-HN (3.44 119.00 9.37) 680000000
assign (resid 20 and name HG1# and segid A) (resid 21 and name HN and segid A) 3.77 2.00 1.50 ! V20HG##-G21N-HN (0.733 119.00 9.37) 482000000
assign (resid 20 and name HA and segid A) (resid 29 and name HA and segid A) 3.00 1.00 2.00 !N29HA#-V20HA 3.462 4.80
assign (resid 20 and name HA and segid A) (resid 29 and name HB# and segid A) 2.50 0.60 1.50 !N29HB#-V20HA 3.462 2.79 
assign (resid 20 and name HA and segid A) (resid 66 and name HG2# and segid A) 4.86 2.50 2.00 !T66HG2#-V20HA  1.194 3.462
! G21                !   
assign (resid 21 and name HA1 and segid A) (resid 21 and name HN and segid A) 3.97 2.00 1.50 ! G21HA1-N-HN (4.118 119.00 9.37) 248000000
assign (resid 21 and name HA2 and segid A) (resid 21 and name HN and segid A) 3.95 2.00 1.50 ! G21HA2-N-HN (3.616 119.00 9.37) 575000000
assign (resid 21 and name HA2 and segid A) (resid 22 and name HN and segid A) 4.87 3.00 1.50 ! G21HA2-N22N-HN (3.508 123.50 8.44) 307000000
assign (resid 21 and name HN and segid A) (resid 22 and name HN and segid A) 3.91 2.00 1.50 ! G21HN-N22N-HN (9.419 123.53 8.46) 319000000
assign (resid 21 and name HN and segid A) (resid 23 and name HG# and segid A) 4.00 2.00 2.00 ! G21HN-N22N-HN (2.54 119 9.37) 319000000
! N22    HB1 and HB2 were stereoassigned!      HB2=2.488  HB1=2.077     chi=60      
assign (resid 22 and name HA and segid A) (resid 22 and name HN and segid A) 3.00 1.20 1.50 ! N22HA-N-HN (4.818 123.50 8.44) 7000986
assign (resid 22 and name HB2 and segid A) (resid 22 and name HN and segid A) 4.27 2.47 1.50 ! N22HB1-N-HN (2.494 123.48 8.46) 400000000
assign (resid 22 and name HA and segid A) (resid 23 and name HN and segid A) 4.75 2.95 1.50 ! N22HA-Q23N-HN (4.828 117.00 8.26) 97400000
assign (resid 22 and name HB2 and segid A) (resid 67 and name HB1 and segid A) 2.63 0.70 1.80 ! N22HB1-H67HB1 2.484 3.348
assign (resid 22 and name HB2 and segid A) (resid 67 and name HB2 and segid A) 4.53 2.00 1.83 ! N22HB1-H67HB2 2.481 2.909
assign (resid 22 and name HB1 and segid A) (resid 67 and name HB1 and segid A) 2.35 0.60 1.60 ! N22HB2-H67HB1 2.101 3.348
assign (resid 22 and name HB1 and segid A) (resid 67 and name HB2 and segid A) 2.64 0.80 1.00 ! N22HB2-H67HB2 2.074 2.911
! Q23 
assign (resid 23 and name HB1 and segid A) (resid 23 and name HG1 and segid A) 2.42 0.70 1.50 !  2.103 2.611
assign (resid 23 and name HG# and segid A) (resid 23 and name HE21 and segid A) 4.50 2.70 1.50 ! Q23HG#-NE-HE21 (2.614 112.70 7.58) 2370000000
assign (resid 23 and name HG# and segid A) (resid 23 and name HE22 and segid A) 4.50 2.70 1.50 ! Q23HG#-NE-HE22 (2.581 112.50 6.92) 223000000
assign (resid 23 and name HA and segid A) (resid 23 and name HN and segid A) 3.95 2.00 1.50 ! Q23HA-N-HN (4.009 117.00 8.26) 955000000
assign (resid 23 and name HA and segid A) (resid 23 and name HE21 and segid A) 4.50 2.00 2.00 ! Q23HA-NE-HE21 (4.009 112.60 7.58) 47400000
assign (resid 23 and name HA and segid A) (resid 23 and name HE22 and segid A) 4.50 2.00 2.00 ! Q23HA-NE-HE22 (4.033 112.50 6.92) 337000000
assign (resid 23 and name HA and segid A) (resid 24 and name HN and segid A) 4.22 2.00 1.50 ! Q23HA-H24N-HN (4.023 124.91 10.21) 277000000
assign (resid 23 and name HB# and segid A) (resid 24 and name HN and segid A) 4.50 2.50 1.50 ! Q23HB#-H24N-HN (2.129 124.89 10.20) 75900000
assign (resid 23 and name HA and segid A) (resid 29 and name HA and segid A) 3.00 1.00 2.00 ! Q23HA-N29HA 4.023 4.80
assign (resid 23 and name HB# and segid A) (resid 29 and name HA and segid A) 3.50 1.00 2.00 ! Q23HA-N29HA 2.10 4.80
assign (resid 23 and name HG# and segid A) (resid 29 and name HA and segid A) 3.00 1.00 2.00 ! Q23HA-N29HA 2.614 4.80
! H24   stereoassigned HB1=3.016; HB2=2.947  
assign (resid 24 and name HA and segid A) (resid 24 and name HB1 and segid A) 3.86 2.00 1.00 !  4.592 3.015
assign (resid 24 and name HA and segid A) (resid 24 and name HB2 and segid A) 3.74 2.00 1.00 !  4.594 2.945
assign (resid 24 and name HA and segid A) (resid 24 and name HD2 and segid A) 2.80 1.00 2.00 ! 2.74 0.32 1.34 !H24HA-HD2? 4.594 5.958
assign (resid 24 and name HA and segid A) (resid 24 and name HE1 and segid A) 3.50 1.50 1.50 ! H24HA-HE1? 4.592 7.521
assign (resid 24 and name HB1 and segid A) (resid 24 and name HD2 and segid A) 2.37 0.60 1.60 ! H24HB1-HD2? 3.017 5.958
assign (resid 24 and name HB1 and segid A) (resid 24 and name HE1 and segid A) 3.50 1.50 1.70 ! H24HB1-HE1? 3.01 7.521
assign (resid 24 and name HB2 and segid A) (resid 24 and name HD2 and segid A) 2.46 0.66 1.60  ! H24HB2-HD2? 2.947 5.957
assign (resid 24 and name HB2 and segid A) (resid 24 and name HE1 and segid A) 3.50 1.50 1.60 ! H24HB2-HE1? 2.938 7.518
assign (resid 24 and name HA and segid A) (resid 24 and name HN and segid A) 4.50 2.50 1.70 ! H24HA-N-HN (4.659 124.92 10.22) 7884482
assign (resid 24 and name HB# and segid A) (resid 24 and name HN and segid A) 4.40 2.00 2.24 ! H24HB#-N-HN (2.955 124.88 10.21) 444000000
assign (resid 24 and name HA and segid A) (resid 25 and name HN and segid A) 4.17 2.00 1.50 ! H24HA-I25N-HN (4.692 118.10 6.87) 311000000
assign (resid 24 and name HB# and segid A) (resid 25 and name HN and segid A) 4.34 2.50 2.24 ! H24HB#-I25N-HN (3.054 118.10 6.87) 458000000
assign (resid 24 and name HN and segid A) (resid 25 and name HN and segid A) 4.00 2.00 1.50 ! H24HN-I25N-HN (10.235 117.89 6.87) 155000000
assign (resid 24 and name HD2 and segid A) (resid 25 and name HA and segid A) 3.50 1.70 2.00 !  weak but correct! I25HA-H24HD2 4.123 5.958
assign (resid 24 and name HD2 and segid A) (resid 25 and name HB and segid A) 2.98 1.18 1.60 ! I25HB-H24HD2? 1.485 5.958
assign (resid 24 and name HD2 and segid A) (resid 25 and name HD1# and segid A) 2.26 0.48 1.60 ! I25HD1#-H24HD2? 0.351 5.958
assign (resid 24 and name HD2 and segid A) (resid 25 and name HG1# and segid A) 2.40 0.60 1.80 ! I25HG#-H24HD2? 0.975 5.958
assign (resid 24 and name HD2 and segid A) (resid 25 and name HG2# and segid A) 2.40 0.60 2.00 ! I25HG2#/I31HG2#-H24HD2? 0.70 5.958
assign (resid 24 and name HA and segid A) (resid 32 and name HD# and segid A) 3.30 1.00 2.50 ! H24HA/I31HA-Y32HE# 4.604 6.813
assign (resid 24 and name HB1 and segid A) (resid 32 and name HD# and segid A) 3.93 2.00 2.40 !  3.015 6.817
assign (resid 24 and name HB1 and segid A) (resid 32 and name HE# and segid A) 4.49 1.50 2.40 !  3.015 6.539
assign (resid 24 and name HB2 and segid A) (resid 32 and name HD# and segid A) 3.91 2.00 2.80!  2.945 6.815
assign (resid 24 and name HB2 and segid A) (resid 32 and name HE# and segid A) 4.69 3.00 2.40  !  2.944 6.539
assign (resid 24 and name HD2 and segid A) (resid 32 and name HD# and segid A) 2.22 0.28 2.70 ! H24HD2?-Y32HD# 5.957 6.818
assign (resid 24 and name HD2 and segid A) (resid 32 and name HE# and segid A) 2.59 0.70 2.40  ! H24HD2?-Y32HE# 5.957 6.54
assign (resid 24 and name HD2 and segid A) (resid 32 and name HN and segid A) 3.34 1.50 1.80 !  5.959 8.271
assign (resid 24 and name HD2 and segid A) (resid 32 and name HA and segid A) 2.89 1.00 2.00 ! Y32HA/G18HA2-H24HD2? 5.228 5.957
assign (resid 24 and name HD2 and segid A) (resid 32 and name HB1 and segid A) 2.50 0.60 2.20 ! strong peak!Y32HB2-H24HD2  2.426 5.957
assign (resid 24 and name HD2 and segid A) (resid 32 and name HB2 and segid A) 2.44 0.60 2.20 ! strong peak! Y32HB1-H24HD2? 1.812 5.957
assign (resid 24 and name HE1 and segid A) (resid 34 and name HB and segid A) 2.71 0.90 1.80 ! T34HB-H24HE1? 4.042 7.521
assign (resid 24 and name HE1 and segid A) (resid 34 and name HA and segid A) 2.95 1.00 1.80 ! T34HA/G19HA1-H24HE1? 4.379 7.521
assign (resid 24 and name HE1 and segid A) (resid 34 and name HG2# and segid A) 2.95 1.00 1.80 ! T34HG2#-H24HE1? 0.63 7.521
! I25               HD1#=0.351 HG2#=0.758, HG1#=0.974
assign (resid 25 and name HA and segid A) (resid 25 and name HN and segid A) 4.27 2.40 1.06 ! I25HA-N-HN (4.116 118.10 6.87) 336000000
assign (resid 25 and name HB# and segid A) (resid 25 and name HN and segid A) 4.24 2.40 2.24 ! I25HB#-N-HN (1.45 118.11 6.87) 561000000
assign (resid 25 and name HD1# and segid A) (resid 25 and name HN and segid A) 4.72 2.70 1.50 ! I25HD1#-N-HN (0.38 118.11 6.87) 62300000
assign (resid 25 and name HA and segid A) (resid 25 and name HB and segid A) 3.54 1.50 1.50 !  4.129 1.486
assign (resid 25 and name HA and segid A) (resid 25 and name HD1# and segid A) 4.00 2.00 1.50 !  4.122 0.351
assign (resid 25 and name HA and segid A) (resid 25 and name HG2# and segid A) 3.07 1.20 1.50 !  4.125 0.758
assign (resid 25 and name HA and segid A) (resid 26 and name HD1 and segid A) 3.00 1.00 1.80 !  4.125 3.608
assign (resid 25 and name HA and segid A) (resid 26 and name HD2 and segid A) 3.00 1.00 1.80 !  4.125 3.384 
assign (resid 25 and name HD1# and segid A) (resid 32 and name HD# and segid A) 2.48 0.70 2.40  ! I25HD1#-Y32HD# 0.355 6.818
assign (resid 25 and name HD1# and segid A) (resid 32 and name HE# and segid A) 2.23 0.50 2.40  ! I25HD1#-Y32HE# 0.352 6.541
assign (resid 25 and name HG1# and segid A) (resid 32 and name HD# and segid A) 2.94 1.00 2.40 ! I31HG12/I25HG#-Y32HD# 0.974 6.818
assign (resid 25 and name HG1# and segid A) (resid 32 and name HE# and segid A) 2.77 1.00 2.40 ! I31HG12/I25HG#-Y32HE# 0.975 6.54
assign (resid 25 and name HG2# and segid A) (resid 32 and name HD# and segid A) 3.00 1.00 2.40 ! I31HG12/I25HG#-Y32HD# 0.70 6.818
assign (resid 25 and name HG2# and segid A) (resid 32 and name HE# and segid A) 3.00 1.00 2.40 ! I31HG12/I25HG#-Y32HE# 0.70 6.54
! P26  suppose       HD1=3.60 HD2=3.384 HB1=2.124, HB2=1.724 HG#=1.92          
assign (resid 26 and name HB# and segid A) (resid 26 and name HA and segid A) 2.11 0.27 1.80 ! P26HB1-HA 2.122 4.032
assign (resid 26 and name HB# and segid A) (resid 26 and name HD# and segid A) 2.96 1.00 1.80 !  2.132 3.384
assign (resid 26 and name HB# and segid A) (resid 26 and name HA and segid A) 2.10 0.30 1.80 ! P26HB2-HA 1.724 4.039
assign (resid 26 and name HG# and segid A) (resid 26 and name HA and segid A) 4.73 2.80 1.94 !  1.916 4.038
assign (resid 26 and name HB1 and segid A) (resid 27 and name HN and segid A) 4.39 2.50 1.50  ! P26HB1-G27N-HN (2.126 112.26 8.18) 242000000
assign (resid 26 and name HB2 and segid A) (resid 27 and name HN and segid A) 4.61 2.50 2.44 ! P26HB2-G27N-HN (1.763 112.30 8.17) 392000000
! G27                   
assign (resid 27 and name HA1 and segid A) (resid 27 and name HN and segid A) 3.33 1.53 1.50 ! G27HA1-N-HN (4.053 112.20 8.18) 869000000
assign (resid 27 and name HA2 and segid A) (resid 27 and name HN and segid A) 3.84 2.00 1.50 ! G27HA2-N-HN (3.665 112.20 8.18) 345000000
assign (resid 27 and name HA1 and segid A) (resid 28 and name HN and segid A) 3.88 2.00 1.50 ! G27HA1-D28N-HN (4.117 121.90 8.07) 345000000
assign (resid 27 and name HA2 and segid A) (resid 28 and name HN and segid A) 4.49 2.69 1.68 ! G27HA2-D28N-HN (3.673 121.86 8.06) 144000000
! D28 HB1 and HB2 were stereoassigned!       HB1=3.11  HB2=2.273   chi=-150      
assign (resid 28 and name HA and segid A) (resid 28 and name HB1 and segid A) 3.96 2.00 1.00 !  4.775 3.129
assign (resid 28 and name HA and segid A) (resid 28 and name HB2 and segid A) 4.50 2.50 1.70 ! D28HB2-HA 2.276 4.777
assign (resid 28 and name HA and segid A) (resid 28 and name HN and segid A) 3.36 1.60 1.00 ! D28HA-N-HN (4.703 121.70 8.07) 1070000000
assign (resid 28 and name HB1 and segid A) (resid 28 and name HN and segid A) 4.02 2.00 1.00 ! D28HB1-?-D28HN (3.104 121.80 8.06) 566000000
assign (resid 28 and name HB2 and segid A) (resid 28 and name HN and segid A) 4.05 2.00 1.00 ! D28HB2-N-HN (2.252 121.90 8.06) 246000000
assign (resid 28 and name HA and segid A) (resid 32 and name HE# and segid A) 3.50 1.80 2.30 ! D28HA-Y32HE# 4.778 6.542
assign (resid 28 and name HB1 and segid A) (resid 32 and name HE# and segid A) 2.50 0.80 1.70 ! D28HB1-Y32HE# 3.111 6.541
assign (resid 28 and name HB2 and segid A) (resid 32 and name HE# and segid A) 3.00 1.20 2.40 ! D28HB2-Y32HE# 2.273 6.541
! N29                   
!assign (resid 29 and name HB# and segid A) (resid 20 and name HA and segid A) 2.12 0.30 2.01 !  2.796 3.464
assign (resid 29 and name HB# and segid A) (resid 29 and name HA and segid A) 3.00 1.00 2.00 !  2.815 4.806
assign (resid 29 and name HA and segid A) (resid 29 and name HN and segid A) 3.62 1.50 1.00 ! N29HA-N-HN (4.823 125.30 9.51) 584000000
assign (resid 29 and name HB# and segid A) (resid 29 and name HN and segid A) 4.24 2.40 1.00 ! N29HB#-N-HN (2.824 125.26 9.51) 760000000
assign (resid 29 and name HB# and segid A) (resid 29 and name HD22 and segid A) 4.50 2.50 2.28 ! N29HB#-ND-HD22 (2.833 119.80 7.13) 326000000
assign (resid 29 and name HB# and segid A) (resid 29 and name HD21 and segid A) 4.50 2.50 2.28 ! N29HB#-ND-HD21 (2.816 119.80 9.10) 581000000
assign (resid 29 and name HB# and segid A) (resid 30 and name HN and segid A) 4.80 3.00 2.28 ! N29HB1-S30N-HN (2.826 116.21 8.77) 1370000000
assign (resid 29 and name HN and segid A) (resid 30 and name HN and segid A) 3.76 2.00 1.50 ! N29HN-?-S30HN (9.509 116.56 8.76) 226000000
assign (resid 29 and name HB# and segid A) (resid 32 and name HE# and segid A) 3.50 1.50 2.40 ! stong peak! 2.80 6.54
! S30     HB1=3.333, HB2=3.634; chi=30              
assign (resid 30 and name HB2 and segid A) (resid 30 and name HA and segid A) 2.48 0.66 1.00 ! S30HB2-HA 3.634 4.219
assign (resid 30 and name HB1 and segid A) (resid 30 and name HA and segid A) 2.52 0.60 1.00 ! S30HB1-HA 3.333 4.22
assign (resid 30 and name HA and segid A) (resid 30 and name HN and segid A) 4.50 2.00 1.50 ! S30HA-N-HN (4.218 116.24 8.76) 306000000
assign (resid 30 and name HB2 and segid A) (resid 30 and name HN and segid A) 4.50 2.00 1.45 ! S30HB1-N-HN (3.643 116.30 8.76) 152000000
assign (resid 30 and name HB1 and segid A) (resid 30 and name HN and segid A) 4.50 2.00 1.00 ! S30HB2-N-HN (3.321 116.30 8.75) 101000000
assign (resid 30 and name HA and segid A) (resid 31 and name HN and segid A) 2.56 0.60 0.60 ! S30HB#-I31HN 4.221 9.249
assign (resid 30 and name HB2 and segid A) (resid 31 and name HN and segid A) 3.02 1.00 1.00 ! S30HB2-I31HN 3.624 9.247
assign (resid 30 and name HB1 and segid A) (resid 31 and name HN and segid A) 2.93 1.00 0.60 ! S30HB1-I31HN 3.328 9.248
assign (resid 30 and name HA and segid A) (resid 32 and name HD# and segid A) 3.05 1.00 2.70 ! S30HA-Y32HD# 4.22 6.822
assign (resid 30 and name HA and segid A) (resid 32 and name HE# and segid A) 2.56 0.60 2.70 ! S30HA-Y32HE# 4.22 6.541
assign (resid 30 and name HB2 and segid A) (resid 32 and name HD# and segid A) 2.46 0.66 2.70 ! S30HB2-Y32HD# 3.623 6.819
assign (resid 30 and name HB2 and segid A) (resid 32 and name HE# and segid A) 2.00 0.26 2.60 ! S30HB2-Y32HE# 3.622 6.542
assign (resid 30 and name HB1 and segid A) (resid 32 and name HD# and segid A) 2.75 1.00 2.70 ! S30HB1-Y32HD# 3.328 6.818
assign (resid 30 and name HB1 and segid A) (resid 32 and name HE# and segid A) 2.15 0.27 2.60 ! S30HB1-Y32HE# 3.328 6.542
assign (resid 30 and name HB1 and segid A) (resid 54 and name HN and segid A) 4.00 1.00 1.50 ! S30HB1-L54HN 3.328 8.36
assign (resid 30 and name HB2 and segid A) (resid 54 and name HN and segid A) 4.00 1.00 1.50 ! S30HB1-L54 HN 3.62 8.36 
! I31 13C-CT-HSQC suppose HD1#= 0.378    HG11=0.98, HG12=1.844, HG2#=0.70, HD1#=0.378, HB=2.11  
assign (resid 31 and name HA and segid A) (resid 31 and name HB and segid A) 4.44 2.60 1.00 !  4.604 2.107
assign (resid 31 and name HA and segid A) (resid 31 and name HD1# and segid A) 3.49 1.70 1.50 !  4.604 0.379
assign (resid 31 and name HA and segid A) (resid 31 and name HG11 and segid A) 4.50 2.00 1.50 !  4.604 0.976
assign (resid 31 and name HA and segid A) (resid 31 and name HG12 and segid A) 4.61 2.50 2.46 !  4.604 1.83
assign (resid 31 and name HA and segid A) (resid 31 and name HG2# and segid A) 4.50 2.50 1.70 ! I31HG2#-HA 0.704 4.603
assign (resid 31 and name HA and segid A) (resid 31 and name HN and segid A) 3.33 1.50 1.50 ! I31HA-HN 4.605 9.248
assign (resid 31 and name HB and segid A) (resid 31 and name HN and segid A) 2.84 1.00 1.00 ! I31HB-HN 2.104 9.249
assign (resid 31 and name HD1# and segid A) (resid 31 and name HN and segid A) 3.20 1.40 1.50 ! I31HD1#-HN 0.383 9.249
assign (resid 31 and name HG1# and segid A) (resid 31 and name HN and segid A) 3.06 1.20 1.50 ! I31HG12?-HN 1.844 9.25
assign (resid 31 and name HG2# and segid A) (resid 31 and name HN and segid A) 3.28 1.40 1.50 ! I31HG2#-HN 0.688 9.247
assign (resid 31 and name HB and segid A) (resid 31 and name HG1# and segid A) 3.93 2.00 1.50 !  0.972 2.106
assign (resid 31 and name HB and segid A) (resid 31 and name HG2# and segid A) 3.55 1.50 1.50 !  0.7 2.106
assign (resid 31 and name HB and segid A) (resid 31 and name HD1# and segid A) 4.00 2.00 1.50 !  0.378 2.106
assign (resid 31 and name HD1# and segid A) (resid 31 and name HG1# and segid A) 3.88 2.00 1.50 !  0.381 1.853
assign (resid 31 and name HA and segid A) (resid 32 and name HA and segid A) 3.00 1.20 1.65 ! A WEAK PEAK! V31HA/H24HA-Y32HA 4.584 5.227 (not H24HA)
assign (resid 31 and name HA and segid A) (resid 32 and name HB2 and segid A) 3.50 1.80 2.00 !  4.604 2.426
assign (resid 31 and name HA and segid A) (resid 32 and name HD# and segid A) 2.00 0.25 1.80 ! I31HA-Y32HD# 4.591 6.819
assign (resid 31 and name HA and segid A) (resid 32 and name HE# and segid A) 3.00 1.00 2.00 ! I31HA/H24HA/I31HA-Y32HE# 4.604 6.539
assign (resid 31 and name HA and segid A) (resid 32 and name HN and segid A) 2.09 0.27 1.00 ! I31HA-Y32HN 4.603 8.27
assign (resid 31 and name HB and segid A) (resid 32 and name HN and segid A) 2.88 1.00 1.50 ! I31HB-Y32HN 2.103 8.266
assign (resid 31 and name HD1# and segid A) (resid 32 and name HN and segid A) 3.00 1.00 1.80 ! I31HD1#-Y32HN 0.38 8.267
assign (resid 31 and name HB and segid A) (resid 54 and name HN and segid A) 3.00 1.00 1.00 ! L54HB1-I31HB  1.322 2.106
assign (resid 31 and name HB and segid A) (resid 54 and name HB1 and segid A) 4.40 2.50 1.50 ! L54HB1-I31HB  1.322 2.106
assign (resid 31 and name HB and segid A) (resid 54 and name HB2 and segid A) 4.50 2.50 1.50 ! L54HB2-I31HB  1.053 2.103
assign (resid 31 and name HD1# and segid A) (resid 70 and name HA and segid A) 2.18 0.27 2.80 ! I31HD1#-A70HA 0.377 3.731
assign (resid 31 and name HB and segid A) (resid 70 and name HA and segid A) 3.00 1.00 1.50 ! I31HB-A70HA 2.10 3.731
assign (resid 31 and name HG1# and segid A) (resid 70 and name HA and segid A) 3.00 1.00 1.50 ! I31HB-A70HA 1.85 3.731
assign (resid 31 and name HD1# and segid A) (resid 70 and name HN and segid A) 2.79 1.00 1.90 ! I31HD1#-A70HN 0.376 7.785
assign (resid 31 and name HG1# and segid A) (resid 70 and name HB# and segid A) 4.36 2.50 1.50 !A70HB#-I31HG11  1.104 1.853
assign (resid 31 and name HD1# and segid A) (resid 70 and name HB# and segid A) 2.50 0.50 1.50 !I31HD1#-A70HB# (K75HG#-2-T4HG2#) 0.372 1.105
! Y32 HB1 and HB2 were stereoassigned!       HB1=2.426,  HB2=1.813     switched    
assign (resid 32 and name HA and segid A) (resid 32 and name HB1 and segid A) 2.65 1.00 1.00 ! Y32HB1-HA 2.427 5.223
assign (resid 32 and name HA and segid A) (resid 32 and name HB2 and segid A) 4.29 2.00 1.09 !  5.225 1.81
assign (resid 32 and name HA and segid A) (resid 32 and name HD# and segid A) 2.50 0.80 2.40 ! Y32HA-HD# 5.226 6.817
assign (resid 32 and name HA and segid A) (resid 32 and name HN and segid A) 2.44 0.60 1.00 ! Y32HA-HN 5.229 8.27
assign (resid 32 and name HB1 and segid A) (resid 32 and name HD# and segid A) 2.10 0.26 2.40 ! Y32HB2-HD# 2.426 6.817
assign (resid 32 and name HB1 and segid A) (resid 32 and name HE# and segid A) 2.48 0.60 2.40 ! Y32HB2-HE# 2.426 6.54
assign (resid 32 and name HB1 and segid A) (resid 32 and name HN and segid A) 4.14 2.00 1.50 ! Y32HB1-N-HN (2.47 123.89 8.26) 63600000
assign (resid 32 and name HB2 and segid A) (resid 32 and name HD# and segid A) 2.00 0.26 2.40 ! Y32HB1-HD# 1.812 6.817
assign (resid 32 and name HB2 and segid A) (resid 32 and name HE# and segid A) 2.43 0.60 2.40 ! Y32HB1-HE# 1.812 6.54
assign (resid 32 and name HB2 and segid A) (resid 32 and name HN and segid A) 2.04 0.26 1.80 ! Y32HB1-HN 1.82 8.264
assign (resid 32 and name HD# and segid A) (resid 32 and name HN and segid A) 2.50 0.60 2.40 ! Y32HD#-HN 6.817 8.27
assign (resid 32 and name HE# and segid A) (resid 32 and name HN and segid A) 3.12 1.00 2.40 ! Y32HE#-HN 6.542 8.269
assign (resid 32 and name HN and segid A) (resid 33 and name HN and segid A) 3.14 1.34 1.40 ! V33HN-Y32HN 8.594 8.269
assign (resid 32 and name HA and segid A) (resid 33 and name HA and segid A) 2.95 1.00 1.40 !  5.234 4.475
assign (resid 32 and name HA and segid A) (resid 33 and name HN and segid A) 2.13 0.27 1.20 ! Y32HA-V33HN 5.224 8.597
assign (resid 32 and name HB1 and segid A) (resid 33 and name HN and segid A) 2.41 0.60 1.00 ! Y32HB2-V33HN 2.432 8.599
assign (resid 32 and name HB2 and segid A) (resid 33 and name HN and segid A) 2.48 0.60 1.80 ! Y32HB1-V33HN 1.808 8.597
assign (resid 32 and name HA and segid A) (resid 33 and name HB and segid A) 3.50 1.50 1.40 !weak peak! ! V33HB-Y32HA 2.043 5.226
assign (resid 32 and name HA and segid A) (resid 33 and name HG2# and segid A) 3.59 1.50 1.50 ! V33HG2#-Y32HA 0.551 5.222
assign (resid 32 and name HD# and segid A) (resid 51 and name HA1 and segid A) 3.50 1.50 1.50 ! G51HA1-Y32HD# 4.352 6.806
assign (resid 32 and name HE# and segid A) (resid 51 and name HA1 and segid A) 3.50 1.50 1.80 ! G51HA1-Y32HE# 4.346 6.538
assign (resid 32 and name HD# and segid A) (resid 51 and name HA2 and segid A) 2.65 0.80 1.00 ! G51HA1-Y32HD# 3.511 6.818
assign (resid 32 and name HE# and segid A) (resid 51 and name HA2 and segid A) 3.50 1.50 1.50 ! weak! G51HA1-Y32HE# 3.512 6.539
assign (resid 32 and name HA and segid A) (resid 52 and name HN and segid A) 4.50 2.50 1.50 
assign (resid 32 and name HD# and segid A) (resid 53 and name HA and segid A) 4.04 2.00 2.40 ! K53HA-Y32HD# 4.547 6.817
assign (resid 32 and name HE# and segid A) (resid 53 and name HA and segid A) 2.47 0.60 2.40 ! K53HA-Y32HE# 4.546 6.541
assign (resid 32 and name HE# and segid A) (resid 53 and name HB# and segid A) 2.10 0.26 2.40 ! K53HB#-Y32HE# 1.51 6.541
assign (resid 32 and name HD# and segid A) (resid 53 and name HB# and segid A) 3.50 1.50 2.40 ! K53HB#-Y32HD#  1.506 6.819
assign (resid 32 and name HD# and segid A) (resid 53 and name HD# and segid A) 2.64 0.80 2.40 ! I16HG2#-Y32HD# 0.782 6.817---K53
assign (resid 32 and name HE# and segid A) (resid 53 and name HD# and segid A) 2.10 0.26 2.40 ! I16HG2#-Y32HE# 0.791 6.541
assign (resid 32 and name HD# and segid A) (resid 53 and name HG# and segid A) 4.00 2.16 2.40 !  1.401 6.819 
assign (resid 32 and name HA and segid A) (resid 54 and name HN and segid A) 2.54 0.80 2.00 ! Y32HA-L54HN 5.226 8.358 it seems strong and correct!
assign (resid 32 and name HD# and segid A) (resid 54 and name HN and segid A) 2.92 1.30 1.70 ! Y32HD#-L54HN 6.818 8.357
assign (resid 32 and name HE# and segid A) (resid 54 and name HN and segid A) 3.28 1.30 1.42 ! Y32HE#-L54HN 6.542 8.358
assign (resid 32 and name HE# and segid A) (resid 88 and name HB# and segid A) 4.00 2.00 1.50 ! Y32HE#-L54HN 6.542 2.17
assign (resid 32 and name HE# and segid A) (resid 88 and name HG# and segid A) 3.50 1.50 1.50 ! Y32HE#-L54HN 6.542 1.94
! V33    BASED ON 13-CT-HSQC HG1# =0.648            HG2#=0.549 
assign (resid 33 and name HA and segid A) (resid 33 and name HG1# and segid A) 3.43 1.50 1.50 !  4.463 0.648
assign (resid 33 and name HA and segid A) (resid 33 and name HG2# and segid A) 3.29 1.40 1.50 !  4.463 0.549
assign (resid 33 and name HA and segid A) (resid 33 and name HN and segid A) 2.41 0.60 1.00 ! V33HA-HN 4.462 8.598
assign (resid 33 and name HB and segid A) (resid 33 and name HN and segid A) 2.23 0.50 1.00 ! V33HB-HN 2.037 8.597
assign (resid 33 and name HG1# and segid A) (resid 33 and name HN and segid A) 3.97 2.00 1.50 !  0.651 8.598
assign (resid 33 and name HG2# and segid A) (resid 33 and name HN and segid A) 3.76 1.50 1.50 !  0.548 8.598
assign (resid 33 and name HB and segid A) (resid 34 and name HN and segid A) 4.50 2.50 1.50 ! V33HB-T34N-HN (2.021 118.60 8.78) 9630000
assign (resid 33 and name HG2# and segid A) (resid 34 and name HN and segid A) 3.70 1.50 1.56 ! V33HG2#-T34N-HN (0.606 118.70 8.76) 333000000
assign (resid 33 and name HA and segid A) (resid 34 and name HN and segid A) 3.55 1.50 1.80 ! V33/T34HA-T34N-HN (4.47 118.70 8.76) 457000000
assign (resid 33 and name HA and segid A) (resid 48 and name HD2# and segid A) 3.50 1.16 2.00 !  4.457 -0.358
assign (resid 33 and name HN and segid A) (resid 48 and name HD2# and segid A) 3.50 1.34 2.00 ! L48HD1#?-V33HN  -0.358 8.6
assign (resid 33 and name HN and segid A) (resid 50 and name HA and segid A) 3.50 1.50 2.00! I50HA-V33HN 3.184 8.599!? possibly something else
assign (resid 33 and name HB and segid A) (resid 50 and name HA and segid A) 2.33 0.60 1.00 ! 33HB/Q49?HG1-I50HA 2.039 3.184
assign (resid 33 and name HG1# and segid A) (resid 50 and name HA and segid A) 3.24 1.00 1.50 !  0.647 3.184
assign (resid 33 and name HG2# and segid A) (resid 50 and name HA and segid A) 4.48 2.00 1.60 !  0.546 3.184
assign (resid 33 and name HG## and segid A) (resid 52 and name HN and segid A) 3.92 2.00 1.50 ! V33HG##-D52N-HN (0.582 121.91 7.75) 
assign (resid 33 and name HN and segid A) (resid 52 and name HN and segid A) 3.92 2.00 1.50 ! V33HN-D52N-HN 8.60 7.77 
! T34       HA=4.36 HB=4.04     HG2#=0.63      
assign (resid 34 and name HB and segid A) (resid 34 and name HA and segid A) 2.70 0.90 0.80 ! T34HB-HA 4.042 4.38
assign (resid 34 and name HB and segid A) (resid 34 and name HG2# and segid A) 2.20 0.50 1.50 ! T34HB-HA 4.042 0.63
assign (resid 34 and name HB and segid A) (resid 35 and name HN and segid A) 5.00 3.00 1.50 ! T34HB-K35N-HN (4.019 120.45 7.06) 38300000
assign (resid 34 and name HN and segid A) (resid 35 and name HN and segid A) 3.56 1.80 1.50 ! T34HN-K35N-HN (8.801 120.48 7.07) 591000000
assign (resid 34 and name HA and segid A) (resid 35 and name HN and segid A) 3.99 2.00 1.50 ! T34/K35HA-K35N-HN (4.362 120.50 7.08) 594000000
assign (resid 34 and name HA and segid A) (resid 50 and name HG2# and segid A) 4.50 2.50 1.50 ! !  T34HA-50HG2# 0.734 4.377
! K35 
assign (resid 35 and name HB# and segid A) (resid 35 and name HN and segid A) 4.03 2.00 1.50 ! K35HB#-N-HN (1.533 120.51 7.08) 387000000
assign (resid 35 and name HN and segid A) (resid 36 and name HN and segid A) 3.81 2.00 1.50 ! I36HN-K35N-HN (8.589 120.50 7.08) 497000000
! I36     CG2=16.8, HG2#=0.79;CD1=11.3, HD1#=0.361; HG1#=0.96               
assign (resid 36 and name HA and segid A) (resid 36 and name HB and segid A) 3.95 2.15 1.50 !  4.237 1.742
assign (resid 36 and name HA and segid A) (resid 36 and name HD1# and segid A) 3.55 1.80 1.80 !  4.232 0.362
assign (resid 36 and name HA and segid A) (resid 36 and name HG2# and segid A) 3.47 1.50 1.50 !  4.233 0.78
assign (resid 36 and name HA and segid A) (resid 36 and name HG1# and segid A) 3.53 1.50 1.50 !  4.23 0.962
assign (resid 36 and name HA and segid A) (resid 36 and name HN and segid A) 3.42 1.00 1.50 ! I36HA-N-HN (4.253 123.70 8.51) 1090000000
assign (resid 36 and name HB and segid A) (resid 36 and name HN and segid A) 3.86 1.50 1.50 ! I36HB-N-HN (1.577 123.89 8.49) 4210000000
assign (resid 36 and name HD1# and segid A) (resid 36 and name HN and segid A) 4.08 2.28 1.81 ! I36HD1#-N-HN (0.741 123.79 8.49) 368000000
assign (resid 36 and name HA and segid A) (resid 37 and name HN and segid A) 3.71 1.50 1.50 ! I36HA-I37N-HN (4.238 126.61 7.64) 521000000
assign (resid 36 and name HN and segid A) (resid 37 and name HN and segid A) 4.50 2.00 1.50 ! I36HN-I37N-HN (8.587 126.62 7.64) 49300000
assign (resid 36 and name HB and segid A) (resid 43 and name HD2 and segid A) 3.00 1.00 1.50 !  1.73 7.047
assign (resid 36 and name HD1# and segid A) (resid 43 and name HD2 and segid A) 3.00 1.00 1.50 !  0.361 7.047
assign (resid 36 and name HG2# and segid A) (resid 43 and name HD2 and segid A) 2.09 0.27 1.50 ! I36?HG2#-H43HD2 0.781 7.047
assign (resid 36 and name HG2# and segid A) (resid 43 and name HA and segid A) 2.50 0.50 2.00 ! I36?HG2#-H43HD2 0.781 4.00
assign (resid 36 and name HG1# and segid A) (resid 48 and name HD2# and segid A) 3.50 1.50 1.50 !  0.962 -0.36
assign (resid 36 and name HD1# and segid A) (resid 48 and name HD2# and segid A) 3.00 1.00 1.50 !  0.357 -0.36
assign (resid 36 and name HG2# and segid A) (resid 48 and name HD2# and segid A) 3.00 1.00 2.00 !  0.78 -0.36
assign (resid 36 and name HD1# and segid A) (resid 48 and name HG and segid A) 3.00 1.00 1.50 !  0.357 1.205
assign (resid 36 and name HD1# and segid A) (resid 49 and name HA and segid A) 3.50 1.00 1.50 ! Q49HA-I36HD1# 4.4 0.362
assign (resid 36 and name HD1# and segid A) (resid 49 and name HN and segid A) 3.50 1.00 1.50 ! Q49HN-I36HD1# 8.65 0.362
assign (resid 36 and name HD1# and segid A) (resid 50 and name HA and segid A) 4.40 2.60 1.50 !  0.358 3.181
! I37        CG2=16.48, HG2#=0.71; CD1=9.78, HD1#=0.47     
assign (resid 37 and name HA and segid A) (resid 37 and name HB and segid A) 3.61 1.80 1.50 !  3.852 1.58
assign (resid 37 and name HA and segid A) (resid 37 and name HD1# and segid A) 2.30 0.50 1.50 ! I37HD1#-HA 0.47 3.851
assign (resid 37 and name HA and segid A) (resid 37 and name HG2# and segid A) 2.90 1.00 1.50 !  3.852 0.706
assign (resid 37 and name HN and segid A) (resid 37 and name HB and segid A) 2.36 0.60 1.30 !  1.605 7.813   ! I37HB-N-HN (1.551 126.62 7.64) 359000000
assign (resid 37 and name HA and segid A) (resid 37 and name HG1# and segid A) 2.69 1.00 1.50 ! I37HG12?-HA 0.959 3.849
assign (resid 37 and name HA and segid A) (resid 37 and name HN and segid A) 4.62 2.50 1.50 ! I37HA-N-HN (3.882 126.63 7.64) 268000000
assign (resid 37 and name HD1# and segid A) (resid 37 and name HN and segid A) 3.89 2.00 1.66 ! I37HD1#-N-HN (0.471 126.60 7.65) 308000000
assign (resid 37 and name HG1# and segid A) (resid 37 and name HN and segid A) 4.50 1.50 1.50 ! I37HG-N-HN (1.124 126.60 7.65) 91400000
assign (resid 37 and name HG2# and segid A) (resid 37 and name HN and segid A) 4.00 2.10 2.00 ! I37HG2#-N-HN (0.719 126.60 7.64) 93900000
assign (resid 37 and name HA and segid A) (resid 38 and name HN and segid A) 3.28 1.00 1.50 ! I37HA-E38N-HN (3.888 133.40 9.08) 1370000000
assign (resid 37 and name HD1# and segid A) (resid 38 and name HN and segid A) 4.29 2.00 1.50 ! I37HD1#-E38N-HN (0.479 133.40 9.08) 194000000
assign (resid 37 and name HG2# and segid A) (resid 38 and name HN and segid A) 4.50 2.50  2.10 ! I37HG#-E38N-HN (1.174 133.60 9.08) 135000000
assign (resid 37 and name HN and segid A) (resid 38 and name HN and segid A) 5.00 2.00 1.50 ! I37HN-E38N-HN (7.647 133.41 9.08) 62000000
! E38                   
assign (resid 38 and name HB1 and segid A) (resid 38 and name HA and segid A) 2.00 0.25 1.20 ! E38HB1-HA 1.713 2.967
assign (resid 38 and name HB2 and segid A) (resid 38 and name HA and segid A) 2,00 0.23 1.20 ! E38HB2-HA 1.648 2.963
assign (resid 38 and name HG# and segid A) (resid 38 and name HA and segid A) 2.00 0.26 1.80 ! E38HG#-HA 1.884 2.956
assign (resid 38 and name HA and segid A) (resid 38 and name HN and segid A) 4.17 2.00 1.50 ! E38HA-N-HN (2.964 133.41 9.08) 360000000
assign (resid 38 and name HG# and segid A) (resid 38 and name HN and segid A) 4.37 2.00 1.80 ! E38HG2-N-HN (1.873 133.41 9.08) 216000000
assign (resid 38 and name HB# and segid A) (resid 38 and name HN and segid A) 3.24 1.00 1.80 ! E38HB#-N-HN (1.662 133.40 9.09) 921000000
assign (resid 38 and name HN and segid A) (resid 39 and name HN and segid A) 4.00 1.50 1.50 ! E38HN-G39N-HN (9.064 116.56 9.46) 915000000
assign (resid 38 and name HA and segid A) (resid 39 and name HN and segid A) 3.53 1.50 1.50 ! E38HA-G39N-HN (2.978 116.56 9.46) 915000000
assign (resid 38 and name HB# and segid A) (resid 39 and name HN and segid A) 4.48 2.00 1.80  ! E38HB#-G39N-HN (1.676 116.56 9.46) 214000000
assign (resid 38 and name HG# and segid A) (resid 39 and name HN and segid A) 4.50 2.00 1.80 ! E38HG#-G39N-HN (1.9 116.53 9.46) 103000000
assign (resid 38 and name HA and segid A) (resid 43 and name HD2 and segid A) 2.62 0.80 1.50 ! E38HA-H43HD2 2.965 7.047
assign (resid 38 and name HA and segid A) (resid 43 and name HE1 and segid A) 2.38 0.60  2.50 ! E38HA-H43HE1 2.962 7.661  ! a strong peak!
assign (resid 38 and name HB1 and segid A) (resid 43 and name HE1 and segid A) 4.61 2.00 2.52 !  1.707 7.66
assign (resid 38 and name HB2 and segid A) (resid 43 and name HE1 and segid A) 4.48 2.00 2.00  !  1.649 7.661
assign (resid 38 and name HG# and segid A) (resid 43 and name HE1 and segid A) 2.12 0.27 1.80 !  1.878 7.661
assign (resid 38 and name HG# and segid A) (resid 43 and name HD2 and segid A) 3.50 1.50 1.80 !  1.878 7.045
! G39         from the model structure HA1=4.128, HA2=3.751       !   
assign (resid 39 and name HN and segid A) (resid 40 and name HN and segid A) 3.00 1.00 1.00 ! G39HN-G40N-HN (9.533 106.70 7.63) 315000000
assign (resid 39 and name HA1 and segid A) (resid 40 and name HN and segid A) 3.50 1.50 1.50 ! G39HN-G40HN 4.13 7.66
assign (resid 39 and name HA2 and segid A) (resid 40 and name HN and segid A) 3.50 1.50 1.50 ! G39HN-G40HN 3.73 7.66
assign (resid 39 and name HA1 and segid A) (resid 43 and name HE1 and segid A) 4.00 2.34 1.50 ! G39HA1-H43HE1    4.128 7.66
assign (resid 39 and name HA2 and segid A) (resid 43 and name HE1 and segid A) 3.00 2.19 1.50 ! G39HA2-H43HE1 3.751 7.66
! G40                !   
assign (resid 40 and name HA1 and segid A) (resid 40 and name HN and segid A) 2.50 0.80 1.00 ! G40/G39HA1-G40N-HN (4.143 106.67 7.63) 475000000
assign (resid 40 and name HA2 and segid A) (resid 40 and name HN and segid A) 2.50 0.80 1.00 ! G40/G39HA2-G40N-HN (3.799 106.66 7.64) 612000000
assign (resid 40 and name HN and segid A) (resid 41 and name HN and segid A) 4.00 2.00 1.50 ! A41HN-G40N-HN (8.57 106.45 7.63) 79000000
assign (resid 40 and name HA1 and segid A) (resid 41 and name HN and segid A) 4.22 2.00 1.50 ! G40HA1-A41N-HN (4.118 120.50 8.57) 340000000
assign (resid 40 and name HA2 and segid A) (resid 41 and name HN and segid A) 4.06 2.00 1.50 ! G40HA2-A41N-HN (3.892 120.40 8.57) 818000000
assign (resid 40 and name HN and segid A) (resid 43 and name HB# and segid A) 2.00 0.30 1.00 ! G40HA2-A41N-HN (3.892 120.40 8.57) 818000000
! A41                   
assign (resid 41 and name HB# and segid A) (resid 41 and name HA and segid A) 2.00 0.26 1.00 ! A41HB#-HA 1.531 3.97
assign (resid 41 and name HN and segid A) (resid 41 and name HB# and segid A) 3.38 1.50 1.50 ! A41HB#-N-HN (1.536 120.40 8.57) 972000000
assign (resid 41 and name HB# and segid A) (resid 42 and name HN and segid A) 4.50 2.50 1.70 ! A41HB#-A42N-HN (1.536 119.70 8.13) 16785468
assign (resid 41 and name HN and segid A) (resid 42 and name HN and segid A) 4.50 2.50 1.70 ! A41HN-A42N-HN (8.589 119.70 8.13) 6944912
assign (resid 41 and name HA and segid A) (resid 44 and name HB# and segid A) 3.50 1.50 1.70 ! A41HA-K44HB# 3.97 1.70
! A42                   
assign (resid 42 and name HB# and segid A) (resid 42 and name HA and segid A) 2.00 0.25 1.24 ! A42HB#-HA 1.36 4.145
assign (resid 42 and name HA and segid A) (resid 42 and name HN and segid A) 4.04 2.00 1.00 ! A42HA-N-HN (4.133 119.70 8.12) 369000000
assign (resid 42 and name HB# and segid A) (resid 42 and name HN and segid A) 4.50 2.50 1.70 ! A42HB#-N-HN (1.331 119.70 8.13) 21318288
assign (resid 42 and name HB# and segid A) (resid 43 and name HN and segid A) 4.34 2.00 1.50  ! A42HB#-H43N-HN (1.331 125.37 9.71) 336000000
assign (resid 42 and name HN and segid A) (resid 43 and name HN and segid A) 4.44 2.64 1.50 ! A42HN-H43N-HN (8.128 125.33 9.71) 72600000
assign (resid 42 and name HB# and segid A) (resid 45 and name HN and segid A) 4.54 2.00 2.00 ! A42?/K44HB#-D45N-HN (1.383 117.02 7.37) 271000000
assign (resid 42 and name HA and segid A) (resid 45 and name HN and segid A) 4.50 2.00 1.50 ! A42HA-D45N-HN (4.006 116.99 7.36) 59100000
assign (resid 42 and name HA and segid A) (resid 45 and name HB2 and segid A) 4.00 2.00 2.00 ! D45HB2-A42HA 2.632 4.147
assign (resid 42 and name HA and segid A) (resid 45 and name HB1 and segid A) 4.00 2.00 2.00 ! D45HB1-A42HA  2.293 4.146
assign (resid 42 and name HN and segid A) (resid 46 and name HN and segid A) 4.50 2.00 1.50 ! A42?HN-G46N-HN (8.355 103.62 7.32) 209000000
assign (resid 42 and name HB# and segid A) (resid 46 and name HN and segid A) 4.50 2.00 1.50 ! A42?HB#-G46N-HN (1.333 103.62 7.32) 209000000
assign (resid 42 and name HB# and segid A) (resid 48 and name HD2# and segid A) 2.00 0.26 1.50 ! L48HD2#-A42HB# -0.358 1.357
assign (resid 42 and name HB# and segid A) (resid 48 and name HD2# and segid A) 3.00 1.00 1.50 ! L48HD2#-A42HA -0.358 4.145
! H43     stereoassignment HB1= 3.05; HB2=3.13             
assign (resid 43 and name HA and segid A) (resid 43 and name HD2 and segid A) 2.60 0.80 1.50 ! H43HA-HD2 4.005 7.047
assign (resid 43 and name HB# and segid A) (resid 43 and name HA and segid A) 2.27 0.50 1.80 ! H43HB1-HA 3.127 4.003
assign (resid 43 and name HB# and segid A) (resid 43 and name HD2 and segid A) 2.38 0.50 1.80 ! H43HB1-HD2 3.132 7.047
assign (resid 43 and name HB# and segid A) (resid 43 and name HE1 and segid A) 4.50 2.00 1.80 ! very weak H43HB1-HE1 3.122 7.661
assign (resid 43 and name HA and segid A) (resid 43 and name HN and segid A) 4.47 2.60 1.57 ! H43HA-N-HN (4.018 125.40 9.71) 236000000
assign (resid 43 and name HB# and segid A) (resid 43 and name HN and segid A) 3.89 2.09 1.80 ! H43HB1-N-HN (3.088 125.52 9.72) 531000000
assign (resid 43 and name HA and segid A) (resid 44 and name HN and segid A) 3.50 1.50 1.50 ! H43HA-K44N-HN (4.016 118.20 8.30) 15870186
assign (resid 43 and name HB# and segid A) (resid 44 and name HN and segid A) 3.50 1.50 1.80 ! H43HB1-K44N-HN (3.101 118.20 8.30) 9433689
assign (resid 43 and name HN and segid A) (resid 44 and name HN and segid A) 3.50 1.00 1.50 ! K44HN-H43N-HN (8.32 125.31 9.72) 195000000
assign (resid 43 and name HE1 and segid A) (resid 44 and name HA and segid A) 3.50 1.00 2.00 ! K44HN-H43N-HN 7.66 3.64
assign (resid 43 and name HE1 and segid A) (resid 44 and name HG# and segid A) 3.50 1.00 2.00 ! 7.66 1.50
assign (resid 43 and name HE1 and segid A) (resid 44 and name HE# and segid A) 4.50 1.00 2.00 ! 7.66 2.83
! K44                   
assign (resid 44 and name HB# and segid A) (resid 44 and name HA and segid A) 2.00 0.25 2.06 ! K44HB#-HA 1.708 3.636
assign (resid 44 and name HD# and segid A) (resid 44 and name HA and segid A) 3.70 1.00 2.35 !  1.295 3.636
assign (resid 44 and name HE# and segid A) (resid 44 and name HA and segid A) 5.00 1.16 2.30 !  2.832 3.638
assign (resid 44 and name HG1 and segid A) (resid 44 and name HA and segid A) 4.04 1.50 1.50 !  1.506 3.638
assign (resid 44 and name HG2 and segid A) (resid 44 and name HA and segid A) 3.87 1.50 1.50 !  1.396 3.636
assign (resid 44 and name HN and segid A) (resid 44 and name HB# and segid A) 3.38 1.50 1.50 ! K44HB#-N-HN (1.675 118.30 8.32) 612000000
assign (resid 44 and name HA and segid A) (resid 45 and name HN and segid A) 4.50 1.50 1.72 ! K44HA-D45N-HN (3.667 117.02 7.36) 202000000
assign (resid 44 and name HN and segid A) (resid 45 and name HN and segid A) 3.90 1.500 1.50 ! K44HN-D45N-HN (8.349 117.00 7.37) 282000000
assign (resid 44 and name HB# and segid A) (resid 45 and name HN and segid A) 3.88 1.50 2.19 ! K44?HB#-D45N-HN (1.677 117.01 7.37) 666000000
assign (resid 44 and name HB# and segid A) (resid 46 and name HN and segid A) 5.00 2.50 2.00 ! K44?HB#-G46N-HN (1.692 103.70 7.33) 113000000
! D45    Stereoassigned HB1=2.293, HB2=2.633               
assign (resid 45 and name HB2 and segid A) (resid 45 and name HA and segid A) 2.49 0.70 1.00 ! D45HB2-HA 2.633 4.288
assign (resid 45 and name HB1 and segid A) (resid 45 and name HA and segid A) 2.53 0.70 1.00 ! D45HB1-HA 2.297 4.294
assign (resid 45 and name HA and segid A) (resid 45 and name HN and segid A) 4.08 2.00 1.50 ! D45HA-N-HN (4.253 117.00 7.37) 448000000
assign (resid 45 and name HB2 and segid A) (resid 45 and name HN and segid A) 3.68 1.90 1.50 ! D45HB1-N-HN (2.628 117.00 7.37) 520000000
assign (resid 45 and name HB1 and segid A) (resid 45 and name HN and segid A) 3.88 2.00 1.50 ! D45HB2-N-HN (2.332 117.00 7.36) 483000000
assign (resid 45 and name HB1 and segid A) (resid 45 and name HN and segid A) 4.53 2.00 1.50 ! D45HB2-N-HN (2.238 117.02 7.37) 103000000
assign (resid 45 and name HA and segid A) (resid 46 and name HN and segid A) 4.50 2.50 1.50 ! D45HA-G46N-HN (4.253 103.62 7.31) 154000000
assign (resid 45 and name HB1 and segid A) (resid 46 and name HN and segid A) 4.00 2.00 1.50 ! D45HB2-G46N-HN (2.277 103.63 7.32) 311000000
assign (resid 45 and name HB2 and segid A) (resid 46 and name HN and segid A) 4.00 2.00 1.50 ! D45HB1-G46N-HN (2.636 103.61 7.32) 141000000
! G46                   
assign (resid 46 and name HN and segid A) (resid 47 and name HN and segid A) 4.50 2.50 1.50 ! K47HN-G46N-HN (7.755 103.62 7.32) 70900000
! K47                   
assign (resid 47 and name HE# and segid A) (resid 47 and name HA and segid A) 4.50 2.50 1.80 !  3.151 4.07
assign (resid 47 and name HA and segid A) (resid 47 and name HN and segid A) 4.50 2.50 1.70 ! K47HA-N-HN (4.096 119.90 7.67) 9742640
assign (resid 47 and name HA and segid A) (resid 48 and name HN and segid A) 4.50 2.50 1.50 ! K47HA-L48N-HN (4.02 124.90 9.29) 53300000
assign (resid 47 and name HN and segid A) (resid 48 and name HN and segid A) 3.50 1.50 1.50 ! K47HN-?-L48HN (7.692 125.30 9.30) 3455391
! L48    HB=1.16, Based on 13C-CT-HSQC   HD1#=0.535  HD2#=-0.358   HG=1.204
assign (resid 48 and name HA and segid A) (resid 48 and name HD2# and segid A) 2.52 0.60 1.50 ! L48HD2#-HA -0.358 3.745
assign (resid 48 and name HD2# and segid A) (resid 48 and name HG and segid A) 2.08 0.27 1.50  ! L48HD2#-HG -0.358 1.205
assign (resid 48 and name HD2# and segid A) (resid 48 and name HB# and segid A) 2.00 0.25 1.80 ! L48HD2#-HB# -0.358 1.1
assign (resid 48 and name HA and segid A) (resid 48 and name HN and segid A) 4.45 2.00 1.49 ! L48HA-N-HN (3.764 124.87 9.28) 255000000
assign (resid 48 and name HB# and segid A) (resid 48 and name HN and segid A) 3.78 1.50 1.80 ! L48HB#-N-HN (1.145 124.90 9.29) 774000000
assign (resid 48 and name HD2# and segid A) (resid 48 and name HN and segid A) 4.66 1.50 1.93 ! L48HD2#-N-HN (-0.343 124.88 9.29) 110000000
assign (resid 48 and name HA and segid A) (resid 49 and name HN and segid A) 2.24 0.28 1.29 ! L48HA-Q49HN 3.745 8.652
assign (resid 48 and name HB# and segid A) (resid 49 and name HN and segid A) 3.00 0.50 1.80 ! L48HD2#-Q49HN 1.10 8.65
assign (resid 48 and name HG and segid A) (resid 49 and name HN and segid A) 3.00 0.50 2.00 ! L48HD2#-Q49HN 1.10 8.65
assign (resid 48 and name HD1# and segid A) (resid 49 and name HN and segid A) 4.50 2.50 1.70 ! L48HD1#-Q49HN 0.525 8.651
assign (resid 48 and name HD2# and segid A) (resid 49 and name HN and segid A) 2.33 0.28 1.50 ! L48HD2#-Q49HN -0.358 8.641
assign (resid 48 and name HD2# and segid A) (resid 49 and name HE2# and segid A) 2.50 0.60 1.80 ! L48HD2#-Q49?HE22 -0.358 6.613
assign (resid 48 and name HD2# and segid A) (resid 50 and name HA and segid A) 3.50 1.00 1.50 ! L48HD2#-I50HA -0.358 3.18
assign (resid 48 and name HD1# and segid A) (resid 52 and name HB1 and segid A) 4.08 2.00 1.50 !  0.535 2.452
assign (resid 48 and name HD2# and segid A) (resid 52 and name HB2 and segid A) 2.65 0.85 1.60 ! L48HD2#-D52HB2 -0.358 2.045
assign (resid 48 and name HD2# and segid A) (resid 52 and name HN and segid A) 5.00 2.00 2.00 !  -0.358 7.774
assign (resid 48 and name HG and segid A) (resid 52 and name HN and segid A) 3.60 1.50 1.60 ! I3?HG#?-D52N-HN (1.09 122.10 7.76) 53700000   possibly it is L48HG-D52HN
! Q49       HB2=1.857, HB1=1.675;
assign (resid 49 and name HA and segid A) (resid 49 and name HB1 and segid A) 3.50 1.50 1.50 ! Q49HA-HB1 4.4 1.67
assign (resid 49 and name HA and segid A) (resid 49 and name HB2 and segid A) 3.50 1.50 1.50 ! Q49HA-HB2 4.4 1.857 
assign (resid 49 and name HA and segid A) (resid 49 and name HN and segid A) 2.52 0.60 1.00 ! Q49HA-HN 4.4 8.649
assign (resid 49 and name HB2 and segid A) (resid 49 and name HN and segid A) 2.79 1.00 1.00 ! Q49HB1-HN 1.857 8.652
assign (resid 49 and name HB1 and segid A) (resid 49 and name HN and segid A) 2.58 0.60 1.00 ! Q49HB2-HN 1.675 8.65
assign (resid 49 and name HG1 and segid A) (resid 49 and name HN and segid A) 3.06 1.00 1.50 ! Q49HG1-HN 2.154 8.651
assign (resid 49 and name HG2 and segid A) (resid 49 and name HN and segid A) 2.65 0.60 1.00 ! Q49HG3-HN 2.062 8.65
assign (resid 49 and name HG1 and segid A) (resid 49 and name HE21 and segid A) 4.05 1.50 1.50 ! Q49HG#-NE-HE21 (2.146 113.90 7.11) 368000000
assign (resid 49 and name HG1 and segid A) (resid 49 and name HE22 and segid A) 4.53 2.00 1.50 ! Q49HG#-NE-HE22 (2.139 113.89 6.66) 118000000
assign (resid 49 and name HA and segid A) (resid 50 and name HA and segid A) 4.21 2.00 1.50 !  4.381 3.183
assign (resid 49 and name HA and segid A) (resid 50 and name HN and segid A) 3.44 1.64 1.50 ! Q49HA-I50N-HN (4.374 120.32 8.31) 390000000
assign (resid 49 and name HB2 and segid A) (resid 50 and name HN and segid A) 4.51 2.50 1.80 ! Q49HB1-I50N-HN (1.879 120.30 8.32) 114000000
assign (resid 49 and name HG1 and segid A) (resid 50 and name HN and segid A) 4.50 2.50 1.80 ! Q49HG#-I50N-HN (2.128 120.30 8.32) 63000000
assign (resid 49 and name HG2 and segid A) (resid 52 and name HN and segid A) 3.64 1.50 1.80 ! Q49HG1-D52N-HN (2.023 121.91 7.75) 648000000
! I50     CD1=13, HD1#=0.79; CG2=17.02, HG2#?= 0.73; HG1#=0.63
assign (resid 50 and name HA and segid A) (resid 50 and name HB and segid A) 3.78 2.00 1.50 !  3.185 1.503
assign (resid 50 and name HA and segid A) (resid 50 and name HG2# and segid A) 3.35 1.70 1.50 !  3.183 0.731
assign (resid 50 and name HA and segid A) (resid 50 and name HN and segid A) 4.55 2.50 1.96 ! I50HA-N-HN (3.172 120.20 8.33) 2200000000
assign (resid 50 and name HB and segid A) (resid 50 and name HN and segid A) 3.56 1.70 1.50 ! I50HB-N-HN (1.528 120.30 8.32) 1110000000
assign (resid 50 and name HA and segid A) (resid 51 and name HN and segid A) 3.46 1.66 1.50 ! I50HA-G51N-HN (3.184 117.00 9.08) 721000000
assign (resid 50 and name HB and segid A) (resid 51 and name HN and segid A) 5.07 3.00 2.00 ! I50HB/HG#-G51N-HN (1.487 117.10 9.07) 466000000
assign (resid 50 and name HG2# and segid A) (resid 51 and name HN and segid A) 3.85 2.00 2.00 ! I50HD1#/HG2#-G51N-HN (0.733 117.01 9.07) 793000000
assign (resid 50 and name HA and segid A) (resid 52 and name HN and segid A) 2.74 1.00 2.00 ! I50HA-D52HN 3.185 7.77
! G51                   
assign (resid 51 and name HA1 and segid A) (resid 51 and name HN and segid A) 3.86 2.06 1.50 ! G51HA1-N-HN (4.367 117.00 9.08) 372000000
assign (resid 51 and name HA2 and segid A) (resid 51 and name HN and segid A) 4.01 2.20 1.50! G51HA2-N-HN (3.52 117.01 9.07) 394000000
assign (resid 51 and name HN and segid A) (resid 52 and name HN and segid A) 4.05 2.00 1.50 ! D52HN-G51N-HN (7.749 117.03 9.08) 235000000
assign (resid 51 and name HA2 and segid A) (resid 52 and name HN and segid A) 2.54 0.80 1.00 ! G51HA1-D52HN 3.521 7.773
! D52       stereoassignment HB1= 2.449; HB2=2.05              
assign (resid 52 and name HA and segid A) (resid 52 and name HB1 and segid A) 3.24 1.50 1.41 ! D52HB1-HA 2.447 4.462
assign (resid 52 and name HA and segid A) (resid 52 and name HB2 and segid A) 3.04 1.30 1.50 ! D52HB2-HA 2.057 4.46
assign (resid 52 and name HA and segid A) (resid 52 and name HN and segid A) 2.24 0.28 0.50 ! D52HA-HN 4.46 7.771
assign (resid 52 and name HB1 and segid A) (resid 52 and name HN and segid A) 2.19 0.27 0.60 ! D52HB1-HN 2.451 7.771
assign (resid 52 and name HB2 and segid A) (resid 52 and name HN and segid A) 3.94 2.00 1.50 !  7.77 2.047
assign (resid 52 and name HB1 and segid A) (resid 85 and name HG2# and segid A) 3.00 1.20 1.50 ! D52HB1-V85HG2# 2.451 0.55
assign (resid 52 and name HB2 and segid A) (resid 85 and name HG1# and segid A) 3.00 1.20 2.00 !  2.451 0.60
! K53               suppose K53HB#=1.55, HG#=1.40 HD#=0.79      
assign (resid 53 and name HA and segid A) (resid 54 and name HN and segid A) 2.08 0.27 1.00 ! K53HA-L54HN 4.544 8.359
assign (resid 53 and name HB# and segid A) (resid 54 and name HN and segid A) 3.00 1.00 2.50 ! K53HB#-L54HN 1.514 8.359
assign (resid 53 and name HG# and segid A) (resid 54 and name HN and segid A) 2.50 0.90 2.50 ! K53HA-L54HN 4.544 8.359
! L54    CD1=26.05, HD1#=0.69,CD2=24.3, HD2#=0.50 suppose HB1=1.32; HB2=1.05              
assign (resid 54 and name HA and segid A) (resid 54 and name HB2 and segid A) 4.17 2.37 1.50 !  4.346 1.059
assign (resid 54 and name HA and segid A) (resid 54 and name HD2# and segid A) 3.43 1.63 1.50 !  4.346 0.5
assign (resid 54 and name HA and segid A) (resid 54 and name HN and segid A) 2.62 0.80 1.00 ! L54HA-HN 4.346 8.359
assign (resid 54 and name HB1 and segid A) (resid 54 and name HN and segid A) 2.28 0.28 1.30 ! L54HB1-HN 1.32 8.358
assign (resid 54 and name HB2 and segid A) (resid 54 and name HN and segid A) 2.47 0.29 1.20 ! L54HB2-HN 1.057 8.359
assign (resid 54 and name HD2# and segid A) (resid 54 and name HN and segid A) 4.41 2.00 1.50 !  0.502 8.361
assign (resid 54 and name HA and segid A) (resid 55 and name HN and segid A) 2.20 0.27 1.00 ! L54HA-L55HN 4.345 8.937
assign (resid 54 and name HB# and segid A) (resid 55 and name HN and segid A) 4.15 2.00 1.50 ! L54HB#-L55N-HN (1.286 122.00 8.94) 530000000
assign (resid 54 and name HD2# and segid A) (resid 55 and name HN and segid A) 2.44 0.60 1.50  ! L54HD2#-L55HN 0.505 8.937
assign (resid 54 and name HA and segid A) (resid 56 and name HN and segid A) 3.00 1.00 1.50 ! L54HA-L55HN 4.345 7.813 ! new added
assign (resid 54 and name HA and segid A) (resid 85 and name HA and segid A) 2.86 1.00 1.50 ! L54HA-V85HA 4.345 5.058
assign (resid 54 and name HN and segid A) (resid 85 and name HG1# and segid A) 2.86 1.00 1.50 ! L54HN-V85HG1# 8.36, 0.60
assign (resid 54 and name HN and segid A) (resid 85 and name HA and segid A) 3.50 1.50 1.50 ! L54HN-V85HA 8.36, 5.05
assign (resid 54 and name HD2# and segid A) (resid 85 and name HA and segid A) 3.00 1.20 1.50 ! L54HD2#-L55HN 0.505 8.937
! L55                  HD1#=HD2#=0.62 
assign (resid 55 and name HA and segid A) (resid 55 and name HN and segid A) 2.56 0.60 1.00 ! L55HA-HN 4.174 8.937
assign (resid 55 and name HB# and segid A) (resid 55 and name HN and segid A) 2.25 0.40 1.50 ! L55HB#-HN 1.306 8.937
assign (resid 55 and name HD## and segid A) (resid 55 and name HN and segid A) 2.21 0.40 1.50 ! L55HD##-HN 0.611 8.937
assign (resid 55 and name HA and segid A) (resid 56 and name HN and segid A) 2.67 0.80 1.00 ! L55HA-A56HN 4.171 7.81
assign (resid 55 and name HB# and segid A) (resid 56 and name HN and segid A) 2.67 0.80 1.00 ! L55HA-A56HN 1.308 7.81
assign (resid 55 and name HN and segid A) (resid 56 and name HN and segid A) 2.28 0.48 1.00 ! L55HN-A56HN 8.937 7.813
assign (resid 55 and name HA and segid A) (resid 62 and name HN and segid A) 4.00 1.00 1.00 ! L55HN-A56HN 4.16 8.13
assign (resid 55 and name HN and segid A) (resid 84 and name HA and segid A) 4.00 2.00 1.50 ! L55HN-K84HB# 8.937 1.603
assign (resid 55 and name HN and segid A) (resid 84 and name HB2 and segid A) 2.50 0.70 2.00 ! L55HN-K84HB# 8.937 1.603
assign (resid 55 and name HN and segid A) (resid 84 and name HB1 and segid A) 3.50 1.70 1.60 ! L55HN-K84HB# 8.937 1.13
assign (resid 55 and name HN and segid A) (resid 85 and name HA and segid A) 2.32 0.50 1.00 ! V85HA-L55HN 5.059 8.936
assign (resid 55 and name HN and segid A) (resid 85 and name HB and segid A) 3.50 1.50 1.80 ! V85HA-L55HN 1.74 8.936
! A56                   
assign (resid 56 and name HA and segid A) (resid 56 and name HB# and segid A) 3.25 1.00 1.50 !  4.89 1.136
assign (resid 56 and name HA and segid A) (resid 56 and name HN and segid A) 2.32 0.50 1.00 ! A56HA-HN 4.898 7.812
assign (resid 56 and name HB# and segid A) (resid 56 and name HN and segid A) 2.47 0.60  1.00 ! A56HB#-HN 1.135 7.818
assign (resid 56 and name HA and segid A) (resid 57 and name HN and segid A) 2.08 0.27 0.50 ! A56HA-V57HN 4.888 8.405
assign (resid 56 and name HB# and segid A) (resid 57 and name HN and segid A) 2.15 0.27 1.20 ! A56HB#-V57HN 1.134 8.406
assign (resid 56 and name HN and segid A) (resid 57 and name HN and segid A) 2.98 1.00 1.50 ! A56HN-V57HN 7.812 8.405
assign (resid 56 and name HA and segid A) (resid 61 and name HA and segid A) 2.50 0.60 0.50 ! A56HA-C61HA 4.886 4.017
assign (resid 56 and name HA and segid A) (resid 61 and name HB# and segid A) 2.80 1.00 1.00 ! A56HA-C61HA 4.886 3.05
assign (resid 56 and name HB# and segid A) (resid 61 and name HA and segid A) 2.80 1.00 1.00 ! A56HB#-C61HA 1.13 4.017
assign (resid 56 and name HA and segid A) (resid 62 and name HN and segid A) 3.00 1.00 1.00 ! A56HA-L62HN 4.888 8.13
assign (resid 56 and name HA and segid A) (resid 62 and name HB1 and segid A) 3.00 1.00 1.00 ! A56HA-L62HN 4.888 0.977
assign (resid 56 and name HB# and segid A) (resid 62 and name HN and segid A) 3.00 1.00 1.50 ! A56HB#-L62HN 4.89 8.13
assign (resid 56 and name HA and segid A) (resid 62 and name HD1# and segid A) 3.00 1.00 1.50 ! A56HA-L62HN 4.888 0.50
assign (resid 56 and name HN and segid A) (resid 84 and name HA and segid A) 3.00 1.00 1.00 ! V85HA-A56HN  5.059 7.812
assign (resid 56 and name HA and segid A) (resid 84 and name HN and segid A) 3.50 1.50 2.00 ! A56HA-L62HN 4.888 8.20 
assign (resid 56 and name HB# and segid A) (resid 84 and name HN and segid A) 3.50 1.50 1.50 ! A56HA-L62HN 1.13 8.20 
assign (resid 56 and name HN and segid A) (resid 84 and name HB# and segid A) 3.00 1.00 1.00 ! V85HA-A56HN  1.605 7.812
assign (resid 56 and name HN and segid A) (resid 85 and name HA and segid A) 2.84 1.00 1.00 ! V85HA-A56HN  5.059 7.812
! V57                   
assign (resid 57 and name HA and segid A) (resid 57 and name HB and segid A) 3.59 1.50 1.30 !  4.793 1.627
assign (resid 57 and name HA and segid A) (resid 57 and name HG## and segid A) 3.10 1.00 2.00  !  4.795 0.726
assign (resid 57 and name HA and segid A) (resid 57 and name HN and segid A) 2.60 0.80 1.00 ! V57HA-HN 4.793 8.405
assign (resid 57 and name HB and segid A) (resid 57 and name HN and segid A) 2.95 1.00 1.50 ! V57HB-HN 1.62 8.4
assign (resid 57 and name HG## and segid A) (resid 57 and name HN and segid A) 3.86 2.00 2.00  ! V57HG##-N-HN (0.716 117.00 8.37) 436000000
assign (resid 57 and name HA and segid A) (resid 58 and name HN and segid A) 4.36 2.56 1.24 ! V57HA-N58N-HN (4.767 128.30 9.80) 317000000
assign (resid 57 and name HB and segid A) (resid 58 and name HN and segid A) 4.98 3.15 1.50 ! V57HB-N58N-HN (1.609 128.20 9.79) 152000000
assign (resid 57 and name HG## and segid A) (resid 58 and name HN and segid A) 4.01 2.20 2.00 ! V57HG##-N58N-HN (0.736 128.20 9.80) 436000000
assign (resid 57 and name HN and segid A) (resid 60 and name HN and segid A) 3.50 1.50 1.50 ! V57HN-V60HN 8.401 8.699
assign (resid 57 and name HN and segid A) (resid 60 and name HA and segid A) 3.50 1.50 1.50 ! a very weak peak! V60HA-V57HN 3.865 8.405
assign (resid 57 and name HN and segid A) (resid 60 and name HB and segid A) 3.10 1.00 1.50 ! V60HB-V57HN 2.215 8.406
assign (resid 57 and name HN and segid A) (resid 60 and name HG2# and segid A) 3.50 1.50 1.80  ! V60HG1#-V57HN 0.864 8.406
assign (resid 57 and name HN and segid A) (resid 61 and name HA and segid A) 2.80 1.00 0.80 ! C61HA-V57HN 4.015 8.405
assign (resid 57 and name HN and segid A) (resid 62 and name HN and segid A) 4.00 1.00 1.00 ! L62HN-V57HN 8.126 8.405
assign (resid 57 and name HN and segid A) (resid 62 and name HD1# and segid A) 3.50 1.50 1.50  ! l62HD1#-V57HN 0.50 8.406
assign (resid 57 and name HN and segid A) ((resid 62 and name HB# and segid A) or (resid 62 and name HG and segid A)) 3.50 1.50 1.80  ! L62HB/L83HG-V57HN 1.48 8.406
assign (resid 57 and name HA and segid A) (resid 62 and name HD1# and segid A) 3.50 1.50 1.50  ! l62HD1#-V57HN 0.50 4.79
assign (resid 57 and name HN and segid A) (resid 62 and name HD2# and segid A) 3.50 1.50 1.50  ! l62HD2#-V57HN 0.59 8.406
assign (resid 57 and name HA and segid A) (resid 83 and name HA and segid A) 3.00 1.30 2.00 ! 4.79 4.93 
assign (resid 57 and name HA and segid A) (resid 84 and name HN and segid A) 3.00 1.30 2.00 ! 8.20, 4.79 
! N58         stereoassigned HB1= 3.067; HB2=2.911; chi=-90?   
assign (resid 58 and name HB1 and segid A) (resid 58 and name HA and segid A) 2.59 0.70  1.50 ! N58HB1-HA 3.067 4.287
assign (resid 58 and name HB2 and segid A) (resid 58 and name HA and segid A) 2.30 0.60 1.50! N58HB2-HA 2.911 4.282
assign (resid 58 and name HA and segid A) (resid 58 and name HN and segid A) 3.93 2.00 1.50 ! N58HA-N-HN (4.288 128.05 9.79) 633000000
assign (resid 58 and name HB# and segid A) (resid 58 and name HN and segid A) 3.50 1.80 1.80  ! N58HB2-N-HN (2.926 128.08 9.80) 328000000
assign (resid 58 and name HB1 and segid A) (resid 58 and name HD21 and segid A) 4.50 2.50 1.50 ! N58HB1-ND-HD1 (3.065 112.13 7.92) 97100000
assign (resid 58 and name HB2 and segid A) (resid 58 and name HD21 and segid A) 4.50 2.50 1.50 ! N58HB1-ND-HD1 (2.947 112.10 7.93) 241000000
! N59                   
assign (resid 59 and name HB# and segid A) (resid 59 and name HN and segid A) 4.48 2.68 1.80 ! N59?HB#-?-N59?HN (2.839 113.40 8.57) 2410000000
assign (resid 59 and name HB# and segid A) (resid 59 and name HD2# and segid A) 4.50 2.70 2.00 ! N59?HB#-ND-HD1 (2.821 113.20 7.47) 2350000000
! V60          cd2=20.6, hg2#=0.864; cd1#=21.54, HG1#=0.7; CHI=-60 ?? HB is not splited!       
assign (resid 60 and name HA and segid A) (resid 60 and name HG2# and segid A) 3.05 1.00 1.50 !  3.865 0.865
assign (resid 60 and name HA and segid A) (resid 60 and name HG1# and segid A) 2.98 1.00 1.50 !  3.865 0.709
assign (resid 60 and name HA and segid A) (resid 60 and name HN and segid A) 2.81 1.00 1.00 ! V60HA-HN 3.869 8.699
assign (resid 60 and name HA and segid A) (resid 60 and name HB and segid A) 2.15 0.27 0.80 ! V60HB-HA 2.211 3.875
assign (resid 60 and name HB and segid A) (resid 60 and name HN and segid A) 2.65 0.60 1.10  ! V60HB-HN 2.212 8.7
assign (resid 60 and name HB and segid A) (resid 60 and name HG2# and segid A) 3.30 1.50 1.50  !V60HG2#-HB  0.861 2.21
assign (resid 60 and name HG1# and segid A) (resid 60 and name HN and segid A) 4.50 2.50 1.50 ! V60HG2#-HN 0.701 8.699
assign (resid 60 and name HG2# and segid A) (resid 60 and name HN and segid A) 2.55 0.60  1.50 ! V60HG1#-HN 0.864 8.699
assign (resid 60 and name HG2# and segid A) (resid 61 and name HN and segid A) 4.82 2.00 1.96 ! V60HG1#-C61N-HN (0.811 127.90 8.56) 91800000
assign (resid 60 and name HG1# and segid A) (resid 61 and name HN and segid A) 4.54 2.00 1.94 ! V60HG2#-C61N-HN (0.621 127.90 8.56) 54100000
assign (resid 60 and name HG1# and segid A) (resid 73 and name HA and segid A) 3.50 1.00 1.50  ! V60HG1#-A73HB# 0.70 3.93
assign (resid 60 and name HG2# and segid A) (resid 73 and name HA and segid A) 4.00 1.00 1.50  ! V60HG1#-A73HB# 0.864 3.93
assign (resid 60 and name HG2# and segid A) (resid 73 and name HB# and segid A) 3.00 1.00 1.50  ! V60HG1#-A73HB# 0.864 1.255
assign (resid 60 and name HG2# and segid A) (resid 73 and name HB# and segid A) 3.50 1.50 1.50  ! V60HG1#-A73HB# 0.864 3.944
! C61    stereoassigned----HB1=2.694; HB2=3.051; CHI=-180               
assign (resid 61 and name HA and segid A) (resid 61 and name HB2 and segid A) 2.17 0.27 0.60 ! C61HB2-HA 3.051 4.011
assign (resid 61 and name HA and segid A) (resid 61 and name HB1 and segid A) 2.88 1.00 1.00 ! C61HB1-HA 2.694 4.017
assign (resid 61 and name HB2 and segid A) (resid 61 and name HN and segid A) 4.24 1.50 1.50 ! C61HB2-N-HN (3.063 127.86 8.57) 210000000
assign (resid 61 and name HB1 and segid A) (resid 61 and name HN and segid A) 4.11 1.65 1.50 ! C61HB1-N-HN (2.71 127.81 8.56) 284000000
assign (resid 61 and name HA and segid A) (resid 61 and name HN and segid A) 3.70 1.50 1.50 ! C61/V60HA-C61N-HN (3.89 127.83 8.56) 558000000
assign (resid 61 and name HA and segid A) (resid 62 and name HN and segid A) 2.50 1.00 1.00 !very strong C61HA-L62HN 4.02, 8.13
assign (resid 61 and name HB1 and segid A) (resid 62 and name HN and segid A) 3.50 1.00 1.50 !very weak C61HA-L62HN 2.69 8.129
assign (resid 61 and name HB2 and segid A) (resid 62 and name HN and segid A) 3.50 1.00 1.50 !very weak C61HA-L62HN 3.05 8.129
! L62     HB1=0.977, HB2=1.56     BASED ON 13c-ct-hsqc   CD2=22.82, hd2#=0.59,CD1=26.02, HD1#=0.50
assign (resid 62 and name HA and segid A) (resid 62 and name HD1# and segid A) 3.77 2.00 1.50 !  4.524 0.5
assign (resid 62 and name HB2 and segid A) (resid 62 and name HN and segid A) 3.00 1.20 1.00 ! L62HB2-HN 0.98 8.128
assign (resid 62 and name HD2# and segid A) (resid 62 and name HN and segid A) 4.50 2.50 1.50 ! L62HG2#-HN 0.581 8.129
assign (resid 62 and name HD1# and segid A) (resid 62 and name HN and segid A) 3.12 1.30 1.00 ! L62HD#-HN 0.504 8.128
assign (resid 62 and name HB1 and segid A) (resid 62 and name HN and segid A) 4.50 2.50 1.50  ! L62HB1-N-HN (1.494 126.60 8.11) 143000000
assign (resid 62 and name HG and segid A) (resid 62 and name HN and segid A) 4.84 3.00 2.00 ! L62HG2#-N-HN (0.572 126.61 8.11) 97000000
assign (resid 62 and name HD1# and segid A) (resid 70 and name HA and segid A) 3.50 1.50 1.50 ! L62HD1#-HN 0.504 3.73
assign (resid 62 and name HD2# and segid A) (resid 70 and name HA and segid A) 3.50 1.50 1.50 ! L62HD2#-HN 0.581 3.73
! E63
assign (resid 63 and name HA and segid A) (resid 64 and name HN and segid A) 3.50 1.50 2.00 !  (4.23 122.1 8.518)
! E64                   
assign (resid 64 and name HB1 and segid A) (resid 64 and name HA and segid A) 2.00 0.26 0.80 ! E64HB1-HA 2.005 3.499
assign (resid 64 and name HB2 and segid A) (resid 64 and name HA and segid A) 2.00 0.26 0.80 ! E64HB2-HA 1.909 3.479
assign (resid 64 and name HG# and segid A) (resid 64 and name HA and segid A) 2.38 0.58 1.80 ! E64HG#-HA 2.193 3.485
assign (resid 64 and name HA and segid A) (resid 64 and name HN and segid A) 3.50 1.16 2.00 !  3.48 8.518
assign (resid 64 and name HN and segid A) (resid 65 and name HG2# and segid A) 4.50 2.70 1.50 !E65HG2#-E64HN  0.578 8.511
assign (resid 64 and name HN and segid A) (resid 65 and name HA and segid A) 4.50 2.70 1.50 !E65HA-E64HN  4.77 8.511
assign (resid 64 and name HA and segid A) (resid 65 and name HA and segid A) 4.00 2.00 1.00 !E65HA-E64HA  4.77 3.50
! V65  BASED ON THE 13C-CT-HSQC     HG1#=0.67; CD2#=17.56; HG2#=0.57
assign (resid 65 and name HB and segid A) (resid 66 and name HN and segid A) 3.41 1.60 1.50 ! V65HB-T66N-HN (2.254 111.09 8.55) 1000000000
assign (resid 65 and name HG2# and segid A) (resid 66 and name HN and segid A) 4.19 2.39 1.94 ! V65HG##-T66N-HN (0.609 111.11 8.56) 477000000
assign (resid 65 and name HB and segid A) (resid 68 and name HN and segid A) 4.46 2.62 1.54 ! V65HB-E68N-HN (2.245 114.80 8.68) 197000000
assign (resid 65 and name HG2# and segid A) (resid 68 and name HN and segid A) 4.09 2.00 1.80 ! V65?HG2#-E68N-HN (0.609 114.70 8.68) 4160000000
assign (resid 65 and name HA and segid A) (resid 69 and name HN and segid A) 3.83 2.03 2.00 ! V65?HA-E69N-HN (4.748 120.50 7.72) 281000000
assign (resid 65 and name HG2# and segid A) (resid 69 and name HN and segid A) 4.27 2.47 2.00 ! V65?HG##-E69N-HN (0.606 120.50 7.71) 575000000
! T66       HA=4.507, HB=4.70?, HG2#=1.199            
assign (resid 66 and name HA and segid A) (resid 66 and name HG2# and segid A) 3.03 1.00 1.50 !  4.507 1.197
assign (resid 66 and name HA and segid A) (resid 66 and name HB and segid A) 3.13 1.00 1.50 !  T66HB-HA 4.7 4.507
assign (resid 66 and name HB and segid A) (resid 66 and name HG2# and segid A) 2.73 1.00 1.00 !  4.695 1.195
assign (resid 66 and name HB and segid A) (resid 66 and name HN and segid A) 4.50 2.45 1.50 ! T66?HB-T66N-HN (4.513 111.10 8.55) 81600000
assign (resid 66 and name HG2# and segid A) (resid 66 and name HN and segid A) 3.65 1.50 1.50 ! T66HG2#-N-HN (1.186 111.08 8.55) 536000000
assign (resid 66 and name HA and segid A) (resid 67 and name HN and segid A) 4.27 2.50 1.50 ! T66HA-H67N-HN (4.484 121.31 9.55) 376000000
assign (resid 66 and name HB and segid A) (resid 67 and name HN and segid A) 3.95 2.00 1.50 ! T66HB-H67N-HN (4.72 121.30 9.55) 423000000
assign (resid 66 and name HG2# and segid A) (resid 67 and name HN and segid A) 4.50 2.50 1.50 ! T66HG#-H67N-HN (1.206 121.34 9.54) 136000000
assign (resid 66 and name HN and segid A) (resid 67 and name HN and segid A) 4.50 2.00 1.50 ! T66HN-?-H67HN (8.696 120.41 9.53) 6490000
assign (resid 66 and name HN and segid A) (resid 67 and name HN and segid A) 4.41 2.50 1.50 ! T66HN-H67N-HN (8.692 121.33 9.55) 253000000
assign (resid 66 and name HN and segid A) (resid 69 and name HN and segid A) 3.50 1.50 1.50 ! E69HN-T66N-HN (7.762 111.08 8.56) 127000000
assign (resid 66 and name HN and segid A) (resid 69 and name HB1 and segid A) 3.50 1.50 1.50 ! E69HB2-T66N-HN (1.68 111.08 8.56) 127000000
assign (resid 66 and name HN and segid A) (resid 69 and name HB1 and segid A) 3.50 1.50 1.50 ! E69HB1-T66N-HN (2.11 111.08 8.56) 127000000
assign (resid 66 and name HN and segid A) (resid 70 and name HN and segid A) 4.50 2.50 1.50 ! T66?HN-A70N-HN (8.584 122.90 7.76) 2513587
! H67 HB1 and HB2 were stereoassigned!       HB1=2.90, HB2=3.346 
assign (resid 67 and name HA and segid A) (resid 67 and name HB1 and segid A) 2.00 0.26 1.00 ! H67HA-HB1 3.733 2.921
assign (resid 67 and name HA and segid A) (resid 67 and name HB2 and segid A) 2.26 0.50 1.00 ! H67HB2-HA 3.346 3.725
assign (resid 67 and name HA and segid A) (resid 67 and name HD2 and segid A) 2.64 0.80 1.50 ! H67HA-HD2 3.731 6.378
assign (resid 67 and name HB1 and segid A) (resid 67 and name HD2 and segid A) 2.20 0.40 1.50 ! H67HB1-HD2 2.909 6.378
assign (resid 67 and name HB2 and segid A) (resid 67 and name HD2 and segid A) 2.50 0.74 1.50 ! H67HB2-HD2 3.347 6.378
assign (resid 67 and name HA and segid A) (resid 67 and name HN and segid A) 4.50 2.00 1.50 ! H67HA-N-HN (3.769 121.30 9.55) 269000000
assign (resid 67 and name HB1 and segid A) (resid 67 and name HN and segid A) 4.57 2.00 1.50 ! H67HB1-N-HN (2.937 121.30 9.55) 313000000
assign (resid 67 and name HB2 and segid A) (resid 67 and name HN and segid A) 4.63 2.00 1.50  ! H67HB2-N-HN (3.315 121.32 9.54) 397000000
assign (resid 67 and name HB1 and segid A) (resid 68 and name HN and segid A) 4.58 2.00 1.50 ! H67HB1-E68N-HN (2.939 114.90 8.69) 2150000000
assign (resid 67 and name HB2 and segid A) (resid 68 and name HN and segid A) 3.50 1.70  1.50 ! H67HB2-E68N-HN (3.321 114.80 8.70) 105000000
assign (resid 67 and name HN and segid A) (resid 68 and name HN and segid A) 4.00 2.00 1.50 ! H67HN-E68N-HN (9.532 115.08 8.70) 1060000000
assign (resid 67 and name HD2 and segid A) (resid 68 and name HA and segid A) 2.64 0.80 1.80 ! 6.378, 3.78 ! IT IS CORRECT, e68,E69 OR SOMETHING ELSE?
assign (resid 67 and name HD2 and segid A) (resid 70 and name HN and segid A) 4.00 1.50 1.50 ! 6.378, 7.79! 
assign (resid 67 and name HD2 and segid A) (resid 71 and name HN and segid A) 3.20 1.40 1.50 !  6.378 8.218
assign (resid 67 and name HD2 and segid A) (resid 71 and name HG1# and segid A) 2.68 0.88 2.00 ! V71HG1#-H67HD2 0.701 6.378
assign (resid 67 and name HD2 and segid A) (resid 71 and name HG2# and segid A) 2.08 0.27 1.28 ! V71HG2#-H67HD2 0.549 6.378
assign (resid 67 and name HD2 and segid A) (resid 71 and name HB and segid A) 3.00 1.00 1.50 ! V71HB-H67HD2 1.90 6.378
! E68                   
assign (resid 68 and name HA and segid A) (resid 68 and name HN and segid A) 3.00 1.20 1.50 ! E68HA-N-HN (3.774 114.80 8.69) 295000000
assign (resid 68 and name HB# and segid A) (resid 68 and name HN and segid A) 3.54 1.00 1.54 ! E68HB#-N-HN (1.887 114.80 8.69) 708000000
assign (resid 68 and name HN and segid A) (resid 69 and name HN and segid A) 4.09 1.50 1.50 ! E69HN-E68N-HN (7.749 114.88 8.69) 470000000
! E69                   
assign (resid 69 and name HB1 and segid A) (resid 69 and name HA and segid A) 2.00 0.25 1.00 ! E69HB1-HA 2.182 3.773
assign (resid 69 and name HB2 and segid A) (resid 69 and name HA and segid A) 2.50 0.50 1.00 !E69HB2-HA 1.718 3.771
assign (resid 69 and name HG# and segid A) (resid 69 and name HA and segid A) 2.18 0.27 1.00 ! E69HG2-HA 1.816 3.78
assign (resid 69 and name HA and segid A) (resid 69 and name HN and segid A) 3.77 1.87 1.50 ! E69HA-?-E69HN (3.782 120.60 7.71) 315000000
assign (resid 69 and name HB# and segid A) (resid 69 and name HN and segid A) 3.56 1.50 1.50 ! E69HB#-?-E69HN (2.231 120.60 7.71) 690000000
assign (resid 69 and name HB1 and segid A) (resid 70 and name HN and segid A) 4.50 1.50 1.50 ! ! E69HB1-A70HN 2.23 7.75
assign (resid 69 and name HB2 and segid A) (resid 70 and name HN and segid A) 4.17 1.50 1.50 ! E69HB2-A70HN 1.74 7.75
assign (resid 69 and name HG# and segid A) (resid 70 and name HN and segid A) 4.53 1.50 1.88 ! E69HG#-A70HN 1.88 7.75
! A70                   
assign (resid 70 and name HA and segid A) (resid 70 and name HN and segid A) 2.00 0.26 1.00 ! A70HA-HN 3.749 7.788
assign (resid 70 and name HA and segid A) (resid 70 and name HB# and segid A) 2.00 0.25 1.00 ! A70HB#-HA 1.105 3.738
assign (resid 70 and name HB# and segid A) (resid 70 and name HN and segid A) 2.00 0.26 1.50 ! A70HB#-HN 1.107 7.789
assign (resid 70 and name HB# and segid A) (resid 71 and name HA and segid A) 2.00 0.22 2.00 ! A70HB#-V71HA 1.102 2.954
assign (resid 70 and name HA and segid A) (resid 71 and name HN and segid A) 4.00 2.00 1.50 ! A70HA-V71N-HN (3.767 117.70 8.17) 129000000
assign (resid 70 and name HB# and segid A) (resid 71 and name HN and segid A) 2.00 0.26 1.50 ! A70HB#-V71HN 1.1 8.219
assign (resid 70 and name HN and segid A) (resid 71 and name HN and segid A) 2.14 0.27 1.40 ! V71HN-L74HN 8.217 7.794 mixed with V71HN-A70HN
assign (resid 70 and name HA and segid A) (resid 73 and name HN and segid A) 2.47 0.60 2.40 !  3.755 7.586
assign (resid 70 and name HA and segid A) (resid 73 and name HB# and segid A) 2.47 0.60 2.40 !  3.755 1.25
! V71     based on 13C-CT-HSQC          HG1#=0.7      HG2#=0.555  
assign (resid 71 and name HA and segid A) (resid 71 and name HG1# and segid A) 3.42 1.00 1.50 !  2.953 0.704
assign (resid 71 and name HA and segid A) (resid 71 and name HN and segid A) 2.30 0.28 0.60 ! V71HA-HN 2.953 8.222
assign (resid 71 and name HB and segid A) (resid 71 and name HN and segid A) 2.04 0.26 0.80 ! V71HB-HN 1.893 8.222
assign (resid 71 and name HA and segid A) (resid 71 and name HG1# and segid A) 2.00 0.26 1.27 ! V71HG1#-HA 0.7 2.953
assign (resid 71 and name HA and segid A) (resid 71 and name HG2# and segid A) 2.00 0.25 1.26 ! V71HG2#-HA 0.542 2.95
assign (resid 71 and name HG1# and segid A) (resid 71 and name HN and segid A) 4.50 2.00 1.50 ! V71HG1#-N-HN (0.701 117.60 8.19) 99600000
assign (resid 71 and name HG2# and segid A) (resid 71 and name HN and segid A) 3.58 1.00 1.50 ! V71HG2#-N-HN (0.533 117.67 8.19) 737000000
assign (resid 71 and name HA and segid A) (resid 72 and name HN and segid A) 4.74 2.00 1.50 ! V71HA-T72N-HN (2.956 115.90 8.24) 187000000
assign (resid 71 and name HB and segid A) (resid 72 and name HN and segid A) 3.85 2.00 1.50 ! V71HB-T72N-HN (1.909 115.80 8.24) 791000000
assign (resid 71 and name HG1# and segid A) (resid 72 and name HN and segid A) 4.51 2.71 1.75 ! V71HG1#-T72N-HN (0.679 115.80 8.23) 90900000
assign (resid 71 and name HG2# and segid A) (resid 74 and name HN and segid A) 4.56 2.76 1.50 ! V71?HG2#-L74N-HN (0.57 116.00 7.74) 93700000
assign (resid 71 and name HN and segid A) (resid 74 and name HN and segid A) 2.14 0.27 2.80 ! V71HN-L74HN 8.217 7.794 mixed with V71HN-A70HN
assign (resid 71 and name HA and segid A) (resid 74 and name HN and segid A) 2.64 0.80 1.00 ! V71HA-L74HN 2.952 7.79
assign (resid 71 and name HA and segid A) (resid 74 and name HD2# and segid A) 2.42 0.60 1.30 ! L74HD1#-V71HA 0.988 2.941
assign (resid 71 and name HA and segid A) (resid 75 and name HN and segid A) 3.50 1.50 1.50!  2.953 8.50
assign (resid 71 and name HG1# and segid A) (resid 75 and name HN and segid A) 4.74 2.00 1.50 !  0.688 8.511
assign (resid 71 and name HG1# and segid A) (resid 75 and name HE# and segid A) 3.50 1.50 1.50 !  0.688 2.72
! T72                   
assign (resid 72 and name HA and segid A) (resid 72 and name HN and segid A) 2.18 0.27 0.60 ! T72HA-HN 3.995 8.242
assign (resid 72 and name HA and segid A) (resid 72 and name HB and segid A) 2.47 0.50 1.00 ! T72HB-HA 3.562 4.008
assign (resid 72 and name HA and segid A) (resid 72 and name HG2# and segid A) 2.00 0.24 1.25 ! T72HG#-HA 1.064 3.992
assign (resid 72 and name HB and segid A) (resid 72 and name HN and segid A) 2.40 0.60 1.00 ! T72HB-HN 3.558 8.242
assign (resid 72 and name HB and segid A) (resid 72 and name HG2# and segid A) 3.15 1.00 1.40 ! T72HB-HG2#  1.06 3.562
assign (resid 72 and name HG2# and segid A) (resid 72 and name HN and segid A) 4.16 1.50 1.50 ! T72HG#-N-HN (1.067 115.80 8.23) 480000000
assign (resid 72 and name HG2# and segid A) (resid 73 and name HA and segid A) 4.00 1.50 1.50 ! T72HG#-A73HA 1.067 3.944
assign (resid 72 and name HN and segid A) (resid 73 and name HN and segid A) 2.56 0.50 0.50 ! T72HN-A73HN 8.242 7.585
assign (resid 72 and name HA and segid A) (resid 73 and name HN and segid A) 3.50 1.00 1.50 !  3.994 7.583
assign (resid 72 and name HB and segid A) (resid 73 and name HN and segid A) 2.77 1.00 1.00 ! T72HB-A73HN 3.558 7.583
assign (resid 72 and name HG2# and segid A) (resid 73 and name HN and segid A) 4.79 2.00 1.50 ! T72HG2#-A73N-HN (1.038 121.90 7.56) 61900000
assign (resid 72 and name HG2# and segid A) (resid 73 and name HB# and segid A) 3.00 1.00 1.20 !  1.06 7.583
assign (resid 72 and name HA and segid A) (resid 76 and name HN and segid A) 3.50 1.00 1.50 !  (4.009 120.4 7.64) 
assign (resid 72 and name HG2# and segid A) (resid 76 and name HN and segid A) 3.00 1.00 1.80 !  1.06 2.68
! A73                   
assign (resid 73 and name HA and segid A) (resid 73 and name HN and segid A) 2.50 0.76 1.00 !  3.945 7.583
assign (resid 73 and name HA and segid A) (resid 73 and name HB# and segid A) 2.00 0.26 1.27 ! A73HB#-HA 1.255 3.941
assign (resid 73 and name HB# and segid A) (resid 73 and name HN and segid A) 2.13 0.40 1.28 ! A73HB#-HN 1.255 7.584
assign (resid 73 and name HB# and segid A) (resid 74 and name HN and segid A) 2.20  0.40 1.50 ! A73HB#-L74HN 1.253 7.797
assign (resid 73 and name HA and segid A) (resid 74 and name HN and segid A) 2.38 0.60 1.30 ! A73HA-A74HN 3.948 7.791
assign (resid 73 and name HN and segid A) (resid 75 and name HN and segid A) 2.38 0.60 1.30 ! A73HA-A74HN 7.791 8.51 
assign (resid 73 and name HA and segid A) (resid 76 and name HB1 and segid A) 3.05 1.00 1.50 ! N76HB1-A73HA 2.825 3.944
assign (resid 73 and name HA and segid A) (resid 76 and name HB2 and segid A) 2.73 1.00 1.00 ! N76HB2-A73HA 2.681 3.941
! L74         HB#?=1.78  based on 13C-CT_HSQC HD1#=0.64, HD2#=0.98; HG=1.51         
assign (resid 74 and name HA and segid A) (resid 74 and name HN and segid A) 4.30 2.50 1.50 ! L74/A73HA-L74N-HN (3.782 116.00 7.75) 161000000
assign (resid 74 and name HG and segid A) (resid 74 and name HN and segid A) 2.09 0.27 2.00 ! L74HB#-HN 1.51 7.793
assign (resid 74 and name HB# and segid A) (resid 74 and name HN and segid A) 4.26 2.50 1.50 ! L74?HB#-L74N-HN (1.777 116.00 7.74) 202000000
assign (resid 74 and name HG and segid A) (resid 74 and name HN and segid A) 4.17 2.50 1.50 ! L74?HG-L74N-HN (1.558 116.00 7.73) 177000000
assign (resid 74 and name HA and segid A) (resid 74 and name HD2# and segid A) 3.00 1.00 1.50 ! L74HD1#-HA 0.99 3.786
assign (resid 74 and name HA and segid A) (resid 74 and name HD1# and segid A) 3.67 1.80 1.50 !  3.776 0.643
assign (resid 74 and name HA and segid A) (resid 74 and name HG and segid A) 3.81 1.80 1.50 !  3.78 1.516
assign (resid 74 and name HD2# and segid A) (resid 74 and name HN and segid A) 2.31 0.50 1.50 !  0.987 7.793
assign (resid 74 and name HN and segid A) (resid 75 and name HN and segid A) 2.71 0.90 1.00 ! L74HN-K75HN 7.791 8.505
assign (resid 74 and name HA and segid A) (resid 75 and name HN and segid A) 3.13 1.00 1.50 !  3.783 8.507
assign (resid 74 and name HD1# and segid A) (resid 75 and name HN and segid A) 3.50 1.50 1.50 ! 0.98, 8.51
assign (resid 74 and name HG and segid A) (resid 75 and name HN and segid A) 3.50 1.50 1.50 ! 1.51, 8.51
! K75                   
assign (resid 75 and name HA and segid A) (resid 75 and name HN and segid A) 2.60 0.90 1.00 ! K75HA-HN 4.131 8.506
assign (resid 75 and name HB# and segid A) (resid 75 and name HN and segid A) 2.25 0.48 1.80 !  1.715 8.506
assign (resid 75 and name HG# and segid A) (resid 76 and name HB# and segid A) 2.25 0.48 1.80 !  0.361 1.358
assign (resid 75 and name HB# and segid A) (resid 76 and name HN and segid A) 4.50 2.50 1.80 ! K75HB#-N76N-HN (1.697 120.40 7.63) 18729970
assign (resid 75 and name HN and segid A) (resid 76 and name HN and segid A) 4.50 2.50 1.70 ! K75HN-?-N76HN (8.473 120.60 7.64) 10576203
assign (resid 75 and name HA and segid A) (resid 77 and name HN and segid A) 3.50 1.50 2.00 ! K75HA-T77N-HN (4.155 110.37 7.48) 304000000
! N76 
assign (resid 76 and name HA and segid A) (resid 76 and name HB1 and segid A) 3.18 1.40 1.50 !  4.805 2.82
assign (resid 76 and name HA and segid A) (resid 76 and name HB2 and segid A) 3.36 1.50 1.50 !  4.803 2.681
assign (resid 76 and name HB# and segid A) (resid 76 and name HD2# and segid A) 4.96 3.13 1.80 ! N76HB1-NE-HE22 (2.731 112.50 6.78) 1320000000
assign (resid 76 and name HA and segid A) (resid 76 and name HN and segid A) 3.85 2.00 1.50 ! N76HA-?-N76HN (4.799 120.40 7.63) 362000000
assign (resid 76 and name HB# and segid A) (resid 76 and name HN and segid A) 3.54 1.50 1.80 ! N76HB#-?-N76HN (2.718 120.30 7.64) 995000000
assign (resid 76 and name HA and segid A) (resid 77 and name HN and segid A) 3.36 1.56 1.50  ! N76HA-T77N-HN (4.796 110.38 7.48) 1310000000
assign (resid 76 and name HB# and segid A) (resid 77 and name HN and segid A) 4.62 2.82 1.80 ! N76HB#-T77N-HN (2.758 110.49 7.49) 1990000000
assign (resid 76 and name HD21 and segid A) (resid 77 and name HG2# and segid A) 4.50 2.70 1.80 ! T77HG2#-N76NE-HE21 (1.083 112.50 7.57) 1420000000
assign (resid 76 and name HD22 and segid A) (resid 77 and name HG2# and segid A) 4.61 2.81 1.80 ! T77HG2#-N76NE-HE22 (1.077 112.50 6.79) 257000000
! T77     HG2#=1.075
assign (resid 77 and name HA and segid A) (resid 77 and name HB and segid A) 2.99 1.19 1.00 ! T77HB-HA 3.771 4.319
assign (resid 77 and name HA and segid A) (resid 77 and name HN and segid A) 4.19 2.39 1.50 ! T77HA-N-HN (4.333 110.36 7.47) 275000000
assign (resid 77 and name HB and segid A) (resid 77 and name HN and segid A) 4.50 2.50 1.50 ! T77HB-N-HN (3.794 110.50 7.47) 55200000
assign (resid 77 and name HG2# and segid A) (resid 77 and name HN and segid A) 3.77 1.97 1.50 ! T77?HG2#-T77N-HN (1.074 110.35 7.48) 565000000
assign (resid 77 and name HN and segid A) (resid 78 and name HN and segid A) 3.50 1.50 1.50 ! S78HN-T77N-HN (8.359 110.48 7.47) 1644299
assign (resid 77 and name HG2# and segid A) (resid 78 and name HN and segid A) 4.37 2.57 1.50 ! T77HG2#-S78N-HN (1.075 115.80 8.34) 285000000
! S78                   
assign (resid 78 and name HA and segid A) (resid 78 and name HB# and segid A) 2.63 0.70 2.00 ! S78HB#-HA 3.754 4.367
assign (resid 78 and name HA and segid A) (resid 78 and name HN and segid A) 3.68 1.88 1.50 ! S78/T77HA-S78N-HN (4.338 115.90 8.34) 676000000
assign (resid 78 and name HB# and segid A) (resid 78 and name HN and segid A) 4.03 2.23 1.80 ! S78/T77HB#-S78N-HN (3.767 115.90 8.34) 320000000
!assign ((resid 78 and name HB1 and segid A) or (resid 78 and name HB2 and segid A)) (resid 79 and name HN and segid A) 3.52 1.72 1.80 ! S78HB#-D79N-HN (3.774 117.90 8.29) 705000000
assign (resid 78 and name HA and segid A) (resid 79 and name HN and segid A) 4.50 2.50 1.70 ! S78HN-?-D79HN (4.338 118.20 8.30) 17984372
! D79                   
assign (resid 79 and name HB# and segid A) (resid 79 and name HA and segid A) 2.17 0.27 2.10 ! D79HB#-HA 2.416 4.02
assign (resid 79 and name HB# and segid A) (resid 79 and name HN and segid A) 4.50 2.50 1.70 ! ! D79HB#-?-D79HN (2.399 118.20 8.29) 6900996
assign (resid 79 and name HA and segid A) (resid 80 and name HN and segid A) 4.31 2.54 1.50 ! D79HA-F80N-HN (8.353 117.69 7.72) 75500000
assign (resid 79 and name HB# and segid A) (resid 80 and name HN and segid A) 3.56 1.80 1.50 ! D79HB#-F80N-HN (2.398 117.80 7.73) 1350000000
! F80  HB1=2.845 HB2=2.574     
assign (resid 80 and name HA and segid A) (resid 80 and name HB1 and segid A) 3.87 2.00 1.50 !  4.88 2.845
assign (resid 80 and name HA and segid A) (resid 80 and name HB2 and segid A) 3.66 1.90 1.50 !  4.878 2.574
assign (resid 80 and name HA and segid A) (resid 80 and name HE# and segid A) 2.20 0.46 2.70 ! F80HA-HE# 4.875 6.996
assign (resid 80 and name HA and segid A) (resid 80 and name HD# and segid A) 2.50 0.60 2.70 ! F80HA-HD# 4.873 6.613
assign (resid 80 and name HB1 and segid A) (resid 80 and name HD# and segid A) 4.02 2.00 2.80 ! F80HB1-HD# 2.829 6.617
assign (resid 80 and name HB1 and segid A) (resid 80 and name HE# and segid A) 2.15 0.27 2.60 ! F80HB1-HE# 2.841 6.986
assign (resid 80 and name HB2 and segid A) (resid 80 and name HD# and segid A) 2.56 0.60 2.70 ! F80HB2-HD# 2.574 6.615
assign (resid 80 and name HB2 and segid A) (resid 80 and name HE# and segid A) 2.18 0.40 2.80 ! F80HB2-HE# 2.573 6.986
assign (resid 80 and name HB2 and segid A) (resid 80 and name HZ and segid A) 4.50 2.50 1.70 ! F80HB2-HZ 2.569 7.185
assign (resid 80 and name HA and segid A) (resid 80 and name HN and segid A) 4.19 2.00 1.50 ! F80HA-N-HN (4.896 117.82 7.73) 602000000
assign (resid 80 and name HB1 and segid A) (resid 80 and name HN and segid A) 3.72 1.90 1.50 ! F80HB1-N-HN (2.848 117.80 7.73) 410000000
assign (resid 80 and name HB2 and segid A) (resid 80 and name HN and segid A) 4.73 2.93 1.50 ! F80HB1-N-HN (2.55 117.81 7.74) 32200000
assign (resid 80 and name HD# and segid A) (resid 80 and name HN and segid A) 4.46 2.00 2.80 ! F80HD#?-N-HN (6.65 117.89 7.73) 431000000
assign (resid 80 and name HE# and segid A) (resid 80 and name HN and segid A) 3.50 1.50 2.80 ! F80HE#?-N-HN (6.979 117.80 7.73) 4302813
assign (resid 80 and name HA and segid A) (resid 81 and name HA and segid A) 3.17 1.00 1.50 ! V81HA-F80HA 4.318 4.874
assign (resid 80 and name HA and segid A) (resid 81 and name HN and segid A) 3.41 1.00 1.50 ! F80HA-V81N-HN (4.853 123.70 8.96) 1020000000
assign (resid 80 and name HB1 and segid A) (resid 81 and name HN and segid A) 4.50 2.50 1.70 ! F80HB1-V81N-HN (2.838 123.90 8.96) 2054746
assign (resid 80 and name HB2 and segid A) (resid 81 and name HN and segid A) 4.56 1.50 2.06 ! F80HB2-V81N-HN (2.586 123.73 8.96) 145000000
assign (resid 80 and name HN and segid A) (resid 81 and name HN and segid A) 4.50 2.50 1.70 ! V81HN-F80N-HN (9.054 117.79 7.74) 8564923
assign (resid 80 and name HD# and segid A) (resid 82 and name HB2 and segid A) 2.64 0.70 2.30 ! Y82HB2-F80HE# 2.739 6.611
! V81  HB=1.70  based on the 13C-CT-HSQC  HG1#=0.76   HG2#=0.80, 
assign (resid 81 and name HA and segid A) (resid 81 and name HN and segid A) 3.98 2.18 1.50 ! V81HA-N-HN (4.362 123.70 8.94) 215000000
assign (resid 81 and name HG1# and segid A) (resid 81 and name HN and segid A) 3.82 2.00 1.50 ! V81HG##-N-HN (0.73 123.70 8.96) 765000000
assign (resid 81 and name HB and segid A) (resid 81 and name HN and segid A) 3.88 1.50 1.50 ! V81HB-N-HN (1.677 123.70 8.96) 297000000
assign (resid 81 and name HB and segid A) (resid 81 and name HA and segid A) 2.91 1.00 1.50 ! V81HB-HA 1.715 4.313
assign (resid 81 and name HG1# and segid A) (resid 81 and name HA and segid A) 2.08 0.27 1.50 ! V81HG1#-HA 0.776 4.312
assign (resid 81 and name HG2# and segid A) (resid 81 and name HN and segid A) 4.33 2.00 1.50 !  0.792 8.999
assign (resid 81 and name HA and segid A) (resid 82 and name HA and segid A) 2.70 1.00 2.00 ! Y82HA-V81HA 4.875 4.32
assign (resid 81 and name HA and segid A) (resid 82 and name HD# and segid A) 4.50 2.00 1.50 !Y82HD#-V81HA   6.996 4.313
! Y82  HB1 and HB2 were stereoassigned!      HB1=2.935  HB2=2.739         
assign (resid 82 and name HA and segid A) (resid 82 and name HB1 and segid A) 3.42 1.60 1.50 ! Y82HB@-HA  2.931 4.88
assign (resid 82 and name HA and segid A) (resid 82 and name HB2 and segid A) 3.80 6.00 1.50 !  4.888 2.736
assign (resid 82 and name HA and segid A) (resid 82 and name HD# and segid A) 5.00 2.00 2.00 !Y82HD#-HA  6.993 4.878
assign (resid 82 and name HB1 and segid A) (resid 82 and name HD# and segid A) 2.01 0.26 1.00 ! Y82HB1-HD# 2.929 7.005
assign (resid 82 and name HB1 and segid A) (resid 82 and name HE# and segid A) 2.93 1.00 1.40 ! Y82HB1-HE# 2.572 7.189
assign (resid 82 and name HB1 and segid A) (resid 82 and name HN and segid A) 4.77 3.01 1.50 ! Y82HB1-N-HN (2.973 125.70 8.67) 1660000000
assign (resid 82 and name HB2 and segid A) (resid 82 and name HN and segid A) 5.00 3.20 1.20 ! Y82HB2-N-HN (2.765 125.49 8.68) 63800000
assign (resid 82 and name HD# and segid A) (resid 82 and name HN and segid A) 4.00 1.50 1.80 ! Y82HD#-N-HN (7.042 125.45 8.70) 184000000
assign (resid 82 and name HB2 and segid A) (resid 82 and name HD# and segid A) 2.03 0.26 1.28 ! Y82HB2-HD# 2.735 7.006
assign (resid 82 and name HA and segid A) (resid 83 and name HN and segid A) 2.01 0.26 1.00 ! Y82HA-L83HN 4.875 9.385
assign (resid 82 and name HB1 and segid A) (resid 83 and name HN and segid A) 3.00 1.00 1.30 ! Y82HB1-L83HN 2.931 9.386
assign (resid 82 and name HB2 and segid A) (resid 83 and name HN and segid A) 3.00 1.00 1.50 ! Y82HB2-L83HN 2.736 9.385
assign (resid 82 and name HD# and segid A) (resid 83 and name HN and segid A) 3.00 1.00 2.00 ! Y82HD#-HE# 7.005 9.387
! L83 STEREOASSIGNED! HB1=1.61 HB2=1.05   HG=1.49, HD2#=0.637  HD1#=0.714  CHI=180
assign (resid 83 and name HA and segid A) (resid 83 and name HB2 and segid A) 2.63 1.00 1.00 ! L83HB2-HA 1.12 4.94
assign (resid 83 and name HA and segid A) (resid 83 and name HB1 and segid A) 3.37 1.50 1.50 !  4.944 1.607
assign (resid 83 and name HA and segid A) (resid 83 and name HD1# and segid A) 3.32 1.50 1.43 !  4.944 0.718
assign (resid 83 and name HA and segid A) (resid 83 and name HD2# and segid A) 3.90 2.00 1.66 !  4.944 0.628
assign (resid 83 and name HA and segid A) (resid 83 and name HG and segid A) 4.06 2.00 1.50 !  4.944 1.478
assign (resid 83 and name HA and segid A) (resid 83 and name HN and segid A) 3.75 2.00 1.50 ! L83/Y82HA-L83N-HN (4.896 126.10 9.36) 810000000
assign (resid 83 and name HB2 and segid A) (resid 83 and name HN and segid A) 2.64 0.84 1.00 ! L83HB2-HN 1.091 9.385
assign (resid 83 and name HB1 and segid A) (resid 83 and name HN and segid A) 2.50 0.60 1.10  ! L83HB1-HN 1.617 9.386
assign (resid 83 and name HD2# and segid A) (resid 83 and name HN and segid A) 2.23 0.50 2.00 ! L83HD2#-HN 0.638 9.385
assign (resid 83 and name HG and segid A) (resid 83 and name HN and segid A) 2.50 0.70 2.00 ! K4?HB#/L83HG-L83HN 1.498 9.386
assign (resid 83 and name HN and segid A) (resid 84 and name HN and segid A) 3.21 1.40 1.50 ! K84HN-L83HN 8.201 9.387
assign (resid 83 and name HG# and segid A) (resid 84 and name HN and segid A) 4.12 2.00 1.50 ! K87HG#?/L83HB2-K84N-HN (1.582 123.90 8.19) 479000000
! K84                   
assign (resid 84 and name HA and segid A) (resid 84 and name HG# and segid A) 4.03 2.00 1.50 !  4.953 1.383
assign (resid 84 and name HA and segid A) (resid 84 and name HB# and segid A) 2.00 0.22 2.00 ! K84HB#-HA 1.601 2.771
assign (resid 84 and name HA and segid A) (resid 84 and name HN and segid A) 3.52 1.50 1.50 ! K84HA-N-HN (4.948 123.87 8.18) 542000000
assign (resid 84 and name HB# and segid A) (resid 84 and name HN and segid A) 2.18 0.27 2.00 ! K84HB#-HN 1.605 8.201
assign (resid 84 and name HG2 and segid A) (resid 84 and name HE# and segid A) 3.67 1.87 1.50 !  1.398 2.619
assign (resid 84 and name HA and segid A) (resid 85 and name HA and segid A) 2.87 1.00 1.80 ! V85HA-K84HA 5.154 4.95
assign (resid 84 and name HE# and segid A) (resid 85 and name HG2# and segid A) 4.35 2.50 1.50 !  2.612 0.549
assign (resid 84 and name HE# and segid A) (resid 85 and name HB and segid A) 4.40 2.60 1.50 !V85HB-K84HE2   1.762 2.616
assign (resid 84 and name HE# and segid A) (resid 86 and name HB# and segid A) 4.95 2.50 2.00 !A86HB#-K84HE2?  1.219 2.603
! V85        BASED ON 13c-cCT-HSQC HG1#=0.596     HG2#=0.549 
assign (resid 85 and name HA and segid A) (resid 85 and name HB and segid A) 2.80 1.00 1.00 ! V85HB-HA 1.752 5.056
assign (resid 85 and name HA and segid A) (resid 85 and name HG1# and segid A) 2.30 0.50 1.30 ! V85HG1#-HA 0.596 5.057
assign (resid 85 and name HA and segid A) (resid 85 and name HG2# and segid A) 3.75 1.95 1.50 !  5.057 0.549
assign (resid 85 and name HB and segid A) (resid 85 and name HN and segid A) 4.54 2.00 1.50 ! V85HB-N-HN (1.681 121.70 8.77) 180000000
assign (resid 85 and name HG2# and segid A) (resid 85 and name HN and segid A) 4.56 2.76 1.50 ! V85HG##-N-HN (0.504 121.90 8.77) 185000000
assign (resid 85 and name HA and segid A) (resid 86 and name HN and segid A) 3.48 1.500 1.50 ! V85HA-A86N-HN (5.069 126.70 9.04) 870000000
assign (resid 85 and name HG1# and segid A) (resid 86 and name HN and segid A) 3.74 1.90 1.57 ! V85HG##-A86N-HN (0.592 126.70 9.04) 544000000
! A86                   
assign (resid 86 and name HB# and segid A) (resid 86 and name HA and segid A) 3.26 1.46 1.80 ! A86HB#-HA 1.206 4.684
assign (resid 86 and name HA and segid A) (resid 86 and name HN and segid A) 4.09 2.00 1.50 ! A86HA-N-HN (4.711 126.70 9.04) 263000000
assign (resid 86 and name HB# and segid A) (resid 86 and name HN and segid A) 3.84 2.00 1.80 ! A86HB#-N-HN (1.192 126.70 9.04) 336000000
! K87                   
assign (resid 87 and name HA and segid A) (resid 87 and name HB1 and segid A) 3.98 2.18 1.50 !  4.646 1.723
assign (resid 87 and name HA and segid A) (resid 87 and name HB2 and segid A) 3.89 2.00 1.50 !  4.645 1.58
assign (resid 87 and name HA and segid A) (resid 87 and name HN and segid A) 4.50 2.70 1.50 ! K87HA-N-HN (4.659 124.90 8.48) 39250552
assign (resid 87 and name HB# and segid A) (resid 87 and name HN and segid A) 3.74 2.00 1.80 ! K87HB#-N-HN (1.569 124.77 8.47) 887000000
assign (resid 87 and name HA and segid A) (resid 88 and name HD1 and segid A) 3.94 2.00 1.50 !  4.637 3.871
assign (resid 87 and name HA and segid A) (resid 88 and name HD2 and segid A) 3.74 2.00 1.50 !  4.637 3.538
! P88                   
assign (resid 88 and name HB1 and segid A) (resid 88 and name HA and segid A) 2.05 0.26 1.00 ! P88HB1-HA 2.214 4.438
assign (resid 88 and name HB2 and segid A) (resid 88 and name HA and segid A) 4.50 2.50 1.00 !  P88HB2-HA 1.823 4.458
assign (resid 88 and name HG# and segid A) (resid 88 and name HA and segid A) 3.37 1.60 1.00 ! P88HG#-HA 1.941 4.449
assign (resid 88 and name HA and segid A) (resid 89 and name HN and segid A) 3.23 1.00 1.50 ! P88HA-T89N-HN (4.492 114.40 8.29) 775000000
assign (resid 88 and name HB1 and segid A) (resid 89 and name HN and segid A) 4.17 2.00 1.00 ! P88HB1-T89N-HN (2.243 114.50 8.29) 171000000
assign (resid 88 and name HB2 and segid A) (resid 89 and name HN and segid A) 3.96 2.00 1.00 ! P88HB1-T89N-HN (1.836 114.40 8.30) 407000000
assign (resid 88 and name HD1 and segid A) (resid 89 and name HN and segid A) 4.93 2.51 1.50 ! P88HD1-T89N-HN (3.906 114.40 8.30) 86500000
assign (resid 88 and name HD2 and segid A) (resid 89 and name HN and segid A) 4.61 2.00 1.50 ! P88HD2-T89N-HN (3.592 114.40 8.29) 349000000
assign (resid 88 and name HG# and segid A) (resid 89 and name HN and segid A) 3.78 2.00 1.50 ! P88HG#-T89N-HN (1.558 114.40 8.30) 309000000
! T89                   
assign (resid 89 and name HB and segid A) (resid 89 and name HA and segid A) 3.24 1.00 1.50 ! T89HB-HA 4.11 4.199
assign (resid 89 and name HG2# and segid A) (resid 89 and name HA and segid A) 2.00 0.25 1.80 ! T89HG2#-HA 1.102 4.198
assign (resid 89 and name HB and segid A) (resid 89 and name HN and segid A) 4.01 2.00 1.50 ! T89HB/HA-N-HN (4.148 114.40 8.28) 313000000
assign (resid 89 and name HB and segid A) (resid 90 and name HN and segid A) 3.76 2.00 1.50 ! T89HB-G90N-HN (4.14 111.10 8.31) 299000000
assign (resid 89 and name HG2# and segid A) (resid 90 and name HN and segid A) 4.81 3.03 1.80 ! T89HG2#-G90N-HN (1.081 111.08 8.32) 61200000
! OTHERS                   
assign (resid 91 and name HA and segid A) (resid 91 and name HB# and segid A) 3.02 1.20 1.80 ! S91HB#-HA 3.637 4.244
assign (resid 92 and name HA and segid A) (resid 92 and name HB# and segid A) 4.50 2.50 1.80 ! H92HB#-HA 3.051 4.508


! the following HN with slow exchange in D2O

assign (resid 3 and name HN and segid A) (resid 83 and name O and segid A) 1.90 0.30 0.50! H-bond 
assign (resid 3 and name N and segid A) (resid 83 and name O and segid A) 2.80 0.40 0.70! H-bond
assign (resid 3 and name O and segid A) (resid 83 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 3 and name O and segid A) (resid 83 and name N and segid A) 2.80 0.40 0.70! H-bond
assign (resid 5 and name HN and segid A) (resid 81 and name O and segid A) 1.90 0.30 0.50! H-bond
assign (resid 5 and name N and segid A) (resid 81 and name O and segid A) 2.80 0.40 0.70! H-bond
assign (resid 5 and name O and segid A) (resid 81 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 5 and name O and segid A) (resid 81 and name N and segid A) 2.80 0.40 0.70! H-bond
assign (resid 7 and name HN and segid A) (resid 79 and name O and segid A) 1.90 0.30 0.50! H-bond
assign (resid 7 and name N and segid A) (resid 79 and name O and segid A) 2.80 0.40 0.70! H-bond
assign (resid 15 and name HN and segid A) (resid 35 and name O and segid A) 1.90 0.30 0.50! H-bond
assign (resid 15 and name N and segid A) (resid 35 and name O and segid A) 2.80 0.40 0.70! H-bond
assign (resid 17 and name HN and segid A) (resid 32 and name O and segid A) 1.90 0.30 0.50! H-bond
assign (resid 17 and name N and segid A) (resid 32 and name O and segid A) 2.80 0.40 0.70! H-bond
assign (resid 17 and name O and segid A) (resid 32 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 17 and name O and segid A) (resid 32 and name HN and segid A) 2.80 0.40 0.70! H-bond
assign (resid 18 and name HN and segid A) (resid 22 and name O and segid A) 1.90 0.30 0.50! H-bond
assign (resid 18 and name N and segid A) (resid 22 and name O and segid A) 2.80 0.40 0.70! H-bond
assign (resid 19 and name O and segid A) (resid 22 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 19 and name O and segid A) (resid 22 and name HN and segid A) 2.80 0.40 0.70! H-bond
assign (resid 22 and name HN and segid A) (resid 19 and name O and segid A) 1.90 0.30 0.50! H-bond
assign (resid 22 and name N and segid A) (resid 19 and name O and segid A) 2.80 0.40 0.70! H-bond
assign (resid 31 and name HN and segid A) (resid 62 and name O and segid A) 1.90 0.30 0.50! H-bond
assign (resid 31 and name N and segid A) (resid 62 and name O and segid A) 2.80 0.40 0.70! H-bond
assign (resid 31 and name O and segid A) (resid 54 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 31 and name O and segid A) (resid 54 and name N and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 33 and name HN and segid A) (resid 52 and name O and segid A) 1.90 0.30 0.80 ! H-bond
assign (resid 33 and name N and segid A) (resid 52 and name O and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 40 and name HN and segid A) (resid 37 and name O and segid A) 1.90 0.30 0.80 ! H-bond
assign (resid 40 and name N and segid A) (resid 37 and name O and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 44 and name HN and segid A) (resid 40 and name O and segid A) 1.90 0.30 0.80 ! H-bond
assign (resid 44 and name N and segid A) (resid 40 and name O and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 45 and name HN and segid A) (resid 41 and name O and segid A) 1.90 0.30 0.80 ! H-bond
assign (resid 45 and name N and segid A) (resid 41 and name O and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 46 and name HN and segid A) (resid 42 and name O and segid A) 1.90 0.30 0.80 ! H-bond
assign (resid 46 and name N and segid A) (resid 42 and name O and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 49 and name O and segid A) (resid 52 and name HN and segid A) 1.90 0.30 0.80 ! Q49/33, H-bond  
assign (resid 49 and name O and segid A) (resid 52 and name N and segid A) 2.80 0.40 0.70  ! Q49/33, H-bond  
assign (resid 49 and name HN and segid A) (resid 52 and name OD2 and segid A) 1.90 0.30 0.50! H-bond
assign (resid 49 and name N and segid A) (resid 52 and name OD2 and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 55 and name O and segid A) (resid 62 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 55 and name O and segid A) (resid 62 and name N and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 55 and name HN and segid A) (resid 84 and name O and segid A) 1.90 0.30 0.80 ! H-bond, 
assign (resid 55 and name N and segid A) (resid 84 and name O and segid A) 2.80 0.40 0.70 ! H-bond, 
assign (resid 56 and name HN and segid A) (resid 84 and name O and segid A) 1.90 0.30 0.90 ! H-bond
assign (resid 56 and name N and segid A) (resid 84 and name O and segid A) 2.80 0.40 0.70! H-bond
assign (resid 56 and name O and segid A) (resid 84 and name HN and segid A) 1.90 0.30 0.50 ! H-bond
assign (resid 56 and name N and segid A) (resid 84 and name O and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 57 and name HN and segid A) (resid 60 and name O and segid A) 1.90 0.30 0.50! H-bond
assign (resid 57 and name N and segid A) (resid 60 and name O and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 57 and name O and segid A) (resid 60 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 57 and name O and segid A) (resid 60 and name N and segid A) 2.80 0.40 0.90 ! H-bond
assign (resid 66 and name O and segid A) (resid 70 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 66 and name O and segid A) (resid 70 and name N and segid A) 2.80 0.40 0.90 ! H-bond
assign (resid 67 and name O and segid A) (resid 71 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 67 and name O and segid A) (resid 71 and name N and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 68 and name O and segid A) (resid 72 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 68 and name O and segid A) (resid 72 and name N and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 69 and name O and segid A) (resid 73 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 69 and name O and segid A) (resid 73 and name N and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 70 and name O and segid A) (resid 74 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 70 and name O and segid A) (resid 74 and name N and segid A) 2.80 0.40 0.70 ! H-bond
assign (resid 71 and name O and segid A) (resid 75 and name HN and segid A) 1.90 0.30 0.50! H-bond
assign (resid 71 and name O and segid A) (resid 75 and name N and segid A) 2.80 0.40 0.70 ! H-bond

!chi angles from analyzing the spectra
! F14
assign (resid 14 and name n and segid A) (resid 14 and name ca and segid A) (resid 14 and name cb and segid A) (resid 14 and name cg and segid A) 1.0 60 30.0 2
! S15 
assign (resid 15 and name n and segid A) (resid 15 and name ca and segid A) (resid 15 and name cb and segid A) (resid 15 and name og and segid A) 1.0 60 30.0 2 
! N22   
assign (resid 22 and name n and segid A) (resid 22 and name ca and segid A) (resid 22 and name cb and segid A) (resid 22 and name cg and segid A) 1.0 60.0 30.0 2     
! H24
assign (resid 24 and name n and segid A) (resid 24 and name ca and segid A) (resid 24 and name cb and segid A) (resid 24 and name cg and segid A) 1.0 -180 30.0 2
! D28
assign (resid 28 and name n and segid A) (resid 28 and name ca and segid A) (resid 28 and name cb and segid A) (resid 28 and name cg and segid A) 1.0 -150 30.0 2    
! H43   
assign (resid 43 and name n and segid A) (resid 43 and name ca and segid A) (resid 43 and name cb and segid A) (resid 43 and name cg and segid A) 1.0 180 40.0 2   
! D45   
assign (resid 45 and name n and segid A) (resid 45 and name ca and segid A) (resid 45 and name cb and segid A) (resid 45 and name cg and segid A) 1.0 -180 40.0 2  
! D52  
assign (resid 52 and name n and segid A) (resid 52 and name ca and segid A) (resid 52 and name cb and segid A) (resid 52 and name cg and segid A) 1.0 65 30.0 2 
! N58  
assign (resid 58 and name n and segid A) (resid 58 and name ca and segid A) (resid 58 and name cb and segid A) (resid 58 and name cg and segid A) 1.0 -90.0 40.0 2   
! V60      
assign (resid 60 and name n and segid A) (resid 60 and name ca and segid A) (resid 60 and name cb and segid A) (resid 60 and name cg1 and segid A) 1.0 -60 30.0 2 
! H67 
assign (resid 67 and name n and segid A) (resid 67 and name ca and segid A) (resid 67 and name cb and segid A) (resid 67 and name cg and segid A) 1.0 -180 30.0 2     
! F80   
assign (resid 80 and name n and segid A) (resid 80 and name ca and segid A) (resid 80 and name cb and segid A) (resid 80 and name cg and segid A) 1.0 -90.0 30.0 2 
! Y82         
assign (resid 82 and name n and segid A) (resid 82 and name ca and segid A) (resid 82 and name cb and segid A) (resid 82 and name cg and segid A) 1.0 180.0 30.0 2     
! L83 
assign (resid 83 and name n and segid A) (resid 83 and name ca and segid A) (resid 83 and name cb and segid A) (resid 83 and name cg and segid A) 1.0 180 40.0 2  

! phi angle from TALOS analysis
assign (resid 1 and name C and segid A) (resid 2 and name N and segid A) (resid 2 and name CA and segid A) (resid 2 and name  C and segid A) 1.00 -108.00 30.00 2
assign (resid 2 and name C and segid A) (resid 3 and name N and segid A) (resid 3 and name CA and segid A) (resid 3 and name  C and segid A) 1.00 -128.00 30.00 2
assign (resid 3 and name C and segid A) (resid 4 and name N and segid A) (resid 4 and name CA and segid A) (resid 4 and name  C and segid A) 1.00 -98.00 30.00 2
assign (resid 4 and name C and segid A) (resid 5 and name N and segid A) (resid 5 and name CA and segid A) (resid 5 and name  C and segid A) 1.00 -120.00 30.00 2
assign (resid 5 and name C and segid A) (resid 6 and name N and segid A) (resid 6 and name CA and segid A) (resid 6 and name  C and segid A) 1.00 -120.00 30.00 2
assign (resid 7 and name C and segid A) (resid 8 and name N and segid A) (resid 8 and name CA and segid A) (resid 8 and name  C and segid A) 1.00 -120 30.00 2 
assign (resid 11 and name C and segid A) (resid 12 and name N and segid A) (resid 12 and name CA and segid A) (resid 12 and  name C and segid A) 1.00 -57.00 30.00 2
assign (resid 13 and name C and segid A) (resid 14 and name N and segid A) (resid 14 and name CA and segid A) (resid 14 and  name C and segid A) 1.00 -140.00 30.00 2  
assign (resid 14 and name C and segid A) (resid 15 and name N and segid A) (resid 15 and name CA and segid A) (resid 15 and  name C and segid A) 1.00 -120.00 30.00 2
assign (resid 15 and name C and segid A) (resid 16 and name N and segid A) (resid 16 and name CA and segid A) (resid 16 and  name C and segid A) 1.00 -135.00 30.00 2
assign (resid 16 and name C and segid A) (resid 17 and name N and segid A) (resid 17 and name CA and segid A) (resid 17 and  name C and segid A) 1.00 -132.00 30.00 2
assign (resid 17 and name C and segid A) (resid 18 and name N and segid A) (resid 18 and name CA and segid A) (resid 18 and  name C and segid A) 1.00 -160.00 30.00 2   
assign (resid 19 and name C and segid A) (resid 20 and name N and segid A) (resid 20 and name CA and segid A) (resid 20 and  name C and segid A) 1.00 -60.00 30.00 2
assign (resid 20 and name C and segid A) (resid 21 and name N and segid A) (resid 21 and name CA and segid A) (resid 21 and  name C and segid A) 1.00 65.00 40.00 2
assign (resid 21 and name C and segid A) (resid 22 and name N and segid A) (resid 22 and name CA and segid A) (resid 22 and  name C and segid A) 1.00 -120.00 30.00 2   
assign (resid 22 and name C and segid A) (resid 23 and name N and segid A) (resid 23 and name CA and segid A) (resid 23 and  name C and segid A) 1.00 -60.00 30.00 2   
assign (resid 23 and name C and segid A) (resid 24 and name N and segid A) (resid 24 and name CA and segid A) (resid 24 and  name C and segid A) 1.00 -120.00 30.00 2  
assign (resid 24 and name C and segid A) (resid 25 and name N and segid A) (resid 25 and name CA and segid A) (resid 25 and  name C and segid A) 1.00 -140.00 30.00 2
assign (resid 27 and name C and segid A) (resid 28 and name N and segid A) (resid 28 and name CA and segid A) (resid 28 and  name C and segid A) 1.00 -100.00 30.00 2  
assign (resid 28 and name C and segid A) (resid 29 and name N and segid A) (resid 29 and name CA and segid A) (resid 29 and  name C and segid A) 1.00 -65.00 30.00 2
assign (resid 29 and name C and segid A) (resid 30 and name N and segid A) (resid 30 and name CA and segid A) (resid 30 and  name C and segid A) 1.00 -80.00 30.00 2    
assign (resid 30 and name C and segid A) (resid 31 and name N and segid A) (resid 31 and name CA and segid A) (resid 31 and  name C and segid A) 1.00 -105.00 30.00 2 
assign (resid 31 and name C and segid A) (resid 32 and name N and segid A) (resid 32 and name CA and segid A) (resid 32 and  name C and segid A) 1.00 -120.00 30.00 2  
assign (resid 32 and name C and segid A) (resid 33 and name N and segid A) (resid 33 and name CA and segid A) (resid 33 and  name C and segid A) 1.00 -75.00 30.00 2
assign (resid 33 and name C and segid A) (resid 34 and name N and segid A) (resid 34 and name CA and segid A) (resid 34 and  name C and segid A) 1.00 -95.00 30.00 2   
assign (resid 34 and name C and segid A) (resid 35 and name N and segid A) (resid 35 and name CA and segid A) (resid 35 and  name C and segid A) 1.00 -137.00 35.00 2
assign (resid 35 and name C and segid A) (resid 36 and name N and segid A) (resid 36 and name CA and segid A) (resid 36 and  name C and segid A) 1.00 -90.00 30.00 2   
assign (resid 36 and name C and segid A) (resid 37 and name N and segid A) (resid 37 and name CA and segid A) (resid 37 and  name C and segid A) 1.00 -84.00 30.00 2
!assign (resid 37 and name C and segid A) (resid 38 and name N and segid A) (resid 38 and name CA and segid A) (resid 38 and  name C and segid A) 1.00 -50.00 30.00 2   
assign (resid 38 and name C and segid A) (resid 39 and name N and segid A) (resid 39 and name CA and segid A) (resid 39 and  name C and segid A) 1.00 60.00 30.00 2
assign (resid 39 and name C and segid A) (resid 40 and name N and segid A) (resid 40 and name CA and segid A) (resid 40 and  name C and segid A) 1.00 -65.00 30.00 2
assign (resid 40 and name C and segid A) (resid 41 and name N and segid A) (resid 41 and name CA and segid A) (resid 41 and  name C and segid A) 1.00 -60.00 15.00 2
assign (resid 41 and name C and segid A) (resid 42 and name N and segid A) (resid 42 and name CA and segid A) (resid 42 and  name C and segid A) 1.00 -55.00 20.00 2
assign (resid 42 and name C and segid A) (resid 43 and name N and segid A) (resid 43 and name CA and segid A) (resid 43 and  name C and segid A) 1.00 -60.00 30.00 2   
assign (resid 43 and name C and segid A) (resid 44 and name N and segid A) (resid 44 and name CA and segid A) (resid 44 and  name C and segid A) 1.00 -60.00 30.00 2  
assign (resid 44 and name C and segid A) (resid 45 and name N and segid A) (resid 45 and name CA and segid A) (resid 45 and  name C and segid A) 1.00 -65.00 30.00 2  
!assign (resid 45 and name C and segid A) (resid 46 and name N and segid A) (resid 46 and name CA and segid A) (resid 46 and  name C and segid A) 1.00 -75.00 30.00 2   
assign (resid 46 and name C and segid A) (resid 47 and name N and segid A) (resid 47 and name CA and segid A) (resid 47 and  name C and segid A) 1.00 -50.00 30.00 2    
assign (resid 47 and name C and segid A) (resid 48 and name N and segid A) (resid 48 and name CA and segid A) (resid 48 and  name C and segid A) 1.00 -50.00 40.00 2
assign (resid 48 and name C and segid A) (resid 49 and name N and segid A) (resid 49 and name CA and segid A) (resid 49 and  name C and segid A) 1.00 -114.00 30.00 2
!assign (resid 49 and name C and segid A) (resid 50 and name N and segid A) (resid 50 and name CA and segid A) (resid 50 and  name C and segid A) 1.00 -40.00 30.00 2
assign (resid 50 and name C and segid A) (resid 51 and name N and segid A) (resid 51 and name CA and segid A) (resid 51 and  name C and segid A) 1.00 90.00 30.00 2   
assign (resid 52 and name C and segid A) (resid 53 and name N and segid A) (resid 53 and name CA and segid A) (resid 53 and  name C and segid A) 1.00 -105.00 30.00 2   
assign (resid 53 and name C and segid A) (resid 54 and name N and segid A) (resid 54 and name CA and segid A) (resid 54 and  name C and segid A) 1.00 -120.00 30.00 2
assign (resid 55 and name C and segid A) (resid 56 and name N and segid A) (resid 56 and name CA and segid A) (resid 56 and  name C and segid A) 1.00 -146.00 30.00 2
assign (resid 56 and name C and segid A) (resid 57 and name N and segid A) (resid 57 and name CA and segid A) (resid 57 and  name C and segid A) 1.00 -126.00 30.00 2
assign (resid 57 and name C and segid A) (resid 58 and name N and segid A) (resid 58 and name CA and segid A) (resid 58 and  name C and segid A) 1.00 60.00 30.00 2
assign (resid 58 and name C and segid A) (resid 59 and name N and segid A) (resid 59 and name CA and segid A) (resid 59 and  name C and segid A) 1.00 60.00 30.00 2
assign (resid 59 and name C and segid A) (resid 60 and name N and segid A) (resid 60 and name CA and segid A) (resid 60 and  name C and segid A) 1.00 -90.00 30.00 2  
assign (resid 60 and name C and segid A) (resid 61 and name N and segid A) (resid 61 and name CA and segid A) (resid 61 and  name C and segid A) 1.00 -90.00 30.00 2 
assign (resid 61 and name C and segid A) (resid 62 and name N and segid A) (resid 62 and name CA and segid A) (resid 62 and  name C and segid A) 1.00 -70.00 30.00 2   
assign (resid 62 and name C and segid A) (resid 63 and name N and segid A) (resid 63 and name CA and segid A) (resid 63 and  name C and segid A) 1.00 -108.00 30.00 2
assign (resid 64 and name C and segid A) (resid 65 and name N and segid A) (resid 65 and name CA and segid A) (resid 65 and  name C and segid A) 1.00 -123.00 30.00 2
assign (resid 65 and name C and segid A) (resid 66 and name N and segid A) (resid 66 and name CA and segid A) (resid 66 and  name C and segid A) 1.00 -80.00 30.00 2
assign (resid 66 and name C and segid A) (resid 67 and name N and segid A) (resid 67 and name CA and segid A) (resid 67 and  name C and segid A) 1.00 -62.00 30.00 2
assign (resid 67 and name C and segid A) (resid 68 and name N and segid A) (resid 68 and name CA and segid A) (resid 68 and  name C and segid A) 1.00 -60.00 30.00 2
assign (resid 68 and name C and segid A) (resid 69 and name N and segid A) (resid 69 and name CA and segid A) (resid 69 and  name C and segid A) 1.00 -65.00 30.00 2
assign (resid 69 and name C and segid A) (resid 70 and name N and segid A) (resid 70 and name CA and segid A) (resid 70 and  name C and segid A) 1.00 -66.00 20.00 2
assign (resid 70 and name C and segid A) (resid 71 and name N and segid A) (resid 71 and name CA and segid A) (resid 71 and  name C and segid A) 1.00 -50.00 30.00 2  
assign (resid 71 and name C and segid A) (resid 72 and name N and segid A) (resid 72 and name CA and segid A) (resid 72 and  name C and segid A) 1.00 -64.00 20.00 2
assign (resid 72 and name C and segid A) (resid 73 and name N and segid A) (resid 73 and name CA and segid A) (resid 73 and  name C and segid A) 1.00 -60.00 30.00 2 
assign (resid 73 and name C and segid A) (resid 74 and name N and segid A) (resid 74 and name CA and segid A) (resid 74 and  name C and segid A) 1.00 -60.00 30.0 2  
assign (resid 74 and name C and segid A) (resid 75 and name N and segid A) (resid 75 and name CA and segid A) (resid 75 and  name C and segid A) 1.00 -60.00 30.00 2 
assign (resid 77 and name C and segid A) (resid 78 and name N and segid A) (resid 78 and name CA and segid A) (resid 78 and  name C and segid A) 1.00 -95.00 40.00 2  
assign (resid 78 and name C and segid A) (resid 79 and name N and segid A) (resid 79 and name CA and segid A) (resid 79 and  name C and segid A) 1.00 -90.00 40.00 2
assign (resid 79 and name C and segid A) (resid 80 and name N and segid A) (resid 80 and name CA and segid A) (resid 80 and  name C and segid A) 1.00 -100.00 30.00 2
assign (resid 80 and name C and segid A) (resid 81 and name N and segid A) (resid 81 and name CA and segid A) (resid 81 and  name C and segid A) 1.00 -116.00 25.00 2
assign (resid 81 and name C and segid A) (resid 82 and name N and segid A) (resid 82 and name CA and segid A) (resid 82 and  name C and segid A) 1.00 -120.00 25.00 2
assign (resid 82 and name C and segid A) (resid 83 and name N and segid A) (resid 83 and name CA and segid A) (resid 83 and  name C and segid A) 1.00 -111.00 30.00 2
assign (resid 83 and name C and segid A) (resid 84 and name N and segid A) (resid 84 and name CA and segid A) (resid 84 and  name C and segid A) 1.00 -115.00 30.00 2
assign (resid 84 and name C and segid A) (resid 85 and name N and segid A) (resid 85 and name CA and segid A) (resid 85 and  name C and segid A) 1.00 -125.00 21.00 2
assign (resid 85 and name C and segid A) (resid 86 and name N and segid A) (resid 86 and name CA and segid A) (resid 86 and  name C and segid A) 1.00 -115.00 30.00 2  
assign (resid 86 and name C and segid A) (resid 87 and name N and segid A) (resid 87 and name CA and segid A) (resid 87 and  name C and segid A) 1.00 -100.00 30.00 2
assign (resid 87 and name C and segid A) (resid 88 and name N and segid A) (resid 88 and name CA and segid A) (resid 88 and  name C and segid A) 1.00 -51.00 20.00 2
assign (resid 90 and name C and segid A) (resid 91 and name N and segid A) (resid 91 and name CA and segid A) (resid 91 and  name C and segid A) 1.00 -70.00 30.00 2
assign (resid 91 and name C and segid A) (resid 92 and name N and segid A) (resid 92 and name CA and segid A) (resid 92 and  name C and segid A) 1.00 -71.00 30.00 2
! added based on the general knowledge for PDZ domains in complex with peptides
assign (resid 302 and name C and segid B) (resid 303 and name N and segid B) (resid 303 and name CA and segid B) (resid 303 and  name C and segid B) 1.00 -120.00 60.00 2
assign (resid 303 and name C and segid B) (resid 304 and name N and segid B) (resid 304 and name CA and segid B) (resid 304 and  name C and segid B) 1.00 -120.00 60.00 2
assign (resid 304 and name C and segid B) (resid 305 and name N and segid B) (resid 305 and name CA and segid B) (resid 305 and  name C and segid B) 1.00 -120.00 60.00 2
assign (resid 305 and name C and segid B) (resid 306 and name N and segid B) (resid 306 and name CA and segid B) (resid 306 and  name C and segid B) 1.00 -120.00 60.00 2

! psi angle restraints
assign (resid 2 and name N and segid A) (resid 2 and name CA and segid A) (resid 2 and name C and segid A) (resid 3 and name N and segid A) 1.00 129.00 30.00 2
assign (resid 3 and name N and segid A) (resid 3 and name CA and segid A) (resid 3 and name C and segid A) (resid 4 and name N and segid A) 1.00 126.00 30.00 2
assign (resid 4 and name N and segid A) (resid 4 and name CA and segid A) (resid 4 and name C and segid A) (resid 5 and name N and segid A) 1.00 133.00 40.00 2
assign (resid 5 and name N and segid A) (resid 5 and name CA and segid A) (resid 5 and name C and segid A) (resid 6 and name N and segid A) 1.00 140.00 30.00 2
assign (resid 6 and name N and segid A) (resid 6 and name CA and segid A) (resid 6 and name C and segid A) (resid 7 and name N and segid A) 1.00 130.00 30.00 2
assign (resid 7 and name N and segid A) (resid 7 and name CA and segid A) (resid 7 and name C and segid A) (resid 8 and name N and segid A) 1.00 120.00 30.00 2
assign (resid 8 and name N and segid A) (resid 8 and name CA and segid A) (resid 8 and name C and segid A) (resid 9 and name N and segid A) 1.00 -180.00 30.00 2
assign (resid 10 and name N and segid A) (resid 10 and name CA and segid A) (resid 10 and name C and segid A) (resid 11 and name N and segid A) 1.00 -120.00 60.00 2
assign (resid 12 and name N and segid A) (resid 12 and name CA and segid A) (resid 12 and name C and segid A) (resid 13 and name N and segid A) 1.00 -32.00 30.00 2
assign (resid 14 and name N and segid A) (resid 14 and name CA and segid A) (resid 14 and name C and segid A) (resid 15 and name N and segid A) 1.00 160.0 25.00 2
assign (resid 15 and name N and segid A) (resid 15 and name CA and segid A) (resid 15 and name C and segid A) (resid 16 and name N and segid A) 1.00 147.00 30.00 2  
assign (resid 16 and name N and segid A) (resid 16 and name CA and segid A) (resid 16 and name C and segid A) (resid 17 and name N and segid A) 1.00 153.00 30.00 2
assign (resid 17 and name N and segid A) (resid 17 and name CA and segid A) (resid 17 and name C and segid A) (resid 18 and name N and segid A) 1.00 155.00 30.00 2  
assign (resid 18 and name N and segid A) (resid 18 and name CA and segid A) (resid 18 and name C and segid A) (resid 19 and name N and segid A) 1.00 120.00 30.00 2
assign (resid 20 and name N and segid A) (resid 20 and name CA and segid A) (resid 20 and name C and segid A) (resid 21 and name N and segid A) 1.00 125.00 30.00 2   
assign (resid 21 and name N and segid A) (resid 21 and name CA and segid A) (resid 21 and name C and segid A) (resid 22 and name N and segid A) 1.00 -14.00 30.00 2   
!assign (resid 22 and name N and segid A) (resid 22 and name CA and segid A) (resid 22 and name C and segid A) (resid 23 and name N and segid A) 1.00 165.00 30.00 2   
assign (resid 23 and name N and segid A) (resid 23 and name CA and segid A) (resid 23 and name C and segid A) (resid 24 and name N and segid A) 1.00 140.00 30.00 2 
assign (resid 24 and name N and segid A) (resid 24 and name CA and segid A) (resid 24 and name C and segid A) (resid 25 and name N and segid A) 1.00 -55.00 35.00 2
assign (resid 25 and name N and segid A) (resid 25 and name CA and segid A) (resid 25 and name C and segid A) (resid 26 and name N and segid A) 1.00 150.00 30.00 2
assign (resid 26 and name N and segid A) (resid 26 and name CA and segid A) (resid 26 and name C and segid A) (resid 27 and name N and segid A) 1.00 140.00 30.00 2   
assign (resid 28 and name N and segid A) (resid 28 and name CA and segid A) (resid 28 and name C and segid A) (resid 29 and name N and segid A) 1.00 130.00 30.00 2  
!assign (resid 29 and name N and segid A) (resid 29 and name CA and segid A) (resid 29 and name C and segid A) (resid 30 and name N and segid A) 1.00 -50.00 40.00 2 
assign (resid 30 and name N and segid A) (resid 30 and name CA and segid A) (resid 30 and name C and segid A) (resid 31 and name N and segid A) 1.00 150.00 30.00 2  
assign (resid 31 and name N and segid A) (resid 31 and name CA and segid A) (resid 31 and name C and segid A) (resid 32 and name N and segid A) 1.00 140.00 30.00 2 
assign (resid 32 and name N and segid A) (resid 32 and name CA and segid A) (resid 32 and name C and segid A) (resid 33 and name N and segid A) 1.00 140.00 30.00 2
assign (resid 33 and name N and segid A) (resid 33 and name CA and segid A) (resid 33 and name C and segid A) (resid 34 and name N and segid A) 1.00 133.00 30.00 2
assign (resid 34 and name N and segid A) (resid 34 and name CA and segid A) (resid 34 and name C and segid A) (resid 35 and name N and segid A) 1.00 -20.00 30.00 2 
assign (resid 35 and name N and segid A) (resid 35 and name CA and segid A) (resid 35 and name C and segid A) (resid 36 and name N and segid A) 1.00 144.00 30.00 2
assign (resid 36 and name N and segid A) (resid 36 and name CA and segid A) (resid 36 and name C and segid A) (resid 37 and name N and segid A) 1.00 130.00 30.00 2   
!assign (resid 37 and name N and segid A) (resid 37 and name CA and segid A) (resid 37 and name C and segid A) (resid 38 and name N and segid A) 1.00 125.00 30.00 2     
assign (resid 38 and name N and segid A) (resid 38 and name CA and segid A) (resid 38 and name C and segid A) (resid 39 and name N and segid A) 1.00 132.00 30.00 2    
assign (resid 40 and name N and segid A) (resid 40 and name CA and segid A) (resid 40 and name C and segid A) (resid 41 and name N and segid A) 1.00 169.00 30.00 2
assign (resid 41 and name N and segid A) (resid 41 and name CA and segid A) (resid 41 and name C and segid A) (resid 42 and name N and segid A) 1.00 -50.00 30.00 2   
assign (resid 42 and name N and segid A) (resid 42 and name CA and segid A) (resid 42 and name C and segid A) (resid 43 and name N and segid A) 1.00 -60.00 40.00 2    
assign (resid 43 and name N and segid A) (resid 43 and name CA and segid A) (resid 43 and name C and segid A) (resid 44 and name N and segid A) 1.00 -60.00 30.00 2
assign (resid 44 and name N and segid A) (resid 44 and name CA and segid A) (resid 44 and name C and segid A) (resid 45 and name N and segid A) 1.00 -60.00 30.00 2
!assign (resid 45 and name N and segid A) (resid 45 and name CA and segid A) (resid 45 and name C and segid A) (resid 46 and name N and segid A) 1.00 -60.00 30.00 2  
assign (resid 46 and name N and segid A) (resid 46 and name CA and segid A) (resid 46 and name C and segid A) (resid 47 and name N and segid A) 1.00 0.00 40.00 2     
assign (resid 48 and name N and segid A) (resid 48 and name CA and segid A) (resid 48 and name C and segid A) (resid 49 and name N and segid A) 1.00 125.00 30.0 2 
assign (resid 49 and name N and segid A) (resid 49 and name CA and segid A) (resid 49 and name C and segid A) (resid 50 and name N and segid A) 1.00 153.00 30.00 2
assign (resid 50 and name N and segid A) (resid 50 and name CA and segid A) (resid 50 and name C and segid A) (resid 51 and name N and segid A) 1.00 132.00 20.00 2
assign (resid 51 and name N and segid A) (resid 51 and name CA and segid A) (resid 51 and name C and segid A) (resid 52 and name N and segid A) 1.00 -22.00 30.00 2
assign (resid 52 and name N and segid A) (resid 52 and name CA and segid A) (resid 52 and name C and segid A) (resid 53 and name N and segid A) 1.00 140.00 30.00 2    
assign (resid 53 and name N and segid A) (resid 53 and name CA and segid A) (resid 53 and name C and segid A) (resid 54 and name N and segid A) 1.00 180.00 30.00 2
assign (resid 54 and name N and segid A) (resid 54 and name CA and segid A) (resid 54 and name C and segid A) (resid 55 and name N and segid A) 1.00 133.00 30.00 2
assign (resid 56 and name N and segid A) (resid 56 and name CA and segid A) (resid 56 and name C and segid A) (resid 57 and name N and segid A) 1.00 147.00 30.00 2
assign (resid 57 and name N and segid A) (resid 57 and name CA and segid A) (resid 57 and name C and segid A) (resid 58 and name N and segid A) 1.00 130.00 30.00 2
assign (resid 58 and name N and segid A) (resid 58 and name CA and segid A) (resid 58 and name C and segid A) (resid 59 and name N and segid A) 1.00 45.00 40.00 2  
assign (resid 59 and name N and segid A) (resid 59 and name CA and segid A) (resid 59 and name C and segid A) (resid 60 and name N and segid A) 1.00 20.00 40.00 2  
assign (resid 60 and name N and segid A) (resid 60 and name CA and segid A) (resid 60 and name C and segid A) (resid 61 and name N and segid A) 1.00 127.00 30.00 2  
assign (resid 61 and name N and segid A) (resid 61 and name CA and segid A) (resid 61 and name C and segid A) (resid 62 and name N and segid A) 1.00 134.00 20.00 2 
!assign (resid 63 and name N and segid A) (resid 63 and name CA and segid A) (resid 63 and name C and segid A) (resid 64 and name N and segid A) 1.00 133.00 30.00 2
assign (resid 65 and name N and segid A) (resid 65 and name CA and segid A) (resid 65 and name C and segid A) (resid 66 and name N and segid A) 1.00 160.00 30.00 2
!assign (resid 66 and name N and segid A) (resid 66 and name CA and segid A) (resid 66 and name C and segid A) (resid 67 and name N and segid A) 1.00 165.00 30.00 2
assign (resid 67 and name N and segid A) (resid 67 and name CA and segid A) (resid 67 and name C and segid A) (resid 68 and name N and segid A) 1.00 -50.00 30.00 2 ! 
assign (resid 68 and name N and segid A) (resid 68 and name CA and segid A) (resid 68 and name C and segid A) (resid 69 and name N and segid A) 1.00 -37.00 30.00 2
assign (resid 69 and name N and segid A) (resid 69 and name CA and segid A) (resid 69 and name C and segid A) (resid 70 and name N and segid A) 1.00 -42.00 30.00 2
assign (resid 70 and name N and segid A) (resid 70 and name CA and segid A) (resid 70 and name C and segid A) (resid 71 and name N and segid A) 1.00 -42.00 30.00 2
assign (resid 71 and name N and segid A) (resid 71 and name CA and segid A) (resid 71 and name C and segid A) (resid 72 and name N and segid A) 1.00 -44.00 30.00 2
assign (resid 72 and name N and segid A) (resid 72 and name CA and segid A) (resid 72 and name C and segid A) (resid 73 and name N and segid A) 1.00 -40.00 30.00 2
assign (resid 73 and name N and segid A) (resid 73 and name CA and segid A) (resid 73 and name C and segid A) (resid 74 and name N and segid A) 1.00 -35.00 30.00 2
assign (resid 74 and name N and segid A) (resid 74 and name CA and segid A) (resid 74 and name C and segid A) (resid 75 and name N and segid A) 1.00 -40.00 30.00 2    
assign (resid 75 and name N and segid A) (resid 75 and name CA and segid A) (resid 75 and name C and segid A) (resid 76 and name N and segid A) 1.00 -35.00 30.00 2
assign (resid 79 and name N and segid A) (resid 79 and name CA and segid A) (resid 79 and name C and segid A) (resid 80 and name N and segid A) 1.00 -40.00 30.00 2
assign (resid 81 and name N and segid A) (resid 81 and name CA and segid A) (resid 81 and name C and segid A) (resid 82 and name N and segid A) 1.00 150.00 30.00 2
assign (resid 82 and name N and segid A) (resid 82 and name CA and segid A) (resid 82 and name C and segid A) (resid 83 and name N and segid A) 1.00 130.00 30.00 2 
assign (resid 83 and name N and segid A) (resid 83 and name CA and segid A) (resid 83 and name C and segid A) (resid 84 and name N and segid A) 1.00 150.00 30.00 2
assign (resid 84 and name N and segid A) (resid 84 and name CA and segid A) (resid 84 and name C and segid A) (resid 85 and name N and segid A) 1.00 136.00 30.00 2
assign (resid 85 and name N and segid A) (resid 85 and name CA and segid A) (resid 85 and name C and segid A) (resid 86 and name N and segid A) 1.00 130.00 40.00 2
assign (resid 86 and name N and segid A) (resid 86 and name CA and segid A) (resid 86 and name C and segid A) (resid 87 and name N and segid A) 1.00 125.00 30.00 2 
assign (resid 87 and name N and segid A) (resid 87 and name CA and segid A) (resid 87 and name C and segid A) (resid 88 and name N and segid A) 1.00 120.00 30.00 2   
assign (resid 88 and name N and segid A) (resid 88 and name CA and segid A) (resid 88 and name C and segid A) (resid 89 and name N and segid A) 1.00 148.00 30.00 2
assign (resid 91 and name N and segid A) (resid 91 and name CA and segid A) (resid 91 and name C and segid A) (resid 92 and name N and segid A) 1.00 -38.00 30.00 2
! added based on the general knowledge for PDZ domains in complex with peptides
assign (resid 302 and name N and segid B) (resid 302 and name CA and segid B) (resid 302 and name C and segid B) (resid 303 and name N and segid B) 1.00 120.00 60.00 2
assign (resid 303 and name N and segid B) (resid 303 and name CA and segid B) (resid 303 and name C and segid B) (resid 304 and name N and segid B) 1.00 120.00 60.00 2
assign (resid 304 and name N and segid B) (resid 304 and name CA and segid B) (resid 304 and name C and segid B) (resid 305 and name N and segid B) 1.00 120.00 60.00 2
assign (resid 305 and name N and segid B) (resid 305 and name CA and segid B) (resid 305 and name C and segid B) (resid 306 and name N and segid B) 1.00 120.00 60.00 2

assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 2 and name N and segid A)
 (resid 2 and name HN and segid A) 3 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 3 and name N and segid A)
 (resid 3 and name HN and segid A) -2 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 4 and name N and segid A)
 (resid 4 and name HN and segid A) -1 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 5 and name N and segid A)
 (resid 5 and name HN and segid A) -4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 6 and name N and segid A)
 (resid 6 and name HN and segid A) 3 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 7 and name N and segid A)
 (resid 7 and name HN and segid A) 15 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 8 and name N and segid A)
 (resid 8 and name HN and segid A) 0 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 10 and name N and segid A)
 (resid 10 and name HN and segid A) 4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 11 and name N and segid A)
 (resid 11 and name HN and segid A) 3 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 12 and name N and segid A)
 (resid 12 and name HN and segid A) 3 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 13 and name N and segid A)
 (resid 13 and name HN and segid A) -4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 14 and name N and segid A)
 (resid 14 and name HN and segid A) 0 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 15 and name N and segid A)
 (resid 15 and name HN and segid A) -11 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 16 and name N and segid A)
 (resid 16 and name HN and segid A) -4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 17 and name N and segid A)
 (resid 17 and name HN and segid A) 1 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 18 and name N and segid A)
 (resid 18 and name HN and segid A) 16 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 19 and name N and segid A)
 (resid 19 and name HN and segid A) -15 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 20 and name N and segid A)
 (resid 20 and name HN and segid A) 16 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 21 and name N and segid A)
 (resid 21 and name HN and segid A) -18 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 22 and name N and segid A)
 (resid 22 and name HN and segid A) 10 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 23 and name N and segid A)
 (resid 23 and name HN and segid A) -1 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 24 and name N and segid A)
 (resid 24 and name HN and segid A) 20 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 25 and name N and segid A)
 (resid 25 and name HN and segid A) 9 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 27 and name N and segid A)
 (resid 27 and name HN and segid A) -5 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 28 and name N and segid A)
 (resid 28 and name HN and segid A) 12 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 29 and name N and segid A)
 (resid 29 and name HN and segid A) -1 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 30 and name N and segid A)
 (resid 30 and name HN and segid A) -14 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 31 and name N and segid A)
 (resid 31 and name HN and segid A) 16 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 32 and name N and segid A)
 (resid 32 and name HN and segid A) 8 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 33 and name N and segid A)
 (resid 33 and name HN and segid A) -4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 34 and name N and segid A)
 (resid 34 and name HN and segid A) -10 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 35 and name N and segid A)
 (resid 35 and name HN and segid A) 13 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 36 and name N and segid A)
 (resid 36 and name HN and segid A) -4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 37 and name N and segid A)
 (resid 37 and name HN and segid A) 10 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 38 and name N and segid A)
 (resid 38 and name HN and segid A) 16 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 39 and name N and segid A)
 (resid 39 and name HN and segid A) -11 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 40 and name N and segid A)
 (resid 40 and name HN and segid A) -1 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 41 and name N and segid A)
 (resid 41 and name HN and segid A) -5 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 42 and name N and segid A)
 (resid 42 and name HN and segid A) 2 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 43 and name N and segid A)
 (resid 43 and name HN and segid A) -5 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 44 and name N and segid A)
 (resid 44 and name HN and segid A) -6 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 45 and name N and segid A)
 (resid 45 and name HN and segid A) 1 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 46 and name N and segid A)
 (resid 46 and name HN and segid A) 0 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 47 and name N and segid A)
 (resid 47 and name HN and segid A) -8 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 48 and name N and segid A)
 (resid 48 and name HN and segid A) -15 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 49 and name N and segid A)
 (resid 49 and name HN and segid A) -4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 50 and name N and segid A)
 (resid 50 and name HN and segid A) -2 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 51 and name N and segid A)
 (resid 51 and name HN and segid A) -9 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 52 and name N and segid A)
 (resid 52 and name HN and segid A) -10 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 53 and name N and segid A)
 (resid 53 and name HN and segid A) -2 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 54 and name N and segid A)
 (resid 54 and name HN and segid A) 15 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 55 and name N and segid A)
 (resid 55 and name HN and segid A) 2 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 56 and name N and segid A)
 (resid 56 and name HN and segid A) 2 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 57 and name N and segid A)
 (resid 57 and name HN and segid A) 1 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 58 and name N and segid A)
 (resid 58 and name HN and segid A) -1 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 59 and name N and segid A)
 (resid 59 and name HN and segid A) 0 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 60 and name N and segid A)
 (resid 60 and name HN and segid A) -8 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 61 and name N and segid A)
 (resid 61 and name HN and segid A) 4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 62 and name N and segid A)
 (resid 62 and name HN and segid A) -2 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 63 and name N and segid A)
 (resid 63 and name HN and segid A) 18 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 64 and name N and segid A)
 (resid 64 and name HN and segid A) 4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 65 and name N and segid A)
 (resid 65 and name HN and segid A) 2 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 66 and name N and segid A)
 (resid 66 and name HN and segid A) 5 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 67 and name N and segid A)
 (resid 67 and name HN and segid A) 9 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 68 and name N and segid A)
 (resid 68 and name HN and segid A) 3 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 69 and name N and segid A)
 (resid 69 and name HN and segid A) -4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 70 and name N and segid A)
 (resid 70 and name HN and segid A) 9 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 71 and name N and segid A)
 (resid 71 and name HN and segid A) 4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 72 and name N and segid A)
 (resid 72 and name HN and segid A) -4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 73 and name N and segid A)
 (resid 73 and name HN and segid A) 0 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 74 and name N and segid A)
 (resid 74 and name HN and segid A) 11 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 75 and name N and segid A)
 (resid 75 and name HN and segid A) -1 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 76 and name N and segid A)
 (resid 76 and name HN and segid A) -14 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 77 and name N and segid A)
 (resid 77 and name HN and segid A) 4 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 78 and name N and segid A)
 (resid 78 and name HN and segid A) -9 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 79 and name N and segid A)
 (resid 79 and name HN and segid A) 3 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 80 and name N and segid A)
 (resid 80 and name HN and segid A) 6 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 81 and name N and segid A)
 (resid 81 and name HN and segid A) -2 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
  (resid 82 and name N and segid A)
 (resid 82 and name HN and segid A) -1 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 83 and name N and segid A)
 (resid 83 and name HN and segid A) -1 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 84 and name N and segid A)
 (resid 84 and name HN and segid A) 0 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 85 and name N and segid A)
 (resid 85 and name HN and segid A) 8 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 86 and name N and segid A)
 (resid 86 and name HN and segid A) 5 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 87 and name N and segid A)
 (resid 87 and name HN and segid A) 14 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 89 and name N and segid A)
 (resid 89 and name HN and segid A) 2 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 90 and name N and segid A)
 (resid 90 and name HN and segid A) 7 0.5
assign (resid 93 and name OO and segid A)
       (resid 93 and name Z and segid A)
       (resid 93 and name X and segid A)
       (resid 93 and name Y and segid A)
 (resid 91 and name N and segid A)
 (resid 91 and name HN and segid A) -2 0.5






  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   MET   1           HA       MET   1  -9.018   2.355  -7.677
    2    H1   MET   1           1HT      MET   1  -9.432  -0.004  -7.493
    3    H2   MET   1           2HT      MET   1  -7.787  -0.249  -7.069
    4    H3   MET   1           3HT      MET   1  -8.194   0.374  -8.616
    5    HB2  MET   1           2HB      MET   1  -9.809   1.106  -5.592
    6    HB3  MET   1           1HB      MET   1  -8.167   1.282  -4.986
    7    HG2  MET   1           2HG      MET   1  -8.795   3.839  -5.732
    8    HG3  MET   1           1HG      MET   1 -10.335   3.225  -5.136
    9    HE1  MET   1           3HE      MET   1  -9.842   5.027  -2.154
   10    HE2  MET   1           1HE      MET   1 -10.619   3.452  -1.995
   11    HE3  MET   1           2HE      MET   1 -10.841   4.400  -3.465
   12    H    GLU   2           H        GLU   2  -7.396   3.379  -8.707
   13    HA   GLU   2           HA       GLU   2  -4.661   3.117  -7.681
   14    HB2  GLU   2           2HB      GLU   2  -3.903   4.038  -9.768
   15    HB3  GLU   2           1HB      GLU   2  -5.056   2.760 -10.114
   16    HG2  GLU   2           2HG      GLU   2  -6.147   5.498  -9.939
   17    HG3  GLU   2           1HG      GLU   2  -5.097   5.148 -11.309
   18    H    ILE   3           H        ILE   3  -3.348   5.016  -7.319
   19    HA   ILE   3           HA       ILE   3  -4.723   7.566  -7.054
   20    HB   ILE   3           HB       ILE   3  -3.273   6.212  -4.764
   21   HG12  ILE   3          2HG1      ILE   3  -5.670   6.893  -3.745
   22   HG13  ILE   3          1HG1      ILE   3  -6.142   6.624  -5.418
   23   HG21  ILE   3          1HG2      ILE   3  -4.375   8.995  -5.042
   24   HG22  ILE   3          2HG2      ILE   3  -2.707   8.515  -4.739
   25   HG23  ILE   3          3HG2      ILE   3  -3.934   8.267  -3.498
   26   HD11  ILE   3          3HD1      ILE   3  -4.573   4.434  -4.816
   27   HD12  ILE   3          1HD1      ILE   3  -6.335   4.484  -4.876
   28   HD13  ILE   3          2HD1      ILE   3  -5.499   4.721  -3.342
   29    H    LYS   4           H        LYS   4  -3.368   9.156  -7.806
   30    HA   LYS   4           HA       LYS   4  -0.585   8.411  -8.276
   31    HB2  LYS   4           2HB      LYS   4  -2.356  10.595  -9.339
   32    HB3  LYS   4           1HB      LYS   4  -0.615  10.639  -9.572
   33    HG2  LYS   4           2HG      LYS   4  -0.622   8.743 -10.924
   34    HG3  LYS   4           1HG      LYS   4  -2.218   8.239 -10.367
   35    HD2  LYS   4           2HD      LYS   4  -2.222  10.878 -11.606
   36    HD3  LYS   4           1HD      LYS   4  -1.668   9.607 -12.696
   37    HE2  LYS   4           2HE      LYS   4  -3.819   8.406 -11.571
   38    HE3  LYS   4           1HE      LYS   4  -4.335  10.093 -11.543
   39    HZ1  LYS   4           3HZ      LYS   4  -5.027   9.045 -13.581
   40    HZ2  LYS   4           1HZ      LYS   4  -3.441   8.571 -13.933
   41    HZ3  LYS   4           2HZ      LYS   4  -3.853  10.212 -13.929
   42    H    LEU   5           H        LEU   5   0.300   8.584  -6.280
   43    HA   LEU   5           HA       LEU   5   0.140  11.093  -4.810
   44    HG   LEU   5           HG       LEU   5  -0.961   9.654  -3.037
   45    HB2  LEU   5           2HB      LEU   5   0.840   8.348  -4.184
   46    HB3  LEU   5           1HB      LEU   5   2.012   9.475  -3.530
   47   HD11  LEU   5          1HD1      LEU   5  -0.302   8.899  -0.724
   48   HD12  LEU   5          2HD1      LEU   5   1.248   8.417  -1.415
   49   HD13  LEU   5          3HD1      LEU   5  -0.243   7.664  -1.982
   50   HD21  LEU   5          3HD2      LEU   5   1.414  11.127  -1.917
   51   HD22  LEU   5          1HD2      LEU   5  -0.185  11.148  -1.173
   52   HD23  LEU   5          2HD2      LEU   5   0.040  11.796  -2.797
   53    H    ILE   6           H        ILE   6   1.623  12.656  -4.781
   54    HA   ILE   6           HA       ILE   6   3.948  12.385  -6.507
   55    HB   ILE   6           HB       ILE   6   2.539  14.409  -6.670
   56   HG12  ILE   6          2HG1      ILE   6   5.344  14.998  -5.697
   57   HG13  ILE   6          1HG1      ILE   6   4.942  14.427  -7.313
   58   HG21  ILE   6          1HG2      ILE   6   3.665  15.319  -4.045
   59   HG22  ILE   6          2HG2      ILE   6   2.125  14.465  -4.140
   60   HG23  ILE   6          3HG2      ILE   6   2.334  16.003  -4.978
   61   HD11  ILE   6          3HD1      ILE   6   3.361  16.584  -7.198
   62   HD12  ILE   6          1HD1      ILE   6   5.026  16.626  -7.775
   63   HD13  ILE   6          2HD1      ILE   6   4.656  17.102  -6.119
   64    H    LYS   7           H        LYS   7   5.945  11.991  -5.799
   65    HA   LYS   7           HA       LYS   7   6.534  11.415  -3.125
   66    HB2  LYS   7           2HB      LYS   7   7.812  10.438  -4.936
   67    HB3  LYS   7           1HB      LYS   7   8.395  12.022  -5.422
   68    HG2  LYS   7           2HG      LYS   7  10.181  11.076  -4.265
   69    HG3  LYS   7           1HG      LYS   7   9.436  12.166  -3.097
   70    HD2  LYS   7           2HD      LYS   7   8.103  10.081  -2.352
   71    HD3  LYS   7           1HD      LYS   7   9.345   9.175  -3.218
   72    HE2  LYS   7           2HE      LYS   7  11.068  10.062  -1.827
   73    HE3  LYS   7           1HE      LYS   7   9.957  11.214  -1.088
   74    HZ1  LYS   7           3HZ      LYS   7   9.934   8.262  -0.778
   75    HZ2  LYS   7           1HZ      LYS   7   8.718   9.283  -0.191
   76    HZ3  LYS   7           2HZ      LYS   7  10.292   9.409   0.411
   77    H    GLY   8           H        GLY   8   6.809  12.714  -1.458
   78    HA2  GLY   8           2HA      GLY   8   7.676  15.493  -1.940
   79    HA3  GLY   8           1HA      GLY   8   6.729  14.958  -0.560
   80    HA   PRO   9           HA       PRO   9  11.509  15.237   0.226
   81    HB2  PRO   9           2HB      PRO   9  10.483  17.211   2.207
   82    HB3  PRO   9           1HB      PRO   9  11.952  17.259   1.227
   83    HG2  PRO   9           2HG      PRO   9   9.865  18.781   0.598
   84    HG3  PRO   9           1HG      PRO   9  10.824  17.990  -0.667
   85    HD2  PRO   9           2HD      PRO   9   8.138  17.253   0.417
   86    HD3  PRO   9           1HD      PRO   9   8.744  17.170  -1.249
   87    H    LYS  10           H        LYS  10   8.719  15.442   2.426
   88    HA   LYS  10           HA       LYS  10   9.916  14.233   4.658
   89    HB2  LYS  10           2HB      LYS  10   7.041  14.425   3.768
   90    HB3  LYS  10           1HB      LYS  10   7.498  13.628   5.268
   91    HG2  LYS  10           2HG      LYS  10   8.702  16.253   5.032
   92    HG3  LYS  10           1HG      LYS  10   6.943  16.316   4.922
   93    HD2  LYS  10           2HD      LYS  10   7.184  16.434   7.193
   94    HD3  LYS  10           1HD      LYS  10   7.115  14.682   6.999
   95    HE2  LYS  10           2HE      LYS  10   9.791  15.916   6.777
   96    HE3  LYS  10           1HE      LYS  10   9.047  15.962   8.374
   97    HZ1  LYS  10           3HZ      LYS  10   9.581  13.548   6.730
   98    HZ2  LYS  10           1HZ      LYS  10   8.710  13.534   8.181
   99    HZ3  LYS  10           2HZ      LYS  10  10.341  13.980   8.177
  100    H    GLY  11           H        GLY  11   7.505  12.668   2.518
  101    HA2  GLY  11           2HA      GLY  11   8.683  10.524   1.528
  102    HA3  GLY  11           1HA      GLY  11   8.639  10.066   3.224
  103    H    LEU  12           H        LEU  12   7.214   8.396   3.135
  104    HA   LEU  12           HA       LEU  12   4.714   8.649   1.696
  105    HG   LEU  12           HG       LEU  12   5.446   6.860   0.435
  106    HB2  LEU  12           2HB      LEU  12   5.962   6.466   3.344
  107    HB3  LEU  12           1HB      LEU  12   4.308   6.355   2.778
  108   HD11  LEU  12          1HD1      LEU  12   7.626   5.979   0.191
  109   HD12  LEU  12          2HD1      LEU  12   7.638   5.361   1.842
  110   HD13  LEU  12          3HD1      LEU  12   7.693   7.099   1.551
  111   HD21  LEU  12          3HD2      LEU  12   4.900   4.386   1.929
  112   HD22  LEU  12          1HD2      LEU  12   5.924   4.206   0.505
  113   HD23  LEU  12          2HD2      LEU  12   4.318   4.917   0.351
  114    H    GLY  13           H        GLY  13   5.678   8.184   5.109
  115    HA2  GLY  13           2HA      GLY  13   4.746   9.196   6.980
  116    HA3  GLY  13           1HA      GLY  13   3.496   9.883   5.964
  117    H    PHE  14           H        PHE  14   4.229   6.430   6.065
  118    HA   PHE  14           HA       PHE  14   2.176   5.830   7.968
  119    HD1  PHE  14           2HD      PHE  14   2.058   3.052   4.956
  120    HD2  PHE  14           1HD      PHE  14   1.281   7.120   3.977
  121    HE1  PHE  14           2HE      PHE  14   2.585   2.581   2.602
  122    HE2  PHE  14           1HE      PHE  14   1.803   6.656   1.620
  123    HZ   PHE  14           HZ       PHE  14   2.459   4.385   0.929
  124    HB2  PHE  14           2HB      PHE  14   0.692   4.593   6.424
  125    HB3  PHE  14           1HB      PHE  14   0.723   6.318   6.089
  126    H    SER  15           H        SER  15   1.647   3.215   7.522
  127    HA   SER  15           HA       SER  15   4.248   1.928   7.146
  128    HG   SER  15           HG       SER  15   1.733   2.414   9.673
  129    HB2  SER  15           2HB      SER  15   3.619   0.430   9.049
  130    HB3  SER  15           1HB      SER  15   3.915   2.091   9.539
  131    H    ILE  16           H        ILE  16   3.864  -0.566   7.051
  132    HA   ILE  16           HA       ILE  16   1.296  -1.362   5.946
  133    HB   ILE  16           HB       ILE  16   1.965  -1.961   3.801
  134   HG12  ILE  16          2HG1      ILE  16   4.190  -2.933   4.579
  135   HG13  ILE  16          1HG1      ILE  16   4.130  -2.259   2.957
  136   HG21  ILE  16          1HG2      ILE  16   3.350   0.653   4.332
  137   HG22  ILE  16          2HG2      ILE  16   1.647   0.424   3.927
  138   HG23  ILE  16          3HG2      ILE  16   2.894   0.044   2.741
  139   HD11  ILE  16          3HD1      ILE  16   4.917  -0.315   4.953
  140   HD12  ILE  16          1HD1      ILE  16   5.676  -0.748   3.420
  141   HD13  ILE  16          2HD1      ILE  16   6.002  -1.706   4.868
  142    H    ALA  17           H        ALA  17   1.394  -3.692   5.250
  143    HA   ALA  17           HA       ALA  17   3.432  -5.293   6.611
  144    HB1  ALA  17           3HB      ALA  17   1.232  -6.797   7.091
  145    HB2  ALA  17           1HB      ALA  17   0.559  -5.174   7.264
  146    HB3  ALA  17           2HB      ALA  17   1.928  -5.673   8.257
  147    H    GLY  18           H        GLY  18   3.283  -7.676   5.711
  148    HA2  GLY  18           2HA      GLY  18   1.761  -8.377   3.560
  149    HA3  GLY  18           1HA      GLY  18   3.007  -7.386   2.846
  150    H    GLY  19           H        GLY  19   2.183 -10.447   2.875
  151    HA2  GLY  19           2HA      GLY  19   3.716 -12.027   1.964
  152    HA3  GLY  19           1HA      GLY  19   4.995 -11.285   2.905
  153    H    VAL  20           H        VAL  20   4.539 -14.027   2.789
  154    HA   VAL  20           HA       VAL  20   3.021 -15.017   4.958
  155    HB   VAL  20           HB       VAL  20   5.467 -16.309   3.724
  156   HG11  VAL  20          1HG1      VAL  20   4.903 -17.418   5.754
  157   HG12  VAL  20          2HG1      VAL  20   4.293 -18.414   4.432
  158   HG13  VAL  20          3HG1      VAL  20   3.184 -17.404   5.357
  159   HG21  VAL  20          3HG2      VAL  20   3.318 -15.590   2.292
  160   HG22  VAL  20          1HG2      VAL  20   2.747 -17.140   2.910
  161   HG23  VAL  20          2HG2      VAL  20   4.238 -17.059   1.973
  162    H    GLY  21           H        GLY  21   3.527 -15.370   7.095
  163    HA2  GLY  21           2HA      GLY  21   4.857 -15.495   9.020
  164    HA3  GLY  21           1HA      GLY  21   6.256 -15.044   8.057
  165    H    ASN  22           H        ASN  22   4.534 -12.739   7.001
  166    HA   ASN  22           HA       ASN  22   4.575 -10.976   9.340
  167    HB2  ASN  22           2HB      ASN  22   5.396  -9.222   7.490
  168    HB3  ASN  22           1HB      ASN  22   6.538 -10.157   8.440
  169   HD21  ASN  22          1HD2      ASN  22   8.170 -10.728   7.212
  170   HD22  ASN  22          2HD2      ASN  22   8.064 -11.343   5.601
  171    H    GLN  23           H        GLN  23   2.504 -12.367   7.468
  172    HA   GLN  23           HA       GLN  23   1.183 -10.576   5.858
  173    HB2  GLN  23           2HB      GLN  23   0.184 -12.883   7.514
  174    HB3  GLN  23           1HB      GLN  23  -0.874 -11.979   6.442
  175    HG2  GLN  23           2HG      GLN  23   0.623 -12.559   4.556
  176    HG3  GLN  23           1HG      GLN  23   1.563 -13.560   5.663
  177   HE21  GLN  23          1HE2      GLN  23  -1.814 -13.069   4.657
  178   HE22  GLN  23          2HE2      GLN  23  -2.222 -14.747   4.624
  179    H    HIS  24           H        HIS  24  -0.464  -9.134   6.069
  180    HA   HIS  24           HA       HIS  24  -0.841  -7.932   8.697
  181    HD1  HIS  24           1HD      HIS  24  -0.515  -5.095   8.898
  182    HD2  HIS  24           2HD      HIS  24  -4.104  -5.652   6.894
  183    HE1  HIS  24           1HE      HIS  24  -2.053  -3.346   9.795
  184    HE2  HIS  24           2HE      HIS  24  -4.185  -3.602   8.480
  185    HB2  HIS  24           2HB      HIS  24  -0.418  -6.534   6.647
  186    HB3  HIS  24           1HB      HIS  24  -1.972  -7.056   6.032
  187    H    ILE  25           H        ILE  25  -2.583  -9.813   6.344
  188    HA   ILE  25           HA       ILE  25  -4.872  -9.971   8.173
  189    HB   ILE  25           HB       ILE  25  -5.182  -9.674   5.182
  190   HG12  ILE  25          2HG1      ILE  25  -4.360  -7.587   6.325
  191   HG13  ILE  25          1HG1      ILE  25  -5.919  -7.421   5.529
  192   HG21  ILE  25          1HG2      ILE  25  -7.014 -10.887   5.989
  193   HG22  ILE  25          2HG2      ILE  25  -7.584  -9.219   5.903
  194   HG23  ILE  25          3HG2      ILE  25  -7.121  -9.913   7.456
  195   HD11  ILE  25          3HD1      ILE  25  -6.305  -8.212   8.253
  196   HD12  ILE  25          1HD1      ILE  25  -6.855  -6.760   7.419
  197   HD13  ILE  25          2HD1      ILE  25  -5.262  -6.793   8.175
  198    HA   PRO  26           HA       PRO  26  -4.114 -14.329   7.608
  199    HB2  PRO  26           2HB      PRO  26  -6.638 -15.163   8.398
  200    HB3  PRO  26           1HB      PRO  26  -5.287 -14.837   9.487
  201    HG2  PRO  26           2HG      PRO  26  -7.598 -13.093   8.761
  202    HG3  PRO  26           1HG      PRO  26  -6.806 -13.311  10.333
  203    HD2  PRO  26           2HD      PRO  26  -6.345 -11.147   8.822
  204    HD3  PRO  26           1HD      PRO  26  -5.051 -11.896   9.783
  205    H    GLY  27           H        GLY  27  -4.132 -15.370   5.727
  206    HA2  GLY  27           2HA      GLY  27  -5.149 -16.521   3.947
  207    HA3  GLY  27           1HA      GLY  27  -6.612 -15.588   4.203
  208    H    ASP  28           H        ASP  28  -4.490 -13.176   4.243
  209    HA   ASP  28           HA       ASP  28  -4.228 -12.983   1.324
  210    HB2  ASP  28           2HB      ASP  28  -5.999 -11.476   2.918
  211    HB3  ASP  28           1HB      ASP  28  -4.669 -10.391   2.523
  212    H    ASN  29           H        ASN  29  -2.100 -12.969   0.950
  213    HA   ASN  29           HA       ASN  29  -0.260 -11.829   2.893
  214    HB2  ASN  29           2HB      ASN  29   0.560 -12.975   0.239
  215    HB3  ASN  29           1HB      ASN  29   1.473 -12.910   1.743
  216   HD21  ASN  29          1HD2      ASN  29   1.487 -14.655   2.993
  217   HD22  ASN  29          2HD2      ASN  29   0.441 -16.018   2.823
  218    H    SER  30           H        SER  30  -2.113 -10.191   1.000
  219    HA   SER  30           HA       SER  30  -0.376  -8.757  -0.738
  220    HG   SER  30           HG       SER  30  -3.885  -9.124  -1.213
  221    HB2  SER  30           2HB      SER  30  -3.089  -7.987   0.373
  222    HB3  SER  30           1HB      SER  30  -2.257  -7.154  -0.940
  223    H    ILE  31           H        ILE  31  -0.506  -6.162  -0.408
  224    HA   ILE  31           HA       ILE  31   0.822  -5.737   2.176
  225    HB   ILE  31           HB       ILE  31   0.930  -3.895  -0.209
  226   HG12  ILE  31          2HG1      ILE  31   2.149  -5.577  -1.119
  227   HG13  ILE  31          1HG1      ILE  31   3.411  -4.918  -0.092
  228   HG21  ILE  31          1HG2      ILE  31   2.901  -2.971   0.949
  229   HG22  ILE  31          2HG2      ILE  31   2.552  -4.021   2.321
  230   HG23  ILE  31          3HG2      ILE  31   1.405  -2.765   1.860
  231   HD11  ILE  31          3HD1      ILE  31   1.993  -7.481   0.052
  232   HD12  ILE  31          1HD1      ILE  31   2.265  -6.680   1.597
  233   HD13  ILE  31          2HD1      ILE  31   3.631  -7.055   0.548
  234    H    TYR  32           H        TYR  32  -0.453  -5.009   3.716
  235    HA   TYR  32           HA       TYR  32  -2.559  -3.050   3.072
  236    HD1  TYR  32           2HD      TYR  32  -2.170  -6.593   3.281
  237    HD2  TYR  32           1HD      TYR  32  -5.608  -4.355   4.399
  238    HE1  TYR  32           2HE      TYR  32  -3.587  -8.181   2.058
  239    HE2  TYR  32           1HE      TYR  32  -7.045  -5.927   3.198
  240    HH   TYR  32           HH       TYR  32  -5.908  -8.126   0.968
  241    HB2  TYR  32           2HB      TYR  32  -2.312  -4.981   5.377
  242    HB3  TYR  32           1HB      TYR  32  -3.556  -3.746   5.267
  243    H    VAL  33           H        VAL  33  -2.770  -1.182   4.288
  244    HA   VAL  33           HA       VAL  33  -0.379  -0.223   5.579
  245    HB   VAL  33           HB       VAL  33  -3.055   1.092   5.078
  246   HG11  VAL  33          1HG1      VAL  33  -0.738   1.972   6.706
  247   HG12  VAL  33          2HG1      VAL  33  -2.454   2.335   6.885
  248   HG13  VAL  33          3HG1      VAL  33  -1.498   3.176   5.664
  249   HG21  VAL  33          3HG2      VAL  33  -0.529   0.885   3.615
  250   HG22  VAL  33          1HG2      VAL  33  -1.136   2.534   3.770
  251   HG23  VAL  33          2HG2      VAL  33  -2.147   1.288   3.039
  252    H    THR  34           H        THR  34   0.026  -0.298   7.696
  253    HA   THR  34           HA       THR  34  -2.092  -1.243   9.481
  254    HB   THR  34           HB       THR  34  -0.480  -2.246  10.770
  255    HG1  THR  34           1HG      THR  34   1.149  -1.144  11.450
  256   HG21  THR  34          3HG2      THR  34  -0.165  -2.739   8.154
  257   HG22  THR  34          1HG2      THR  34   0.772  -3.528   9.421
  258   HG23  THR  34          2HG2      THR  34   1.449  -2.150   8.554
  259    H    LYS  35           H        LYS  35  -0.101   1.593   8.994
  260    HA   LYS  35           HA       LYS  35  -1.608   3.030  10.999
  261    HB2  LYS  35           2HB      LYS  35   0.384   1.744  12.112
  262    HB3  LYS  35           1HB      LYS  35   1.365   3.011  11.402
  263    HG2  LYS  35           2HG      LYS  35  -0.900   3.422  13.335
  264    HG3  LYS  35           1HG      LYS  35   0.821   3.480  13.714
  265    HD2  LYS  35           2HD      LYS  35   0.948   5.310  11.916
  266    HD3  LYS  35           1HD      LYS  35  -0.807   5.391  12.074
  267    HE2  LYS  35           2HE      LYS  35  -0.715   6.348  14.121
  268    HE3  LYS  35           1HE      LYS  35   0.721   5.444  14.596
  269    HZ1  LYS  35           3HZ      LYS  35   1.129   7.838  14.366
  270    HZ2  LYS  35           1HZ      LYS  35   0.719   7.751  12.727
  271    HZ3  LYS  35           2HZ      LYS  35   2.078   6.927  13.304
  272    H    ILE  36           H        ILE  36  -2.001   4.969  10.101
  273    HA   ILE  36           HA       ILE  36  -0.057   6.037   8.180
  274    HB   ILE  36           HB       ILE  36  -2.930   6.865   8.621
  275   HG12  ILE  36          2HG1      ILE  36  -1.591   5.037   6.637
  276   HG13  ILE  36          1HG1      ILE  36  -3.006   4.723   7.635
  277   HG21  ILE  36          1HG2      ILE  36  -2.691   8.221   6.647
  278   HG22  ILE  36          2HG2      ILE  36  -1.037   7.656   6.410
  279   HG23  ILE  36          3HG2      ILE  36  -1.433   8.669   7.799
  280   HD11  ILE  36          3HD1      ILE  36  -2.786   6.280   5.100
  281   HD12  ILE  36          1HD1      ILE  36  -4.102   6.599   6.231
  282   HD13  ILE  36          2HD1      ILE  36  -3.907   4.990   5.536
  283    H    ILE  37           H        ILE  37   1.199   7.705   8.720
  284    HA   ILE  37           HA       ILE  37   0.915   9.009  11.273
  285    HB   ILE  37           HB       ILE  37   2.924   9.271   9.035
  286   HG12  ILE  37          2HG1      ILE  37   4.408   8.535  11.066
  287   HG13  ILE  37          1HG1      ILE  37   2.878   7.989  11.744
  288   HG21  ILE  37          1HG2      ILE  37   2.685  10.894  11.547
  289   HG22  ILE  37          2HG2      ILE  37   2.871  11.451   9.884
  290   HG23  ILE  37          3HG2      ILE  37   4.222  10.675  10.709
  291   HD11  ILE  37          3HD1      ILE  37   2.558   6.431  10.012
  292   HD12  ILE  37          1HD1      ILE  37   4.246   6.276  10.500
  293   HD13  ILE  37          2HD1      ILE  37   3.832   7.152   9.027
  294    H    GLU  38           H        GLU  38   0.576  11.231  11.632
  295    HA   GLU  38           HA       GLU  38  -1.340  12.476   9.988
  296    HB2  GLU  38           2HB      GLU  38   0.303  13.375  12.327
  297    HB3  GLU  38           1HB      GLU  38  -0.646  14.551  11.431
  298    HG2  GLU  38           2HG      GLU  38  -2.169  13.988  13.009
  299    HG3  GLU  38           1HG      GLU  38  -2.554  12.756  11.808
  300    H    GLY  39           H        GLY  39  -1.221  14.320   8.671
  301    HA2  GLY  39           2HA      GLY  39  -0.336  15.649   7.033
  302    HA3  GLY  39           1HA      GLY  39   1.074  15.784   8.066
  303    H    GLY  40           H        GLY  40   0.265  12.580   7.051
  304    HA2  GLY  40           2HA      GLY  40   2.690  12.491   5.444
  305    HA3  GLY  40           1HA      GLY  40   1.726  11.116   5.957
  306    H    ALA  41           H        ALA  41   2.659  11.162   3.413
  307    HA   ALA  41           HA       ALA  41   1.246  12.359   1.395
  308    HB1  ALA  41           3HB      ALA  41   2.153   9.487   1.334
  309    HB2  ALA  41           1HB      ALA  41   3.225  10.872   1.128
  310    HB3  ALA  41           2HB      ALA  41   1.938  10.572  -0.040
  311    H    ALA  42           H        ALA  42   0.425   9.189   2.858
  312    HA   ALA  42           HA       ALA  42  -2.007   8.899   1.428
  313    HB1  ALA  42           3HB      ALA  42  -1.024   6.924   2.261
  314    HB2  ALA  42           1HB      ALA  42  -2.498   7.156   3.200
  315    HB3  ALA  42           2HB      ALA  42  -0.933   7.567   3.900
  316    H    HIS  43           H        HIS  43  -1.340   9.853   4.798
  317    HA   HIS  43           HA       HIS  43  -3.906  10.276   5.706
  318    HD1  HIS  43           1HD      HIS  43  -2.851  14.002   7.083
  319    HD2  HIS  43           2HD      HIS  43  -3.855  10.485   9.056
  320    HE1  HIS  43           1HE      HIS  43  -4.246  14.712   9.049
  321    HE2  HIS  43           2HE      HIS  43  -4.912  12.561  10.184
  322    HB2  HIS  43           2HB      HIS  43  -1.870  10.395   7.103
  323    HB3  HIS  43           1HB      HIS  43  -1.462  11.936   6.362
  324    H    LYS  44           H        LYS  44  -1.828  12.583   3.968
  325    HA   LYS  44           HA       LYS  44  -3.715  14.718   4.020
  326    HB2  LYS  44           2HB      LYS  44  -1.228  14.208   2.396
  327    HB3  LYS  44           1HB      LYS  44  -2.212  15.646   2.171
  328    HG2  LYS  44           2HG      LYS  44  -1.775  16.394   4.385
  329    HG3  LYS  44           1HG      LYS  44  -1.022  14.857   4.818
  330    HD2  LYS  44           2HD      LYS  44   0.921  15.337   3.710
  331    HD3  LYS  44           1HD      LYS  44   0.118  16.370   2.526
  332    HE2  LYS  44           2HE      LYS  44  -0.289  17.741   4.858
  333    HE3  LYS  44           1HE      LYS  44   1.308  17.040   5.116
  334    HZ1  LYS  44           3HZ      LYS  44   0.492  18.709   2.797
  335    HZ2  LYS  44           1HZ      LYS  44   2.020  18.012   3.009
  336    HZ3  LYS  44           2HZ      LYS  44   1.477  19.203   4.081
  337    H    ASP  45           H        ASP  45  -2.942  12.178   1.682
  338    HA   ASP  45           HA       ASP  45  -4.479  13.134  -0.468
  339    HB2  ASP  45           2HB      ASP  45  -2.751  11.158  -0.309
  340    HB3  ASP  45           1HB      ASP  45  -4.183  10.193   0.036
  341    H    GLY  46           H        GLY  46  -5.295  10.780   2.079
  342    HA2  GLY  46           2HA      GLY  46  -7.387  10.593   3.145
  343    HA3  GLY  46           1HA      GLY  46  -8.104  11.554   1.865
  344    H    LYS  47           H        LYS  47  -6.778   9.794  -0.202
  345    HA   LYS  47           HA       LYS  47  -8.930   8.010  -0.592
  346    HB2  LYS  47           2HB      LYS  47  -6.231   8.274  -1.905
  347    HB3  LYS  47           1HB      LYS  47  -7.381   7.033  -2.385
  348    HG2  LYS  47           2HG      LYS  47  -9.004   8.722  -2.991
  349    HG3  LYS  47           1HG      LYS  47  -7.921   9.996  -2.429
  350    HD2  LYS  47           2HD      LYS  47  -6.285   8.748  -4.152
  351    HD3  LYS  47           1HD      LYS  47  -7.838   8.379  -4.906
  352    HE2  LYS  47           2HE      LYS  47  -7.233  11.178  -4.052
  353    HE3  LYS  47           1HE      LYS  47  -6.537  10.555  -5.546
  354    HZ1  LYS  47           3HZ      LYS  47  -8.607  11.669  -5.995
  355    HZ2  LYS  47           1HZ      LYS  47  -9.430  10.694  -4.885
  356    HZ3  LYS  47           2HZ      LYS  47  -8.791  10.016  -6.297
  357    H    LEU  48           H        LEU  48  -5.630   7.525   0.632
  358    HA   LEU  48           HA       LEU  48  -6.106   4.683   0.989
  359    HG   LEU  48           HG       LEU  48  -4.211   3.351   0.986
  360    HB2  LEU  48           2HB      LEU  48  -3.877   5.844   0.304
  361    HB3  LEU  48           1HB      LEU  48  -3.691   6.123   2.025
  362   HD11  LEU  48          1HD1      LEU  48  -2.328   4.060  -0.304
  363   HD12  LEU  48          2HD1      LEU  48  -1.744   3.021   0.996
  364   HD13  LEU  48          3HD1      LEU  48  -1.556   4.770   1.114
  365   HD21  LEU  48          3HD2      LEU  48  -3.692   2.667   3.056
  366   HD22  LEU  48          1HD2      LEU  48  -4.098   4.320   3.504
  367   HD23  LEU  48          2HD2      LEU  48  -2.415   3.866   3.253
  368    H    GLN  49           H        GLN  49  -6.900   3.810   2.743
  369    HA   GLN  49           HA       GLN  49  -6.569   5.108   5.342
  370    HB2  GLN  49           2HB      GLN  49  -8.858   4.847   5.915
  371    HB3  GLN  49           1HB      GLN  49  -8.829   5.643   4.354
  372    HG2  GLN  49           2HG      GLN  49  -9.208   2.679   4.666
  373    HG3  GLN  49           1HG      GLN  49 -10.547   3.822   4.671
  374   HE21  GLN  49          1HE2      GLN  49  -8.451   1.971   2.779
  375   HE22  GLN  49          2HE2      GLN  49  -8.910   2.583   1.230
  376    H    ILE  50           H        ILE  50  -6.512   3.660   7.113
  377    HA   ILE  50           HA       ILE  50  -5.241   1.273   6.853
  378    HB   ILE  50           HB       ILE  50  -6.299   0.582   9.054
  379   HG12  ILE  50          2HG1      ILE  50  -7.338   3.275   9.541
  380   HG13  ILE  50          1HG1      ILE  50  -8.265   2.399   8.328
  381   HG21  ILE  50          1HG2      ILE  50  -4.203   1.687   9.077
  382   HG22  ILE  50          2HG2      ILE  50  -5.202   2.468  10.302
  383   HG23  ILE  50          3HG2      ILE  50  -4.946   3.251   8.743
  384   HD11  ILE  50          3HD1      ILE  50  -7.710   1.551  11.158
  385   HD12  ILE  50          1HD1      ILE  50  -8.488   0.529   9.949
  386   HD13  ILE  50          2HD1      ILE  50  -9.258   2.031  10.461
  387    H    GLY  51           H        GLY  51  -5.733  -0.877   6.480
  388    HA2  GLY  51           2HA      GLY  51  -7.254  -2.708   6.401
  389    HA3  GLY  51           1HA      GLY  51  -8.559  -1.586   6.091
  390    H    ASP  52           H        ASP  52  -6.693  -0.216   4.001
  391    HA   ASP  52           HA       ASP  52  -7.689  -1.712   1.818
  392    HB2  ASP  52           2HB      ASP  52  -6.261  -0.080   0.456
  393    HB3  ASP  52           1HB      ASP  52  -7.566   0.589   1.422
  394    H    LYS  53           H        LYS  53  -6.504  -2.721   0.142
  395    HA   LYS  53           HA       LYS  53  -3.936  -3.832   1.057
  396    HB2  LYS  53           2HB      LYS  53  -4.472  -5.760  -0.472
  397    HB3  LYS  53           1HB      LYS  53  -5.507  -5.607   0.935
  398    HG2  LYS  53           2HG      LYS  53  -6.831  -4.160  -1.013
  399    HG3  LYS  53           1HG      LYS  53  -6.182  -5.555  -1.874
  400    HD2  LYS  53           2HD      LYS  53  -7.343  -6.242   0.712
  401    HD3  LYS  53           1HD      LYS  53  -8.503  -5.504  -0.394
  402    HE2  LYS  53           2HE      LYS  53  -8.327  -7.205  -1.937
  403    HE3  LYS  53           1HE      LYS  53  -6.707  -7.656  -1.411
  404    HZ1  LYS  53           3HZ      LYS  53  -8.371  -8.110   0.750
  405    HZ2  LYS  53           1HZ      LYS  53  -7.646  -9.270  -0.245
  406    HZ3  LYS  53           2HZ      LYS  53  -9.202  -8.713  -0.594
  407    H    LEU  54           H        LEU  54  -2.306  -4.072  -0.389
  408    HA   LEU  54           HA       LEU  54  -2.421  -2.211  -2.638
  409    HG   LEU  54           HG       LEU  54  -0.908  -0.625  -2.318
  410    HB2  LEU  54           2HB      LEU  54  -0.498  -2.643  -0.717
  411    HB3  LEU  54           1HB      LEU  54   0.185  -3.409  -2.139
  412   HD11  LEU  54          1HD1      LEU  54   0.564   0.112  -0.825
  413   HD12  LEU  54          2HD1      LEU  54   1.820  -0.328  -1.983
  414   HD13  LEU  54          3HD1      LEU  54   1.356  -1.460  -0.713
  415   HD21  LEU  54          3HD2      LEU  54   1.392  -1.958  -3.737
  416   HD22  LEU  54          1HD2      LEU  54   0.629  -0.417  -4.135
  417   HD23  LEU  54          2HD2      LEU  54  -0.262  -1.924  -4.347
  418    H    LEU  55           H        LEU  55  -3.215  -3.107  -4.391
  419    HA   LEU  55           HA       LEU  55  -2.835  -5.800  -5.176
  420    HG   LEU  55           HG       LEU  55  -3.132  -5.965  -7.792
  421    HB2  LEU  55           2HB      LEU  55  -4.759  -4.620  -5.980
  422    HB3  LEU  55           1HB      LEU  55  -3.768  -3.354  -6.676
  423   HD11  LEU  55          1HD1      LEU  55  -5.965  -4.971  -7.943
  424   HD12  LEU  55          2HD1      LEU  55  -5.392  -6.567  -7.456
  425   HD13  LEU  55          3HD1      LEU  55  -5.261  -6.059  -9.140
  426   HD21  LEU  55          3HD2      LEU  55  -3.151  -4.787  -9.825
  427   HD22  LEU  55          1HD2      LEU  55  -2.551  -3.635  -8.633
  428   HD23  LEU  55          2HD2      LEU  55  -4.222  -3.538  -9.189
  429    H    ALA  56           H        ALA  56  -1.449  -2.716  -6.364
  430    HA   ALA  56           HA       ALA  56   1.077  -4.055  -6.879
  431    HB1  ALA  56           3HB      ALA  56  -0.014  -4.638  -8.943
  432    HB2  ALA  56           1HB      ALA  56   1.123  -3.335  -9.298
  433    HB3  ALA  56           2HB      ALA  56  -0.601  -2.989  -9.162
  434    H    VAL  57           H        VAL  57   2.793  -2.527  -7.521
  435    HA   VAL  57           HA       VAL  57   2.151   0.306  -7.312
  436    HB   VAL  57           HB       VAL  57   2.441  -0.306  -4.972
  437   HG11  VAL  57          1HG1      VAL  57   3.958  -2.272  -5.496
  438   HG12  VAL  57          2HG1      VAL  57   4.364  -1.311  -4.075
  439   HG13  VAL  57          3HG1      VAL  57   5.273  -1.100  -5.570
  440   HG21  VAL  57          3HG2      VAL  57   4.981   1.113  -5.586
  441   HG22  VAL  57          1HG2      VAL  57   3.729   1.493  -4.404
  442   HG23  VAL  57          2HG2      VAL  57   3.463   1.839  -6.113
  443    H    ASN  58           H        ASN  58   3.190   1.245  -8.929
  444    HA   ASN  58           HA       ASN  58   4.801   1.850 -10.412
  445    HB2  ASN  58           2HB      ASN  58   6.687   0.277  -8.637
  446    HB3  ASN  58           1HB      ASN  58   7.164   1.405  -9.899
  447   HD21  ASN  58          1HD2      ASN  58   5.884   3.605  -9.610
  448   HD22  ASN  58          2HD2      ASN  58   6.002   4.272  -8.021
  449    H    ASN  59           H        ASN  59   3.186  -0.370 -10.927
  450    HA   ASN  59           HA       ASN  59   2.944  -1.819 -12.684
  451    HB2  ASN  59           2HB      ASN  59   5.340  -0.645 -13.368
  452    HB3  ASN  59           1HB      ASN  59   5.757  -2.353 -13.285
  453   HD21  ASN  59          1HD2      ASN  59   4.530  -3.839 -14.592
  454   HD22  ASN  59          2HD2      ASN  59   3.805  -3.290 -16.061
  455    H    VAL  60           H        VAL  60   4.840  -2.411  -9.902
  456    HA   VAL  60           HA       VAL  60   4.986  -5.289 -10.415
  457    HB   VAL  60           HB       VAL  60   6.298  -5.489  -8.421
  458   HG11  VAL  60          1HG1      VAL  60   7.046  -3.348 -10.339
  459   HG12  VAL  60          2HG1      VAL  60   7.782  -4.925 -10.060
  460   HG13  VAL  60          3HG1      VAL  60   8.069  -3.605  -8.925
  461   HG21  VAL  60          3HG2      VAL  60   6.650  -2.769  -7.614
  462   HG22  VAL  60          1HG2      VAL  60   6.113  -4.155  -6.665
  463   HG23  VAL  60          2HG2      VAL  60   4.939  -3.189  -7.555
  464    H    CYS  61           H        CYS  61   3.876  -6.838  -9.195
  465    HA   CYS  61           HA       CYS  61   1.458  -5.857  -7.941
  466    HG   CYS  61           HG       CYS  61   3.459  -9.125  -9.157
  467    HB2  CYS  61           2HB      CYS  61   0.840  -8.232  -7.742
  468    HB3  CYS  61           1HB      CYS  61   1.270  -7.791  -9.389
  469    H    LEU  62           H        LEU  62   1.084  -5.693  -5.819
  470    HA   LEU  62           HA       LEU  62   3.217  -6.538  -4.006
  471    HG   LEU  62           HG       LEU  62   3.613  -5.025  -2.022
  472    HB2  LEU  62           2HB      LEU  62   1.914  -4.094  -4.338
  473    HB3  LEU  62           1HB      LEU  62   1.276  -4.744  -2.846
  474   HD11  LEU  62          1HD1      LEU  62   4.189  -4.005  -4.741
  475   HD12  LEU  62          2HD1      LEU  62   5.064  -5.177  -3.757
  476   HD13  LEU  62          3HD1      LEU  62   5.220  -3.455  -3.422
  477   HD21  LEU  62          3HD2      LEU  62   3.928  -2.755  -1.434
  478   HD22  LEU  62          1HD2      LEU  62   2.188  -2.991  -1.587
  479   HD23  LEU  62          2HD2      LEU  62   3.085  -2.191  -2.876
  480    H    GLU  63           H        GLU  63   1.027  -8.281  -5.021
  481    HA   GLU  63           HA       GLU  63  -0.387  -8.819  -2.498
  482    HB2  GLU  63           2HB      GLU  63  -1.098  -9.557  -5.335
  483    HB3  GLU  63           1HB      GLU  63  -1.987 -10.109  -3.922
  484    HG2  GLU  63           2HG      GLU  63  -2.566  -7.832  -3.353
  485    HG3  GLU  63           1HG      GLU  63  -1.596  -7.227  -4.694
  486    H    GLU  64           H        GLU  64   1.997 -10.112  -4.620
  487    HA   GLU  64           HA       GLU  64   1.885 -12.652  -3.142
  488    HB2  GLU  64           2HB      GLU  64   3.017 -13.558  -5.346
  489    HB3  GLU  64           1HB      GLU  64   1.268 -13.450  -5.195
  490    HG2  GLU  64           2HG      GLU  64   1.290 -11.332  -6.391
  491    HG3  GLU  64           1HG      GLU  64   3.043 -11.426  -6.535
  492    H    VAL  65           H        VAL  65   3.357 -10.539  -2.212
  493    HA   VAL  65           HA       VAL  65   6.108 -11.503  -2.631
  494    HB   VAL  65           HB       VAL  65   6.928  -9.157  -2.319
  495   HG11  VAL  65          1HG1      VAL  65   5.352  -9.971  -4.740
  496   HG12  VAL  65          2HG1      VAL  65   7.099  -9.961  -4.500
  497   HG13  VAL  65          3HG1      VAL  65   6.228  -8.441  -4.691
  498   HG21  VAL  65          3HG2      VAL  65   5.319  -7.334  -2.900
  499   HG22  VAL  65          1HG2      VAL  65   5.015  -8.103  -1.343
  500   HG23  VAL  65          2HG2      VAL  65   4.012  -8.505  -2.737
  501    H    THR  66           H        THR  66   7.591 -10.983  -0.894
  502    HA   THR  66           HA       THR  66   6.455 -11.490   1.677
  503    HB   THR  66           HB       THR  66   8.811 -11.259   2.484
  504    HG1  THR  66           1HG      THR  66   9.806  -9.843   1.216
  505   HG21  THR  66          3HG2      THR  66   8.015 -13.414   1.544
  506   HG22  THR  66          1HG2      THR  66   9.751 -13.147   1.383
  507   HG23  THR  66          2HG2      THR  66   8.693 -12.930  -0.010
  508    H    HIS  67           H        HIS  67   7.791  -9.943   3.490
  509    HA   HIS  67           HA       HIS  67   6.347  -7.473   3.273
  510    HD1  HIS  67           1HD      HIS  67   5.066  -6.912   6.257
  511    HD2  HIS  67           2HD      HIS  67   8.808  -5.281   5.514
  512    HE1  HIS  67           1HE      HIS  67   4.927  -4.528   7.015
  513    HE2  HIS  67           2HE      HIS  67   7.154  -3.530   6.434
  514    HB2  HIS  67           2HB      HIS  67   6.694  -8.620   5.457
  515    HB3  HIS  67           1HB      HIS  67   8.390  -8.173   5.395
  516    H    GLU  68           H        GLU  68   9.728  -8.439   3.013
  517    HA   GLU  68           HA       GLU  68  10.979  -5.989   2.899
  518    HB2  GLU  68           2HB      GLU  68  11.606  -8.394   1.171
  519    HB3  GLU  68           1HB      GLU  68  12.703  -7.070   1.533
  520    HG2  GLU  68           2HG      GLU  68  13.460  -8.475   3.107
  521    HG3  GLU  68           1HG      GLU  68  12.088  -7.861   4.029
  522    H    GLU  69           H        GLU  69   9.376  -7.758   0.267
  523    HA   GLU  69           HA       GLU  69   9.901  -5.852  -1.759
  524    HB2  GLU  69           2HB      GLU  69   8.555  -8.352  -1.552
  525    HB3  GLU  69           1HB      GLU  69   7.448  -7.210  -2.302
  526    HG2  GLU  69           2HG      GLU  69  10.268  -7.626  -3.254
  527    HG3  GLU  69           1HG      GLU  69   8.892  -8.542  -3.867
  528    H    ALA  70           H        ALA  70   7.269  -6.234   0.570
  529    HA   ALA  70           HA       ALA  70   5.458  -4.346  -0.467
  530    HB1  ALA  70           3HB      ALA  70   5.239  -6.046   1.507
  531    HB2  ALA  70           1HB      ALA  70   4.326  -4.538   1.534
  532    HB3  ALA  70           2HB      ALA  70   5.804  -4.690   2.482
  533    H    VAL  71           H        VAL  71   8.195  -3.991   1.746
  534    HA   VAL  71           HA       VAL  71   7.781  -1.149   2.082
  535    HB   VAL  71           HB       VAL  71   9.972  -3.014   3.004
  536   HG11  VAL  71          1HG1      VAL  71  10.593  -0.920   4.435
  537   HG12  VAL  71          2HG1      VAL  71   9.842  -0.031   3.109
  538   HG13  VAL  71          3HG1      VAL  71  11.218  -1.087   2.793
  539   HG21  VAL  71          3HG2      VAL  71   8.308  -1.395   4.847
  540   HG22  VAL  71          1HG2      VAL  71   8.947  -3.028   5.032
  541   HG23  VAL  71          2HG2      VAL  71   7.530  -2.744   4.023
  542    H    THR  72           H        THR  72   9.919  -3.250   0.217
  543    HA   THR  72           HA       THR  72  11.707  -1.292  -0.701
  544    HB   THR  72           HB       THR  72  10.868  -3.951  -1.850
  545    HG1  THR  72           1HG      THR  72  13.189  -3.058  -0.483
  546   HG21  THR  72          3HG2      THR  72  13.019  -2.098  -2.844
  547   HG22  THR  72          1HG2      THR  72  11.663  -2.767  -3.753
  548   HG23  THR  72          2HG2      THR  72  12.964  -3.823  -3.205
  549    H    ALA  73           H        ALA  73   8.594  -2.403  -1.965
  550    HA   ALA  73           HA       ALA  73   8.753  -0.871  -4.371
  551    HB1  ALA  73           3HB      ALA  73   6.809  -1.879  -4.966
  552    HB2  ALA  73           1HB      ALA  73   6.128  -1.784  -3.342
  553    HB3  ALA  73           2HB      ALA  73   7.328  -3.019  -3.726
  554    H    LEU  74           H        LEU  74   7.321  -0.418  -1.153
  555    HA   LEU  74           HA       LEU  74   5.866   1.945  -1.821
  556    HG   LEU  74           HG       LEU  74   4.563   0.230   1.208
  557    HB2  LEU  74           2HB      LEU  74   6.755   0.637   0.725
  558    HB3  LEU  74           1HB      LEU  74   6.117   2.267   0.770
  559   HD11  LEU  74          1HD1      LEU  74   3.688   2.416  -0.670
  560   HD12  LEU  74          2HD1      LEU  74   3.887   2.602   1.072
  561   HD13  LEU  74          3HD1      LEU  74   2.668   1.498   0.438
  562   HD21  LEU  74          3HD2      LEU  74   4.140   0.375  -1.747
  563   HD22  LEU  74          1HD2      LEU  74   3.609  -0.853  -0.597
  564   HD23  LEU  74          2HD2      LEU  74   5.306  -0.757  -1.064
  565    H    LYS  75           H        LYS  75   9.123   1.198  -0.822
  566    HA   LYS  75           HA       LYS  75   9.809   3.991  -0.366
  567    HB2  LYS  75           2HB      LYS  75  11.920   3.244   0.376
  568    HB3  LYS  75           1HB      LYS  75  10.764   2.064   0.974
  569    HG2  LYS  75           2HG      LYS  75  11.572   0.401  -0.335
  570    HG3  LYS  75           1HG      LYS  75  12.038   1.493  -1.636
  571    HD2  LYS  75           2HD      LYS  75  14.080   0.778  -0.783
  572    HD3  LYS  75           1HD      LYS  75  13.835   2.334   0.011
  573    HE2  LYS  75           2HE      LYS  75  12.660   0.766   1.819
  574    HE3  LYS  75           1HE      LYS  75  13.779  -0.409   1.136
  575    HZ1  LYS  75           3HZ      LYS  75  14.532   2.233   2.262
  576    HZ2  LYS  75           1HZ      LYS  75  15.605   1.098   1.613
  577    HZ3  LYS  75           2HZ      LYS  75  14.747   0.740   3.026
  578    H    ASN  76           H        ASN  76   9.781   1.838  -3.041
  579    HA   ASN  76           HA       ASN  76  11.914   3.103  -4.504
  580    HB2  ASN  76           2HB      ASN  76  11.176   0.695  -4.794
  581    HB3  ASN  76           1HB      ASN  76   9.750   1.312  -5.621
  582   HD21  ASN  76          1HD2      ASN  76   9.881   1.568  -7.741
  583   HD22  ASN  76          2HD2      ASN  76  11.342   1.636  -8.661
  584    H    THR  77           H        THR  77  10.719   5.250  -3.903
  585    HA   THR  77           HA       THR  77   8.979   5.974  -6.169
  586    HB   THR  77           HB       THR  77   8.044   7.746  -4.629
  587    HG1  THR  77           1HG      THR  77   9.255   6.174  -2.601
  588   HG21  THR  77          3HG2      THR  77   6.936   5.510  -5.063
  589   HG22  THR  77          1HG2      THR  77   6.458   6.371  -3.599
  590   HG23  THR  77          2HG2      THR  77   7.577   5.012  -3.498
  591    H    SER  78           H        SER  78   9.928   7.291  -7.554
  592    HA   SER  78           HA       SER  78  12.237   8.870  -6.725
  593    HG   SER  78           HG       SER  78  12.497   6.620  -8.823
  594    HB2  SER  78           2HB      SER  78  11.083   8.132  -9.410
  595    HB3  SER  78           1HB      SER  78  12.320   9.377  -9.254
  596    H    ASP  79           H        ASP  79   9.897   9.839  -9.205
  597    HA   ASP  79           HA       ASP  79   9.626  12.417  -7.836
  598    HB2  ASP  79           2HB      ASP  79   8.813  13.290  -9.969
  599    HB3  ASP  79           1HB      ASP  79  10.357  12.476 -10.192
  600    H    PHE  80           H        PHE  80   7.686   9.834  -9.290
  601    HA   PHE  80           HA       PHE  80   5.419  10.682  -7.625
  602    HD1  PHE  80           1HD      PHE  80   5.144  13.021  -9.700
  603    HD2  PHE  80           2HD      PHE  80   2.290   9.919  -9.102
  604    HE1  PHE  80           1HE      PHE  80   3.407  14.708  -9.277
  605    HE2  PHE  80           2HE      PHE  80   0.549  11.606  -8.677
  606    HZ   PHE  80           HZ       PHE  80   1.109  14.000  -8.760
  607    HB2  PHE  80           2HB      PHE  80   5.523  10.687 -10.479
  608    HB3  PHE  80           1HB      PHE  80   4.416   9.415  -9.974
  609    H    VAL  81           H        VAL  81   3.719   8.810  -7.524
  610    HA   VAL  81           HA       VAL  81   4.966   6.190  -7.696
  611    HB   VAL  81           HB       VAL  81   5.488   6.765  -5.429
  612   HG11  VAL  81          1HG1      VAL  81   4.137   8.551  -4.835
  613   HG12  VAL  81          2HG1      VAL  81   3.519   7.239  -3.832
  614   HG13  VAL  81          3HG1      VAL  81   2.653   7.716  -5.292
  615   HG21  VAL  81          3HG2      VAL  81   4.443   4.984  -4.246
  616   HG22  VAL  81          1HG2      VAL  81   4.582   4.479  -5.930
  617   HG23  VAL  81          2HG2      VAL  81   3.030   5.029  -5.301
  618    H    TYR  82           H        TYR  82   3.585   4.909  -8.731
  619    HA   TYR  82           HA       TYR  82   0.743   5.629  -8.746
  620    HD1  TYR  82           1HD      TYR  82   0.062   2.188 -10.459
  621    HD2  TYR  82           2HD      TYR  82  -0.046   6.267 -11.663
  622    HE1  TYR  82           1HE      TYR  82  -2.138   1.826 -11.473
  623    HE2  TYR  82           2HE      TYR  82  -2.253   5.913 -12.678
  624    HH   TYR  82           HH       TYR  82  -3.464   3.260 -13.578
  625    HB2  TYR  82           2HB      TYR  82   2.022   5.251 -10.903
  626    HB3  TYR  82           1HB      TYR  82   2.077   3.545 -10.466
  627    H    LEU  83           H        LEU  83  -0.129   4.840  -6.954
  628    HA   LEU  83           HA       LEU  83   0.435   2.146  -6.051
  629    HG   LEU  83           HG       LEU  83  -1.238   1.550  -4.138
  630    HB2  LEU  83           2HB      LEU  83   0.195   4.095  -4.502
  631    HB3  LEU  83           1HB      LEU  83  -1.507   4.153  -4.916
  632   HD11  LEU  83          1HD1      LEU  83   0.701   3.217  -2.556
  633   HD12  LEU  83          2HD1      LEU  83   0.990   1.681  -3.373
  634   HD13  LEU  83          3HD1      LEU  83  -0.020   1.735  -1.930
  635   HD21  LEU  83          3HD2      LEU  83  -2.392   2.226  -2.127
  636   HD22  LEU  83          1HD2      LEU  83  -2.979   3.172  -3.493
  637   HD23  LEU  83          2HD2      LEU  83  -1.854   3.892  -2.342
  638    H    LYS  84           H        LYS  84  -0.745   0.412  -6.433
  639    HA   LYS  84           HA       LYS  84  -3.415   0.728  -7.621
  640    HB2  LYS  84           2HB      LYS  84  -1.314  -1.377  -8.064
  641    HB3  LYS  84           1HB      LYS  84  -2.994  -1.630  -8.505
  642    HG2  LYS  84           2HG      LYS  84  -1.917   0.877  -9.520
  643    HG3  LYS  84           1HG      LYS  84  -1.051  -0.545 -10.106
  644    HD2  LYS  84           2HD      LYS  84  -2.760  -0.220 -11.673
  645    HD3  LYS  84           1HD      LYS  84  -3.366  -1.508 -10.631
  646    HE2  LYS  84           2HE      LYS  84  -4.054   1.191  -9.727
  647    HE3  LYS  84           1HE      LYS  84  -4.735   0.762 -11.295
  648    HZ1  LYS  84           3HZ      LYS  84  -5.705  -1.210 -10.303
  649    HZ2  LYS  84           1HZ      LYS  84  -6.218   0.174  -9.476
  650    HZ3  LYS  84           2HZ      LYS  84  -5.033  -0.824  -8.799
  651    H    VAL  85           H        VAL  85  -4.967   0.322  -6.194
  652    HA   VAL  85           HA       VAL  85  -4.429  -1.653  -4.084
  653    HB   VAL  85           HB       VAL  85  -6.552   0.504  -4.124
  654   HG11  VAL  85          1HG1      VAL  85  -5.629  -0.695  -1.588
  655   HG12  VAL  85          2HG1      VAL  85  -6.598  -1.734  -2.633
  656   HG13  VAL  85          3HG1      VAL  85  -7.245  -0.188  -2.087
  657   HG21  VAL  85          3HG2      VAL  85  -5.051   1.550  -2.359
  658   HG22  VAL  85          1HG2      VAL  85  -4.504   1.656  -4.033
  659   HG23  VAL  85          2HG2      VAL  85  -3.789   0.466  -2.944
  660    H    ALA  86           H        ALA  86  -5.652  -3.454  -3.899
  661    HA   ALA  86           HA       ALA  86  -7.636  -3.968  -5.976
  662    HB1  ALA  86           3HB      ALA  86  -5.948  -5.629  -4.214
  663    HB2  ALA  86           1HB      ALA  86  -6.410  -5.864  -5.899
  664    HB3  ALA  86           2HB      ALA  86  -7.537  -6.284  -4.610
  665    H    LYS  87           H        LYS  87  -9.766  -4.616  -5.567
  666    HA   LYS  87           HA       LYS  87 -10.840  -3.641  -3.033
  667    HB2  LYS  87           2HB      LYS  87 -13.031  -3.727  -4.134
  668    HB3  LYS  87           1HB      LYS  87 -11.880  -2.781  -5.064
  669    HG2  LYS  87           2HG      LYS  87 -11.519  -5.071  -6.318
  670    HG3  LYS  87           1HG      LYS  87 -13.137  -5.399  -5.694
  671    HD2  LYS  87           2HD      LYS  87 -12.590  -2.803  -7.068
  672    HD3  LYS  87           1HD      LYS  87 -12.821  -4.263  -8.032
  673    HE2  LYS  87           2HE      LYS  87 -14.993  -3.649  -7.920
  674    HE3  LYS  87           1HE      LYS  87 -14.918  -4.487  -6.371
  675    HZ1  LYS  87           3HZ      LYS  87 -14.515  -1.565  -6.732
  676    HZ2  LYS  87           1HZ      LYS  87 -14.568  -2.398  -5.260
  677    HZ3  LYS  87           2HZ      LYS  87 -15.958  -2.284  -6.218
  678    HA   PRO  88           HA       PRO  88 -11.034  -7.920  -1.707
  679    HB2  PRO  88           2HB      PRO  88 -12.011  -7.414   0.778
  680    HB3  PRO  88           1HB      PRO  88 -10.312  -7.197   0.346
  681    HG2  PRO  88           2HG      PRO  88 -12.490  -5.155   0.550
  682    HG3  PRO  88           1HG      PRO  88 -10.810  -5.060   1.112
  683    HD2  PRO  88           2HD      PRO  88 -11.647  -3.902  -1.189
  684    HD3  PRO  88           1HD      PRO  88 -10.006  -4.546  -0.985
  685    H    THR  89           H        THR  89 -12.636  -9.170  -2.511
  686    HA   THR  89           HA       THR  89 -15.399  -8.588  -1.697
  687    HB   THR  89           HB       THR  89 -14.581  -9.517  -4.460
  688    HG1  THR  89           1HG      THR  89 -15.436  -6.967  -3.557
  689   HG21  THR  89          3HG2      THR  89 -17.251  -8.758  -3.312
  690   HG22  THR  89          1HG2      THR  89 -16.773 -10.303  -4.016
  691   HG23  THR  89          2HG2      THR  89 -16.922  -8.876  -5.041
  692    H    GLY  90           H        GLY  90 -13.573 -11.085  -3.501
  693    HA2  GLY  90           2HA      GLY  90 -13.302 -13.331  -3.083
  694    HA3  GLY  90           1HA      GLY  90 -13.981 -13.069  -1.487
  695    H    SER  91           H        SER  91 -14.517 -15.352  -2.969
  696    HA   SER  91           HA       SER  91 -17.237 -14.985  -4.007
  697    HG   SER  91           HG       SER  91 -16.620 -16.154  -6.394
  698    HB2  SER  91           2HB      SER  91 -15.119 -16.524  -4.925
  699    HB3  SER  91           1HB      SER  91 -16.162 -17.701  -4.128
  700    H    HIS  92           H        HIS  92 -15.407 -16.926  -1.653
  701    HA   HIS  92           HA       HIS  92 -17.744 -18.187  -0.574
  702    HD1  HIS  92           1HD      HIS  92 -17.723 -20.625   0.317
  703    HD2  HIS  92           2HD      HIS  92 -15.255 -18.909   3.186
  704    HE1  HIS  92           1HE      HIS  92 -18.218 -21.855   2.454
  705    HE2  HIS  92           2HE      HIS  92 -16.642 -20.867   4.152
  706    HB2  HIS  92           2HB      HIS  92 -15.447 -19.192  -0.526
  707    HB3  HIS  92           1HB      HIS  92 -14.993 -17.982   0.668
  708    HA   ARG 301           HA       ARG 301   2.707 -10.998  10.398
  709    HE   ARG 301           HE       ARG 301   0.517 -12.836  14.047
  710    H1   ARG 301           1HT      ARG 301   4.323 -12.380  11.656
  711    H2   ARG 301           2HT      ARG 301   2.717 -12.974  11.555
  712    H3   ARG 301           3HT      ARG 301   3.271 -12.236  13.002
  713    HB2  ARG 301           2HB      ARG 301   1.724 -10.559  13.227
  714    HB3  ARG 301           1HB      ARG 301   1.277  -9.555  11.856
  715    HG2  ARG 301           2HG      ARG 301  -0.044 -11.193  10.916
  716    HG3  ARG 301           1HG      ARG 301   0.797 -12.500  11.751
  717    HD2  ARG 301           2HD      ARG 301  -0.856 -10.443  13.193
  718    HD3  ARG 301           1HD      ARG 301  -1.539 -11.943  12.568
  719   HH11  ARG 301          1HH1      ARG 301  -2.056 -10.573  14.768
  720   HH12  ARG 301          2HH1      ARG 301  -2.074 -10.944  16.460
  721   HH21  ARG 301          1HH2      ARG 301   0.484 -13.325  16.274
  722   HH22  ARG 301          2HH2      ARG 301  -0.632 -12.507  17.315
  723    H    ARG 302           H        ARG 302   3.642  -9.073   9.887
  724    HA   ARG 302           HA       ARG 302   5.255  -7.684  11.890
  725    HE   ARG 302           HE       ARG 302   9.092  -9.421   8.940
  726    HB2  ARG 302           2HB      ARG 302   6.759  -9.257  10.654
  727    HB3  ARG 302           1HB      ARG 302   6.355  -8.406   9.169
  728    HG2  ARG 302           2HG      ARG 302   7.523  -6.510   9.770
  729    HG3  ARG 302           1HG      ARG 302   7.448  -6.883  11.491
  730    HD2  ARG 302           2HD      ARG 302   9.705  -7.191  10.669
  731    HD3  ARG 302           1HD      ARG 302   9.020  -8.744  11.140
  732   HH11  ARG 302          1HH1      ARG 302   9.762  -5.986   9.107
  733   HH12  ARG 302          2HH1      ARG 302  10.332  -5.895   7.475
  734   HH21  ARG 302          1HH2      ARG 302   9.853  -9.296   6.797
  735   HH22  ARG 302          2HH2      ARG 302  10.376  -7.772   6.160
  736    H    GLU 303           H        GLU 303   5.003  -5.554  11.798
  737    HA   GLU 303           HA       GLU 303   3.981  -4.357   9.307
  738    HB2  GLU 303           2HB      GLU 303   3.226  -3.422  12.077
  739    HB3  GLU 303           1HB      GLU 303   2.514  -2.933  10.547
  740    HG2  GLU 303           2HG      GLU 303   1.408  -4.990  10.280
  741    HG3  GLU 303           1HG      GLU 303   2.374  -5.763  11.533
  742    H    THR 304           H        THR 304   5.581  -3.158   8.503
  743    HA   THR 304           HA       THR 304   7.236  -1.589  10.365
  744    HB   THR 304           HB       THR 304   7.901  -3.298   8.121
  745    HG1  THR 304           1HG      THR 304   9.268  -3.682   9.645
  746   HG21  THR 304          3HG2      THR 304   9.105  -0.546   8.062
  747   HG22  THR 304          1HG2      THR 304   8.113  -1.288   6.806
  748   HG23  THR 304          2HG2      THR 304   9.703  -1.951   7.179
  749    H    GLN 305           H        GLN 305   7.660   0.569   9.939
  750    HA   GLN 305           HA       GLN 305   5.670   1.922   8.349
  751    HB2  GLN 305           2HB      GLN 305   7.681   2.707  10.370
  752    HB3  GLN 305           1HB      GLN 305   7.328   3.913   9.137
  753    HG2  GLN 305           2HG      GLN 305   5.014   3.932   9.714
  754    HG3  GLN 305           1HG      GLN 305   5.221   2.560  10.802
  755   HE21  GLN 305          1HE2      GLN 305   5.159   3.134  12.852
  756   HE22  GLN 305          2HE2      GLN 305   5.770   4.607  13.518
  757    H    VAL 306           H        VAL 306   6.113   3.399   6.648
  758    HA   VAL 306           HA       VAL 306   8.738   3.158   5.365
  759    HB   VAL 306           HB       VAL 306   7.602   2.854   3.143
  760   HG11  VAL 306          1HG1      VAL 306   8.720   1.021   4.379
  761   HG12  VAL 306          2HG1      VAL 306   7.386   0.460   3.372
  762   HG13  VAL 306          3HG1      VAL 306   7.171   0.609   5.116
  763   HG21  VAL 306          3HG2      VAL 306   5.366   3.506   3.583
  764   HG22  VAL 306          1HG2      VAL 306   5.228   2.382   4.936
  765   HG23  VAL 306          2HG2      VAL 306   5.317   1.769   3.283
  Start of MODEL    2
    1    HA   MET   1           HA       MET   1  -8.879   1.471  -9.389
    2    H1   MET   1           1HT      MET   1  -8.126  -0.596 -10.208
    3    H2   MET   1           2HT      MET   1  -9.521  -0.834  -9.239
    4    H3   MET   1           3HT      MET   1  -7.968  -1.222  -8.620
    5    HB2  MET   1           2HB      MET   1  -9.099  -0.132  -6.922
    6    HB3  MET   1           1HB      MET   1  -8.460   1.489  -6.688
    7    HG2  MET   1           2HG      MET   1 -10.562   2.062  -8.249
    8    HG3  MET   1           1HG      MET   1 -11.164   0.606  -7.457
    9    HE1  MET   1           3HE      MET   1 -12.946   1.242  -6.081
   10    HE2  MET   1           1HE      MET   1 -12.787   2.078  -4.537
   11    HE3  MET   1           2HE      MET   1 -11.925   0.565  -4.813
   12    H    GLU   2           H        GLU   2  -7.335   3.023  -9.339
   13    HA   GLU   2           HA       GLU   2  -4.634   2.255  -8.437
   14    HB2  GLU   2           2HB      GLU   2  -3.722   3.635 -10.289
   15    HB3  GLU   2           1HB      GLU   2  -4.625   2.237 -10.851
   16    HG2  GLU   2           2HG      GLU   2  -6.232   4.666 -10.585
   17    HG3  GLU   2           1HG      GLU   2  -4.926   4.785 -11.763
   18    H    ILE   3           H        ILE   3  -3.241   4.080  -7.806
   19    HA   ILE   3           HA       ILE   3  -4.603   6.581  -7.191
   20    HB   ILE   3           HB       ILE   3  -3.229   4.896  -5.087
   21   HG12  ILE   3          2HG1      ILE   3  -5.712   5.456  -4.109
   22   HG13  ILE   3          1HG1      ILE   3  -6.061   5.296  -5.826
   23   HG21  ILE   3          1HG2      ILE   3  -4.377   7.672  -4.979
   24   HG22  ILE   3          2HG2      ILE   3  -2.706   7.181  -4.709
   25   HG23  ILE   3          3HG2      ILE   3  -3.956   6.725  -3.552
   26   HD11  ILE   3          3HD1      ILE   3  -5.626   3.074  -5.844
   27   HD12  ILE   3          1HD1      ILE   3  -6.107   3.240  -4.155
   28   HD13  ILE   3          2HD1      ILE   3  -4.397   3.190  -4.585
   29    H    LYS   4           H        LYS   4  -3.261   8.161  -7.909
   30    HA   LYS   4           HA       LYS   4  -0.351   7.733  -7.699
   31    HB2  LYS   4           2HB      LYS   4  -1.487   7.894 -10.024
   32    HB3  LYS   4           1HB      LYS   4  -1.684   9.600  -9.652
   33    HG2  LYS   4           2HG      LYS   4   0.722   9.847  -9.435
   34    HG3  LYS   4           1HG      LYS   4   0.939   8.127  -9.758
   35    HD2  LYS   4           2HD      LYS   4   1.368   9.308 -11.792
   36    HD3  LYS   4           1HD      LYS   4  -0.181   8.482 -11.967
   37    HE2  LYS   4           2HE      LYS   4  -1.279  10.403 -12.253
   38    HE3  LYS   4           1HE      LYS   4  -0.486  11.150 -10.868
   39    HZ1  LYS   4           3HZ      LYS   4   0.444  11.055 -13.675
   40    HZ2  LYS   4           1HZ      LYS   4   1.493  11.430 -12.400
   41    HZ3  LYS   4           2HZ      LYS   4   0.153  12.413 -12.711
   42    H    LEU   5           H        LEU   5   0.937   9.561  -6.954
   43    HA   LEU   5           HA       LEU   5  -0.467  11.980  -6.201
   44    HG   LEU   5           HG       LEU   5  -1.795  11.800  -4.513
   45    HB2  LEU   5           2HB      LEU   5   0.183   9.878  -4.318
   46    HB3  LEU   5           1HB      LEU   5   1.031  11.357  -3.916
   47   HD11  LEU   5          1HD1      LEU   5  -1.868  10.774  -1.894
   48   HD12  LEU   5          2HD1      LEU   5  -1.130   9.530  -2.904
   49   HD13  LEU   5          3HD1      LEU   5  -2.718  10.177  -3.319
   50   HD21  LEU   5          3HD2      LEU   5  -0.437  12.394  -1.922
   51   HD22  LEU   5          1HD2      LEU   5  -1.633  13.339  -2.810
   52   HD23  LEU   5          2HD2      LEU   5   0.037  13.277  -3.373
   53    H    ILE   6           H        ILE   6   1.174  13.551  -5.149
   54    HA   ILE   6           HA       ILE   6   3.660  13.398  -6.701
   55    HB   ILE   6           HB       ILE   6   2.170  15.419  -6.908
   56   HG12  ILE   6          2HG1      ILE   6   4.888  16.128  -5.802
   57   HG13  ILE   6          1HG1      ILE   6   4.678  15.354  -7.370
   58   HG21  ILE   6          1HG2      ILE   6   3.210  16.204  -4.199
   59   HG22  ILE   6          2HG2      ILE   6   1.630  15.456  -4.433
   60   HG23  ILE   6          3HG2      ILE   6   1.989  17.011  -5.183
   61   HD11  ILE   6          3HD1      ILE   6   3.949  18.107  -6.504
   62   HD12  ILE   6          1HD1      ILE   6   3.070  17.343  -7.830
   63   HD13  ILE   6          2HD1      ILE   6   4.815  17.569  -7.943
   64    H    LYS   7           H        LYS   7   5.676  13.419  -5.735
   65    HA   LYS   7           HA       LYS   7   5.988  12.390  -3.174
   66    HB2  LYS   7           2HB      LYS   7   7.691  12.281  -4.968
   67    HB3  LYS   7           1HB      LYS   7   8.002  13.996  -4.750
   68    HG2  LYS   7           2HG      LYS   7   9.696  13.106  -3.511
   69    HG3  LYS   7           1HG      LYS   7   8.456  13.281  -2.269
   70    HD2  LYS   7           2HD      LYS   7   7.789  10.892  -2.803
   71    HD3  LYS   7           1HD      LYS   7   9.284  10.788  -3.735
   72    HE2  LYS   7           2HE      LYS   7   9.551  11.851  -0.998
   73    HE3  LYS   7           1HE      LYS   7   9.082  10.156  -1.116
   74    HZ1  LYS   7           3HZ      LYS   7  11.473  11.394  -2.372
   75    HZ2  LYS   7           1HZ      LYS   7  11.016   9.772  -2.533
   76    HZ3  LYS   7           2HZ      LYS   7  11.472  10.377  -1.021
   77    H    GLY   8           H        GLY   8   6.159  13.218  -1.178
   78    HA2  GLY   8           2HA      GLY   8   5.789  16.113  -0.867
   79    HA3  GLY   8           1HA      GLY   8   5.510  14.894   0.368
   80    HA   PRO   9           HA       PRO   9   9.548  16.799   1.437
   81    HB2  PRO   9           2HB      PRO   9   8.757  16.368   4.210
   82    HB3  PRO   9           1HB      PRO   9   9.094  17.882   3.374
   83    HG2  PRO   9           2HG      PRO   9   6.604  17.167   4.192
   84    HG3  PRO   9           1HG      PRO   9   6.904  18.196   2.780
   85    HD2  PRO   9           2HD      PRO   9   6.275  15.268   2.893
   86    HD3  PRO   9           1HD      PRO   9   5.656  16.509   1.780
   87    H    LYS  10           H        LYS  10   8.666  14.631   4.112
   88    HA   LYS  10           HA       LYS  10  11.085  13.226   4.002
   89    HB2  LYS  10           2HB      LYS  10   8.466  12.423   5.284
   90    HB3  LYS  10           1HB      LYS  10  10.015  11.656   5.596
   91    HG2  LYS  10           2HG      LYS  10   9.955  14.572   5.979
   92    HG3  LYS  10           1HG      LYS  10   8.966  13.633   7.099
   93    HD2  LYS  10           2HD      LYS  10  11.643  12.529   6.658
   94    HD3  LYS  10           1HD      LYS  10  11.640  14.136   7.387
   95    HE2  LYS  10           2HE      LYS  10  10.194  13.369   9.165
   96    HE3  LYS  10           1HE      LYS  10  10.052  11.784   8.407
   97    HZ1  LYS  10           3HZ      LYS  10  12.436  12.983   9.687
   98    HZ2  LYS  10           1HZ      LYS  10  12.542  11.632   8.672
   99    HZ3  LYS  10           2HZ      LYS  10  11.638  11.550  10.098
  100    H    GLY  11           H        GLY  11   7.850  11.803   3.387
  101    HA2  GLY  11           2HA      GLY  11   8.522  10.680   0.891
  102    HA3  GLY  11           1HA      GLY  11   8.830   9.489   2.142
  103    H    LEU  12           H        LEU  12   7.192   8.211   2.728
  104    HA   LEU  12           HA       LEU  12   4.571   8.691   1.581
  105    HG   LEU  12           HG       LEU  12   6.761   6.404   1.101
  106    HB2  LEU  12           2HB      LEU  12   5.572   6.374   3.230
  107    HB3  LEU  12           1HB      LEU  12   4.036   6.444   2.398
  108   HD11  LEU  12          1HD1      LEU  12   6.561   4.206   1.391
  109   HD12  LEU  12          2HD1      LEU  12   5.263   4.270   0.199
  110   HD13  LEU  12          3HD1      LEU  12   4.884   4.347   1.920
  111   HD21  LEU  12          3HD2      LEU  12   3.994   6.648  -0.062
  112   HD22  LEU  12          1HD2      LEU  12   5.390   6.115  -0.999
  113   HD23  LEU  12          2HD2      LEU  12   5.370   7.728  -0.287
  114    H    GLY  13           H        GLY  13   5.879   8.069   4.849
  115    HA2  GLY  13           2HA      GLY  13   5.216   9.056   6.844
  116    HA3  GLY  13           1HA      GLY  13   3.920   9.869   5.988
  117    H    PHE  14           H        PHE  14   4.469   6.374   5.923
  118    HA   PHE  14           HA       PHE  14   2.509   5.837   7.947
  119    HD1  PHE  14           2HD      PHE  14   2.255   3.099   4.997
  120    HD2  PHE  14           1HD      PHE  14   1.298   7.111   3.941
  121    HE1  PHE  14           2HE      PHE  14   2.619   2.557   2.625
  122    HE2  PHE  14           1HE      PHE  14   1.655   6.574   1.568
  123    HZ   PHE  14           HZ       PHE  14   2.318   4.296   0.907
  124    HB2  PHE  14           2HB      PHE  14   0.881   4.699   6.492
  125    HB3  PHE  14           1HB      PHE  14   0.994   6.413   6.128
  126    H    SER  15           H        SER  15   1.853   3.254   7.532
  127    HA   SER  15           HA       SER  15   4.365   1.865   6.962
  128    HG   SER  15           HG       SER  15   2.202   1.100  10.269
  129    HB2  SER  15           2HB      SER  15   3.598   0.317   8.907
  130    HB3  SER  15           1HB      SER  15   4.425   1.819   9.292
  131    H    ILE  16           H        ILE  16   3.886  -0.620   6.958
  132    HA   ILE  16           HA       ILE  16   1.235  -1.352   6.027
  133    HB   ILE  16           HB       ILE  16   1.753  -2.012   3.858
  134   HG12  ILE  16          2HG1      ILE  16   3.939  -3.077   4.400
  135   HG13  ILE  16          1HG1      ILE  16   3.912  -2.231   2.859
  136   HG21  ILE  16          1HG2      ILE  16   3.221   0.581   4.235
  137   HG22  ILE  16          2HG2      ILE  16   1.490   0.384   3.962
  138   HG23  ILE  16          3HG2      ILE  16   2.637  -0.049   2.695
  139   HD11  ILE  16          3HD1      ILE  16   5.736  -1.939   4.943
  140   HD12  ILE  16          1HD1      ILE  16   4.770  -0.463   4.927
  141   HD13  ILE  16          2HD1      ILE  16   5.612  -0.981   3.466
  142    H    ALA  17           H        ALA  17   1.246  -3.703   5.343
  143    HA   ALA  17           HA       ALA  17   3.320  -5.328   6.632
  144    HB1  ALA  17           3HB      ALA  17   1.902  -5.824   8.302
  145    HB2  ALA  17           1HB      ALA  17   0.992  -6.746   7.106
  146    HB3  ALA  17           2HB      ALA  17   0.536  -5.079   7.471
  147    H    GLY  18           H        GLY  18   3.112  -7.717   5.727
  148    HA2  GLY  18           2HA      GLY  18   1.490  -8.370   3.621
  149    HA3  GLY  18           1HA      GLY  18   2.741  -7.405   2.877
  150    H    GLY  19           H        GLY  19   1.815 -10.437   2.951
  151    HA2  GLY  19           2HA      GLY  19   3.260 -12.069   1.960
  152    HA3  GLY  19           1HA      GLY  19   4.593 -11.400   2.885
  153    H    VAL  20           H        VAL  20   3.847 -14.151   2.743
  154    HA   VAL  20           HA       VAL  20   2.348 -14.966   4.989
  155    HB   VAL  20           HB       VAL  20   4.559 -16.474   3.564
  156   HG11  VAL  20          1HG1      VAL  20   2.527 -17.339   5.602
  157   HG12  VAL  20          2HG1      VAL  20   4.276 -17.561   5.628
  158   HG13  VAL  20          3HG1      VAL  20   3.288 -18.480   4.492
  159   HG21  VAL  20          3HG2      VAL  20   2.922 -17.421   2.180
  160   HG22  VAL  20          1HG2      VAL  20   2.507 -15.709   2.239
  161   HG23  VAL  20          2HG2      VAL  20   1.602 -16.870   3.211
  162    H    GLY  21           H        GLY  21   2.904 -15.331   7.111
  163    HA2  GLY  21           2HA      GLY  21   4.274 -15.556   8.995
  164    HA3  GLY  21           1HA      GLY  21   5.681 -15.332   7.968
  165    H    ASN  22           H        ASN  22   4.233 -12.831   6.922
  166    HA   ASN  22           HA       ASN  22   4.521 -11.028   9.199
  167    HB2  ASN  22           2HB      ASN  22   5.774  -9.446   7.566
  168    HB3  ASN  22           1HB      ASN  22   6.686 -10.741   8.313
  169   HD21  ASN  22          1HD2      ASN  22   8.217 -11.025   6.786
  170   HD22  ASN  22          2HD2      ASN  22   7.889 -11.548   5.173
  171    H    GLN  23           H        GLN  23   2.268 -12.074   7.491
  172    HA   GLN  23           HA       GLN  23   1.432  -9.947   5.794
  173    HB2  GLN  23           2HB      GLN  23  -0.582 -11.203   5.470
  174    HB3  GLN  23           1HB      GLN  23   0.766 -12.328   5.488
  175    HG2  GLN  23           2HG      GLN  23  -0.617 -11.857   8.060
  176    HG3  GLN  23           1HG      GLN  23  -1.498 -12.749   6.822
  177   HE21  GLN  23          1HE2      GLN  23  -0.096 -13.412   9.479
  178   HE22  GLN  23          2HE2      GLN  23   0.818 -14.828   9.099
  179    H    HIS  24           H        HIS  24  -0.569  -8.772   6.012
  180    HA   HIS  24           HA       HIS  24  -0.790  -7.588   8.656
  181    HD1  HIS  24           1HD      HIS  24  -0.575  -4.854   8.904
  182    HD2  HIS  24           2HD      HIS  24  -4.271  -5.370   7.094
  183    HE1  HIS  24           1HE      HIS  24  -2.048  -3.117   9.911
  184    HE2  HIS  24           2HE      HIS  24  -4.324  -3.504   8.898
  185    HB2  HIS  24           2HB      HIS  24  -0.629  -6.203   6.561
  186    HB3  HIS  24           1HB      HIS  24  -2.220  -6.792   6.117
  187    H    ILE  25           H        ILE  25  -2.636  -9.684   6.580
  188    HA   ILE  25           HA       ILE  25  -4.654  -9.934   8.672
  189    HB   ILE  25           HB       ILE  25  -5.512  -9.518   5.809
  190   HG12  ILE  25          2HG1      ILE  25  -5.457  -7.515   8.077
  191   HG13  ILE  25          1HG1      ILE  25  -4.513  -7.438   6.593
  192   HG21  ILE  25          1HG2      ILE  25  -7.128  -9.335   8.339
  193   HG22  ILE  25          2HG2      ILE  25  -6.977 -10.814   7.389
  194   HG23  ILE  25          3HG2      ILE  25  -7.717  -9.380   6.677
  195   HD11  ILE  25          3HD1      ILE  25  -7.450  -7.014   6.974
  196   HD12  ILE  25          1HD1      ILE  25  -6.768  -7.384   5.389
  197   HD13  ILE  25          2HD1      ILE  25  -6.252  -5.937   6.255
  198    HA   PRO  26           HA       PRO  26  -4.035 -14.247   7.796
  199    HB2  PRO  26           2HB      PRO  26  -6.505 -15.100   8.738
  200    HB3  PRO  26           1HB      PRO  26  -5.063 -14.859   9.729
  201    HG2  PRO  26           2HG      PRO  26  -7.394 -13.043   9.300
  202    HG3  PRO  26           1HG      PRO  26  -6.478 -13.364  10.784
  203    HD2  PRO  26           2HD      PRO  26  -6.099 -11.120   9.378
  204    HD3  PRO  26           1HD      PRO  26  -4.741 -11.951  10.165
  205    H    GLY  27           H        GLY  27  -4.258 -15.265   5.906
  206    HA2  GLY  27           2HA      GLY  27  -5.524 -16.316   4.197
  207    HA3  GLY  27           1HA      GLY  27  -6.843 -15.201   4.522
  208    H    ASP  28           H        ASP  28  -5.861 -12.756   4.282
  209    HA   ASP  28           HA       ASP  28  -5.135 -12.610   1.469
  210    HB2  ASP  28           2HB      ASP  28  -6.909 -11.168   2.891
  211    HB3  ASP  28           1HB      ASP  28  -5.499 -10.127   3.059
  212    H    ASN  29           H        ASN  29  -3.023 -12.828   1.082
  213    HA   ASN  29           HA       ASN  29  -1.034 -11.782   2.921
  214    HB2  ASN  29           2HB      ASN  29   0.587 -12.902   1.519
  215    HB3  ASN  29           1HB      ASN  29  -0.740 -13.988   1.901
  216   HD21  ASN  29          1HD2      ASN  29   1.280 -13.728  -0.364
  217   HD22  ASN  29          2HD2      ASN  29   0.315 -13.864  -1.790
  218    H    SER  30           H        SER  30  -2.810 -10.014   1.065
  219    HA   SER  30           HA       SER  30  -0.836  -8.708  -0.611
  220    HG   SER  30           HG       SER  30  -2.855  -8.966  -2.402
  221    HB2  SER  30           2HB      SER  30  -3.678  -7.878   0.050
  222    HB3  SER  30           1HB      SER  30  -2.659  -7.171  -1.203
  223    H    ILE  31           H        ILE  31  -0.217  -6.439  -0.324
  224    HA   ILE  31           HA       ILE  31   0.439  -5.921   2.389
  225    HB   ILE  31           HB       ILE  31   0.773  -3.929   0.155
  226   HG12  ILE  31          2HG1      ILE  31   1.839  -5.647  -0.905
  227   HG13  ILE  31          1HG1      ILE  31   3.153  -5.112   0.127
  228   HG21  ILE  31          1HG2      ILE  31   2.628  -4.445   2.445
  229   HG22  ILE  31          2HG2      ILE  31   1.242  -3.366   2.598
  230   HG23  ILE  31          3HG2      ILE  31   2.505  -3.019   1.416
  231   HD11  ILE  31          3HD1      ILE  31   1.885  -7.667  -0.013
  232   HD12  ILE  31          1HD1      ILE  31   1.712  -7.010   1.612
  233   HD13  ILE  31          2HD1      ILE  31   3.312  -7.181   0.898
  234    H    TYR  32           H        TYR  32  -0.576  -4.830   3.899
  235    HA   TYR  32           HA       TYR  32  -2.705  -2.924   3.172
  236    HD1  TYR  32           2HD      TYR  32  -2.587  -6.600   3.693
  237    HD2  TYR  32           1HD      TYR  32  -5.746  -3.854   4.398
  238    HE1  TYR  32           2HE      TYR  32  -4.136  -8.120   2.532
  239    HE2  TYR  32           1HE      TYR  32  -7.321  -5.349   3.262
  240    HH   TYR  32           HH       TYR  32  -7.221  -8.154   2.839
  241    HB2  TYR  32           2HB      TYR  32  -2.523  -4.816   5.518
  242    HB3  TYR  32           1HB      TYR  32  -3.691  -3.510   5.425
  243    H    VAL  33           H        VAL  33  -2.867  -1.037   4.463
  244    HA   VAL  33           HA       VAL  33  -0.383  -0.129   5.589
  245    HB   VAL  33           HB       VAL  33  -3.064   1.189   5.197
  246   HG11  VAL  33          1HG1      VAL  33  -2.421   2.151   7.239
  247   HG12  VAL  33          2HG1      VAL  33  -1.869   3.295   6.015
  248   HG13  VAL  33          3HG1      VAL  33  -0.718   2.199   6.781
  249   HG21  VAL  33          3HG2      VAL  33  -2.085   1.552   3.216
  250   HG22  VAL  33          1HG2      VAL  33  -0.486   1.127   3.822
  251   HG23  VAL  33          2HG2      VAL  33  -1.119   2.755   4.067
  252    H    THR  34           H        THR  34   0.207  -0.230   7.652
  253    HA   THR  34           HA       THR  34  -1.724  -1.220   9.610
  254    HB   THR  34           HB       THR  34   0.057  -2.088  10.827
  255    HG1  THR  34           1HG      THR  34   1.762  -0.945  11.156
  256   HG21  THR  34          3HG2      THR  34   0.768  -3.571   9.356
  257   HG22  THR  34          1HG2      THR  34   1.778  -2.366   8.562
  258   HG23  THR  34          2HG2      THR  34   0.098  -2.569   8.071
  259    H    LYS  35           H        LYS  35   0.217   1.656   9.039
  260    HA   LYS  35           HA       LYS  35  -1.234   3.071  11.090
  261    HB2  LYS  35           2HB      LYS  35   1.740   2.627  11.425
  262    HB3  LYS  35           1HB      LYS  35   0.819   3.834  12.306
  263    HG2  LYS  35           2HG      LYS  35  -0.567   1.998  13.250
  264    HG3  LYS  35           1HG      LYS  35   0.518   0.845  12.473
  265    HD2  LYS  35           2HD      LYS  35   2.391   1.688  13.749
  266    HD3  LYS  35           1HD      LYS  35   1.379   2.945  14.461
  267    HE2  LYS  35           2HE      LYS  35   0.208   1.431  15.779
  268    HE3  LYS  35           1HE      LYS  35   0.654   0.057  14.768
  269    HZ1  LYS  35           3HZ      LYS  35   1.830   0.106  16.910
  270    HZ2  LYS  35           1HZ      LYS  35   2.551   1.574  16.478
  271    HZ3  LYS  35           2HZ      LYS  35   2.890   0.173  15.595
  272    H    ILE  36           H        ILE  36  -1.591   5.074  10.343
  273    HA   ILE  36           HA       ILE  36   0.219   6.119   8.285
  274    HB   ILE  36           HB       ILE  36  -2.606   6.931   8.977
  275   HG12  ILE  36          2HG1      ILE  36  -1.349   5.318   6.772
  276   HG13  ILE  36          1HG1      ILE  36  -2.731   4.913   7.784
  277   HG21  ILE  36          1HG2      ILE  36  -0.800   8.003   6.809
  278   HG22  ILE  36          2HG2      ILE  36  -1.274   8.865   8.272
  279   HG23  ILE  36          3HG2      ILE  36  -2.489   8.440   7.068
  280   HD11  ILE  36          3HD1      ILE  36  -3.553   5.368   5.618
  281   HD12  ILE  36          1HD1      ILE  36  -2.626   6.863   5.504
  282   HD13  ILE  36          2HD1      ILE  36  -3.982   6.752   6.626
  283    H    ILE  37           H        ILE  37   1.614   7.683   8.798
  284    HA   ILE  37           HA       ILE  37   1.546   8.966  11.376
  285    HB   ILE  37           HB       ILE  37   3.432   9.147   9.029
  286   HG12  ILE  37          2HG1      ILE  37   4.986   8.360  11.002
  287   HG13  ILE  37          1HG1      ILE  37   3.463   7.863  11.732
  288   HG21  ILE  37          1HG2      ILE  37   3.440  10.782  11.547
  289   HG22  ILE  37          2HG2      ILE  37   3.511  11.338   9.875
  290   HG23  ILE  37          3HG2      ILE  37   4.893  10.506  10.586
  291   HD11  ILE  37          3HD1      ILE  37   4.707   6.103  10.447
  292   HD12  ILE  37          1HD1      ILE  37   4.313   7.006   8.984
  293   HD13  ILE  37          2HD1      ILE  37   3.022   6.340   9.984
  294    H    GLU  38           H        GLU  38   1.374  11.207  11.773
  295    HA   GLU  38           HA       GLU  38  -0.599  12.567  10.296
  296    HB2  GLU  38           2HB      GLU  38   1.255  13.328  12.516
  297    HB3  GLU  38           1HB      GLU  38   0.372  14.596  11.678
  298    HG2  GLU  38           2HG      GLU  38  -1.649  12.915  12.158
  299    HG3  GLU  38           1HG      GLU  38  -0.599  12.498  13.512
  300    H    GLY  39           H        GLY  39  -0.499  14.401   8.974
  301    HA2  GLY  39           2HA      GLY  39   0.308  15.706   7.277
  302    HA3  GLY  39           1HA      GLY  39   1.808  15.760   8.183
  303    H    GLY  40           H        GLY  40   0.751  12.612   7.227
  304    HA2  GLY  40           2HA      GLY  40   3.025  12.408   5.428
  305    HA3  GLY  40           1HA      GLY  40   2.020  11.085   5.993
  306    H    ALA  41           H        ALA  41   2.778  11.154   3.385
  307    HA   ALA  41           HA       ALA  41   1.281  12.465   1.501
  308    HB1  ALA  41           3HB      ALA  41   3.140  10.947   0.982
  309    HB2  ALA  41           1HB      ALA  41   1.711  10.598   0.005
  310    HB3  ALA  41           2HB      ALA  41   2.114   9.569   1.380
  311    H    ALA  42           H        ALA  42   0.414   9.343   3.022
  312    HA   ALA  42           HA       ALA  42  -2.124   9.173   1.757
  313    HB1  ALA  42           3HB      ALA  42  -0.933   7.755   4.127
  314    HB2  ALA  42           1HB      ALA  42  -1.163   7.144   2.489
  315    HB3  ALA  42           2HB      ALA  42  -2.559   7.419   3.531
  316    H    HIS  43           H        HIS  43  -1.169  10.023   5.081
  317    HA   HIS  43           HA       HIS  43  -3.637  10.548   6.184
  318    HD1  HIS  43           1HD      HIS  43  -2.240  14.171   7.571
  319    HD2  HIS  43           2HD      HIS  43  -3.376  10.675   9.506
  320    HE1  HIS  43           1HE      HIS  43  -3.444  14.917   9.645
  321    HE2  HIS  43           2HE      HIS  43  -4.213  12.786  10.751
  322    HB2  HIS  43           2HB      HIS  43  -1.509  10.518   7.432
  323    HB3  HIS  43           1HB      HIS  43  -1.064  12.050   6.696
  324    H    LYS  44           H        LYS  44  -1.569  12.806   4.369
  325    HA   LYS  44           HA       LYS  44  -3.345  15.021   4.640
  326    HB2  LYS  44           2HB      LYS  44  -1.051  14.533   2.735
  327    HB3  LYS  44           1HB      LYS  44  -1.912  16.060   2.874
  328    HG2  LYS  44           2HG      LYS  44  -1.218  15.614   5.461
  329    HG3  LYS  44           1HG      LYS  44   0.139  14.880   4.606
  330    HD2  LYS  44           2HD      LYS  44   0.987  16.881   4.140
  331    HD3  LYS  44           1HD      LYS  44  -0.526  17.393   3.391
  332    HE2  LYS  44           2HE      LYS  44  -0.268  17.354   6.369
  333    HE3  LYS  44           1HE      LYS  44   0.415  18.690   5.446
  334    HZ1  LYS  44           3HZ      LYS  44  -1.851  19.140   6.208
  335    HZ2  LYS  44           1HZ      LYS  44  -2.421  17.813   5.327
  336    HZ3  LYS  44           2HZ      LYS  44  -1.751  19.140   4.520
  337    H    ASP  45           H        ASP  45  -2.849  12.568   2.134
  338    HA   ASP  45           HA       ASP  45  -4.492  13.770   0.173
  339    HB2  ASP  45           2HB      ASP  45  -2.783  11.830  -0.064
  340    HB3  ASP  45           1HB      ASP  45  -4.131  10.794   0.392
  341    H    GLY  46           H        GLY  46  -5.196  11.057   2.410
  342    HA2  GLY  46           2HA      GLY  46  -7.249  10.936   3.634
  343    HA3  GLY  46           1HA      GLY  46  -8.015  11.901   2.385
  344    H    LYS  47           H        LYS  47  -6.820  10.253   0.214
  345    HA   LYS  47           HA       LYS  47  -8.925   8.417  -0.107
  346    HB2  LYS  47           2HB      LYS  47  -6.375   8.963  -1.555
  347    HB3  LYS  47           1HB      LYS  47  -7.239   7.476  -1.919
  348    HG2  LYS  47           2HG      LYS  47  -9.003   8.567  -2.875
  349    HG3  LYS  47           1HG      LYS  47  -8.759  10.032  -1.921
  350    HD2  LYS  47           2HD      LYS  47  -7.320  10.914  -3.416
  351    HD3  LYS  47           1HD      LYS  47  -6.557   9.358  -3.752
  352    HE2  LYS  47           2HE      LYS  47  -8.353   8.735  -5.223
  353    HE3  LYS  47           1HE      LYS  47  -9.271  10.174  -4.782
  354    HZ1  LYS  47           3HZ      LYS  47  -6.655  10.176  -6.190
  355    HZ2  LYS  47           1HZ      LYS  47  -7.578  11.542  -5.806
  356    HZ3  LYS  47           2HZ      LYS  47  -8.159  10.415  -6.925
  357    H    LEU  48           H        LEU  48  -5.544   7.930   0.913
  358    HA   LEU  48           HA       LEU  48  -5.995   5.079   1.235
  359    HG   LEU  48           HG       LEU  48  -4.107   3.757   1.099
  360    HB2  LEU  48           2HB      LEU  48  -3.825   6.259   0.412
  361    HB3  LEU  48           1HB      LEU  48  -3.518   6.514   2.118
  362   HD11  LEU  48          1HD1      LEU  48  -1.583   3.494   0.976
  363   HD12  LEU  48          2HD1      LEU  48  -1.511   5.255   0.903
  364   HD13  LEU  48          3HD1      LEU  48  -2.360   4.354  -0.353
  365   HD21  LEU  48          3HD2      LEU  48  -3.801   4.690   3.599
  366   HD22  LEU  48          1HD2      LEU  48  -2.125   4.301   3.210
  367   HD23  LEU  48          2HD2      LEU  48  -3.370   3.054   3.103
  368    H    GLN  49           H        GLN  49  -6.859   4.279   3.000
  369    HA   GLN  49           HA       GLN  49  -6.278   5.503   5.601
  370    HB2  GLN  49           2HB      GLN  49  -8.519   5.362   6.293
  371    HB3  GLN  49           1HB      GLN  49  -8.595   6.046   4.681
  372    HG2  GLN  49           2HG      GLN  49  -8.981   3.116   5.225
  373    HG3  GLN  49           1HG      GLN  49 -10.303   4.280   5.246
  374   HE21  GLN  49          1HE2      GLN  49  -8.205   2.389   3.305
  375   HE22  GLN  49          2HE2      GLN  49  -8.839   2.859   1.768
  376    H    ILE  50           H        ILE  50  -6.044   4.048   7.329
  377    HA   ILE  50           HA       ILE  50  -4.895   1.611   6.955
  378    HB   ILE  50           HB       ILE  50  -6.716   2.307   9.268
  379   HG12  ILE  50          2HG1      ILE  50  -3.993   2.486   9.995
  380   HG13  ILE  50          1HG1      ILE  50  -4.146   3.331   8.458
  381   HG21  ILE  50          1HG2      ILE  50  -5.259   0.683  10.512
  382   HG22  ILE  50          2HG2      ILE  50  -4.615   0.176   8.950
  383   HG23  ILE  50          3HG2      ILE  50  -6.329  -0.036   9.309
  384   HD11  ILE  50          3HD1      ILE  50  -5.996   4.659   9.439
  385   HD12  ILE  50          1HD1      ILE  50  -4.441   4.896  10.236
  386   HD13  ILE  50          2HD1      ILE  50  -5.672   3.881  10.988
  387    H    GLY  51           H        GLY  51  -5.524  -0.442   6.374
  388    HA2  GLY  51           2HA      GLY  51  -7.191  -2.203   6.567
  389    HA3  GLY  51           1HA      GLY  51  -8.423  -0.987   6.296
  390    H    ASP  52           H        ASP  52  -6.507   0.215   4.154
  391    HA   ASP  52           HA       ASP  52  -7.701  -1.131   1.982
  392    HB2  ASP  52           2HB      ASP  52  -6.071   0.344   0.628
  393    HB3  ASP  52           1HB      ASP  52  -7.328   1.125   1.576
  394    H    LYS  53           H        LYS  53  -6.777  -2.364   0.366
  395    HA   LYS  53           HA       LYS  53  -4.332  -3.784   1.168
  396    HB2  LYS  53           2HB      LYS  53  -5.337  -5.424  -0.695
  397    HB3  LYS  53           1HB      LYS  53  -5.787  -5.516   0.996
  398    HG2  LYS  53           2HG      LYS  53  -7.362  -3.918  -0.996
  399    HG3  LYS  53           1HG      LYS  53  -7.656  -5.630  -0.701
  400    HD2  LYS  53           2HD      LYS  53  -7.510  -4.108   1.767
  401    HD3  LYS  53           1HD      LYS  53  -8.762  -3.498   0.687
  402    HE2  LYS  53           2HE      LYS  53  -9.872  -5.572   0.636
  403    HE3  LYS  53           1HE      LYS  53  -8.492  -6.421   1.326
  404    HZ1  LYS  53           3HZ      LYS  53  -9.176  -4.507   3.182
  405    HZ2  LYS  53           1HZ      LYS  53  -9.477  -6.170   3.281
  406    HZ3  LYS  53           2HZ      LYS  53 -10.653  -5.134   2.648
  407    H    LEU  54           H        LEU  54  -2.779  -4.272  -0.348
  408    HA   LEU  54           HA       LEU  54  -2.703  -2.436  -2.628
  409    HG   LEU  54           HG       LEU  54  -1.152  -0.899  -2.128
  410    HB2  LEU  54           2HB      LEU  54  -0.838  -3.005  -0.627
  411    HB3  LEU  54           1HB      LEU  54  -0.185  -3.735  -2.081
  412   HD11  LEU  54          1HD1      LEU  54   0.397  -0.265  -0.672
  413   HD12  LEU  54          2HD1      LEU  54   1.619  -0.823  -1.815
  414   HD13  LEU  54          3HD1      LEU  54   1.036  -1.905  -0.550
  415   HD21  LEU  54          3HD2      LEU  54  -0.633  -2.053  -4.235
  416   HD22  LEU  54          1HD2      LEU  54   1.002  -2.361  -3.650
  417   HD23  LEU  54          2HD2      LEU  54   0.462  -0.705  -3.926
  418    H    LEU  55           H        LEU  55  -2.732  -3.110  -4.627
  419    HA   LEU  55           HA       LEU  55  -2.643  -5.979  -5.180
  420    HG   LEU  55           HG       LEU  55  -4.787  -5.535  -8.144
  421    HB2  LEU  55           2HB      LEU  55  -4.546  -4.597  -6.016
  422    HB3  LEU  55           1HB      LEU  55  -3.417  -3.707  -7.015
  423   HD11  LEU  55          1HD1      LEU  55  -1.914  -6.126  -8.578
  424   HD12  LEU  55          2HD1      LEU  55  -2.458  -4.465  -8.811
  425   HD13  LEU  55          3HD1      LEU  55  -3.190  -5.771  -9.742
  426   HD21  LEU  55          3HD2      LEU  55  -2.752  -7.363  -6.894
  427   HD22  LEU  55          1HD2      LEU  55  -4.135  -7.795  -7.900
  428   HD23  LEU  55          2HD2      LEU  55  -4.391  -7.176  -6.269
  429    H    ALA  56           H        ALA  56  -1.289  -2.923  -6.518
  430    HA   ALA  56           HA       ALA  56   1.232  -4.333  -6.982
  431    HB1  ALA  56           3HB      ALA  56  -0.397  -3.111  -9.218
  432    HB2  ALA  56           1HB      ALA  56   0.123  -4.789  -9.063
  433    HB3  ALA  56           2HB      ALA  56   1.311  -3.519  -9.370
  434    H    VAL  57           H        VAL  57   3.006  -2.878  -7.553
  435    HA   VAL  57           HA       VAL  57   2.518  -0.027  -7.028
  436    HB   VAL  57           HB       VAL  57   4.731  -1.644  -5.742
  437   HG11  VAL  57          1HG1      VAL  57   4.895   0.641  -4.451
  438   HG12  VAL  57          2HG1      VAL  57   4.186   1.279  -5.934
  439   HG13  VAL  57          3HG1      VAL  57   5.719   0.408  -5.991
  440   HG21  VAL  57          3HG2      VAL  57   2.233  -0.416  -4.595
  441   HG22  VAL  57          1HG2      VAL  57   3.593  -0.967  -3.616
  442   HG23  VAL  57          2HG2      VAL  57   2.693  -2.118  -4.605
  443    H    ASN  58           H        ASN  58   3.176   0.995  -8.818
  444    HA   ASN  58           HA       ASN  58   4.382   1.622 -10.633
  445    HB2  ASN  58           2HB      ASN  58   6.530   0.489  -8.863
  446    HB3  ASN  58           1HB      ASN  58   6.920   1.094 -10.470
  447   HD21  ASN  58          1HD2      ASN  58   6.470   1.898  -7.245
  448   HD22  ASN  58          2HD2      ASN  58   6.436   3.617  -7.413
  449    H    ASN  59           H        ASN  59   2.978  -0.801 -10.842
  450    HA   ASN  59           HA       ASN  59   2.659  -2.242 -12.630
  451    HB2  ASN  59           2HB      ASN  59   4.693  -0.963 -13.697
  452    HB3  ASN  59           1HB      ASN  59   5.579  -2.418 -13.251
  453   HD21  ASN  59          1HD2      ASN  59   2.913  -1.159 -15.148
  454   HD22  ASN  59          2HD2      ASN  59   2.841  -2.477 -16.263
  455    H    VAL  60           H        VAL  60   4.889  -2.658 -10.042
  456    HA   VAL  60           HA       VAL  60   5.134  -5.531 -10.431
  457    HB   VAL  60           HB       VAL  60   6.621  -5.582  -8.621
  458   HG11  VAL  60          1HG1      VAL  60   7.993  -3.348  -8.941
  459   HG12  VAL  60          2HG1      VAL  60   6.885  -3.145 -10.297
  460   HG13  VAL  60          3HG1      VAL  60   7.913  -4.574 -10.205
  461   HG21  VAL  60          3HG2      VAL  60   5.009  -3.402  -7.574
  462   HG22  VAL  60          1HG2      VAL  60   6.737  -3.137  -7.353
  463   HG23  VAL  60          2HG2      VAL  60   5.981  -4.600  -6.723
  464    H    CYS  61           H        CYS  61   4.052  -7.108  -9.214
  465    HA   CYS  61           HA       CYS  61   1.630  -6.186  -7.936
  466    HG   CYS  61           HG       CYS  61   3.761  -9.451  -8.918
  467    HB2  CYS  61           2HB      CYS  61   1.048  -8.539  -7.706
  468    HB3  CYS  61           1HB      CYS  61   1.553  -8.175  -9.350
  469    H    LEU  62           H        LEU  62   1.256  -5.944  -5.834
  470    HA   LEU  62           HA       LEU  62   3.367  -6.721  -3.958
  471    HG   LEU  62           HG       LEU  62   3.556  -5.306  -1.894
  472    HB2  LEU  62           2HB      LEU  62   2.143  -4.286  -4.355
  473    HB3  LEU  62           1HB      LEU  62   1.286  -4.923  -2.968
  474   HD11  LEU  62          1HD1      LEU  62   5.415  -3.976  -2.771
  475   HD12  LEU  62          2HD1      LEU  62   4.441  -3.548  -4.177
  476   HD13  LEU  62          3HD1      LEU  62   4.911  -5.227  -3.907
  477   HD21  LEU  62          3HD2      LEU  62   1.959  -3.352  -1.502
  478   HD22  LEU  62          1HD2      LEU  62   3.055  -2.413  -2.513
  479   HD23  LEU  62          2HD2      LEU  62   3.641  -3.138  -1.017
  480    H    GLU  63           H        GLU  63   1.057  -8.374  -5.073
  481    HA   GLU  63           HA       GLU  63  -0.404  -8.939  -2.593
  482    HB2  GLU  63           2HB      GLU  63  -1.989 -10.151  -3.992
  483    HB3  GLU  63           1HB      GLU  63  -1.754  -8.515  -4.592
  484    HG2  GLU  63           2HG      GLU  63  -0.424  -9.274  -6.402
  485    HG3  GLU  63           1HG      GLU  63  -0.309 -10.896  -5.722
  486    H    GLU  64           H        GLU  64   2.019 -10.298  -4.679
  487    HA   GLU  64           HA       GLU  64   1.973 -12.745  -3.050
  488    HB2  GLU  64           2HB      GLU  64   1.457 -12.585  -5.812
  489    HB3  GLU  64           1HB      GLU  64   3.062 -13.277  -5.647
  490    HG2  GLU  64           2HG      GLU  64   0.651 -14.309  -4.183
  491    HG3  GLU  64           1HG      GLU  64   1.195 -14.930  -5.741
  492    H    VAL  65           H        VAL  65   3.496 -10.815  -2.155
  493    HA   VAL  65           HA       VAL  65   6.209 -11.746  -2.748
  494    HB   VAL  65           HB       VAL  65   7.025  -9.348  -2.586
  495   HG11  VAL  65          1HG1      VAL  65   6.844 -10.764  -4.681
  496   HG12  VAL  65          2HG1      VAL  65   6.901  -9.018  -4.915
  497   HG13  VAL  65          3HG1      VAL  65   5.364  -9.874  -5.036
  498   HG21  VAL  65          3HG2      VAL  65   4.978  -8.338  -1.730
  499   HG22  VAL  65          1HG2      VAL  65   4.132  -8.763  -3.217
  500   HG23  VAL  65          2HG2      VAL  65   5.452  -7.593  -3.257
  501    H    THR  66           H        THR  66   7.746 -11.366  -1.100
  502    HA   THR  66           HA       THR  66   6.770 -11.660   1.533
  503    HB   THR  66           HB       THR  66   9.561 -10.701   0.945
  504    HG1  THR  66           1HG      THR  66   8.531 -13.298   0.452
  505   HG21  THR  66          3HG2      THR  66   8.373 -12.588   2.950
  506   HG22  THR  66          1HG2      THR  66   9.243 -11.082   3.242
  507   HG23  THR  66          2HG2      THR  66  10.104 -12.494   2.630
  508    H    HIS  67           H        HIS  67   7.268 -10.201   3.381
  509    HA   HIS  67           HA       HIS  67   6.109  -7.708   3.053
  510    HD1  HIS  67           1HD      HIS  67   4.885  -7.003   6.234
  511    HD2  HIS  67           2HD      HIS  67   8.608  -5.521   5.160
  512    HE1  HIS  67           1HE      HIS  67   4.876  -4.591   6.919
  513    HE2  HIS  67           2HE      HIS  67   7.072  -3.685   6.118
  514    HB2  HIS  67           2HB      HIS  67   6.322  -8.756   5.262
  515    HB3  HIS  67           1HB      HIS  67   8.054  -8.446   5.259
  516    H    GLU  68           H        GLU  68   9.524  -8.574   2.847
  517    HA   GLU  68           HA       GLU  68  10.711  -6.086   2.836
  518    HB2  GLU  68           2HB      GLU  68  11.405  -8.463   1.094
  519    HB3  GLU  68           1HB      GLU  68  12.450  -7.076   1.366
  520    HG2  GLU  68           2HG      GLU  68  12.848  -7.649   3.583
  521    HG3  GLU  68           1HG      GLU  68  11.440  -8.707   3.662
  522    H    GLU  69           H        GLU  69   9.230  -7.798   0.089
  523    HA   GLU  69           HA       GLU  69   9.728  -5.825  -1.861
  524    HB2  GLU  69           2HB      GLU  69   7.822  -8.112  -1.619
  525    HB3  GLU  69           1HB      GLU  69   7.581  -6.944  -2.911
  526    HG2  GLU  69           2HG      GLU  69  10.224  -8.288  -2.474
  527    HG3  GLU  69           1HG      GLU  69   8.943  -9.037  -3.426
  528    H    ALA  70           H        ALA  70   7.124  -6.232   0.475
  529    HA   ALA  70           HA       ALA  70   5.289  -4.333  -0.520
  530    HB1  ALA  70           3HB      ALA  70   4.251  -4.449   1.589
  531    HB2  ALA  70           1HB      ALA  70   5.753  -4.880   2.402
  532    HB3  ALA  70           2HB      ALA  70   4.960  -6.044   1.343
  533    H    VAL  71           H        VAL  71   8.047  -4.047   1.673
  534    HA   VAL  71           HA       VAL  71   7.657  -1.223   2.098
  535    HB   VAL  71           HB       VAL  71   9.811  -3.155   2.942
  536   HG11  VAL  71          1HG1      VAL  71  11.165  -1.318   2.767
  537   HG12  VAL  71          2HG1      VAL  71  10.515  -1.067   4.386
  538   HG13  VAL  71          3HG1      VAL  71   9.844  -0.178   3.020
  539   HG21  VAL  71          3HG2      VAL  71   8.919  -2.969   5.081
  540   HG22  VAL  71          1HG2      VAL  71   7.492  -2.979   4.045
  541   HG23  VAL  71          2HG2      VAL  71   8.088  -1.458   4.710
  542    H    THR  72           H        THR  72   9.791  -3.260   0.149
  543    HA   THR  72           HA       THR  72  11.535  -1.229  -0.720
  544    HB   THR  72           HB       THR  72  10.776  -3.849  -2.025
  545    HG1  THR  72           1HG      THR  72  11.966  -4.580  -0.477
  546   HG21  THR  72          3HG2      THR  72  13.037  -1.973  -2.662
  547   HG22  THR  72          1HG2      THR  72  11.766  -2.537  -3.747
  548   HG23  THR  72          2HG2      THR  72  12.989  -3.665  -3.158
  549    H    ALA  73           H        ALA  73   8.376  -2.264  -1.874
  550    HA   ALA  73           HA       ALA  73   8.545  -0.760  -4.318
  551    HB1  ALA  73           3HB      ALA  73   7.196  -2.903  -3.917
  552    HB2  ALA  73           1HB      ALA  73   6.436  -1.606  -4.839
  553    HB3  ALA  73           2HB      ALA  73   6.010  -1.851  -3.145
  554    H    LEU  74           H        LEU  74   7.125  -0.315  -1.099
  555    HA   LEU  74           HA       LEU  74   5.733   2.099  -1.818
  556    HG   LEU  74           HG       LEU  74   3.999   0.648   1.115
  557    HB2  LEU  74           2HB      LEU  74   6.334   0.626   0.715
  558    HB3  LEU  74           1HB      LEU  74   5.821   2.297   0.816
  559   HD11  LEU  74          1HD1      LEU  74   2.389   1.863  -0.106
  560   HD12  LEU  74          2HD1      LEU  74   3.553   2.293  -1.358
  561   HD13  LEU  74          3HD1      LEU  74   3.687   3.002   0.250
  562   HD21  LEU  74          3HD2      LEU  74   5.120  -0.685  -0.969
  563   HD22  LEU  74          1HD2      LEU  74   3.758   0.114  -1.753
  564   HD23  LEU  74          2HD2      LEU  74   3.483  -0.946  -0.370
  565    H    LYS  75           H        LYS  75   8.815   1.204  -0.433
  566    HA   LYS  75           HA       LYS  75   9.618   3.849   0.306
  567    HB2  LYS  75           2HB      LYS  75  10.811   2.343   1.535
  568    HB3  LYS  75           1HB      LYS  75  10.874   1.167   0.235
  569    HG2  LYS  75           2HG      LYS  75  12.688   2.264  -0.808
  570    HG3  LYS  75           1HG      LYS  75  12.506   3.687   0.222
  571    HD2  LYS  75           2HD      LYS  75  14.374   2.426   1.028
  572    HD3  LYS  75           1HD      LYS  75  13.057   2.246   2.187
  573    HE2  LYS  75           2HE      LYS  75  12.500   0.071   1.225
  574    HE3  LYS  75           1HE      LYS  75  13.795   0.255   0.042
  575    HZ1  LYS  75           3HZ      LYS  75  14.432  -1.141   1.933
  576    HZ2  LYS  75           1HZ      LYS  75  14.185   0.160   2.985
  577    HZ3  LYS  75           2HZ      LYS  75  15.405   0.238   1.816
  578    H    ASN  76           H        ASN  76   9.898   1.970  -2.654
  579    HA   ASN  76           HA       ASN  76  11.954   3.604  -3.780
  580    HB2  ASN  76           2HB      ASN  76  11.271   1.167  -4.396
  581    HB3  ASN  76           1HB      ASN  76  10.122   1.950  -5.478
  582   HD21  ASN  76          1HD2      ASN  76  11.289   3.932  -6.644
  583   HD22  ASN  76          2HD2      ASN  76  12.772   3.511  -7.406
  584    H    THR  77           H        THR  77  10.976   5.669  -3.326
  585    HA   THR  77           HA       THR  77   9.153   6.519  -5.482
  586    HB   THR  77           HB       THR  77   7.854   6.599  -3.496
  587    HG1  THR  77           1HG      THR  77   7.525   8.478  -4.572
  588   HG21  THR  77          3HG2      THR  77   8.846   6.608  -1.524
  589   HG22  THR  77          1HG2      THR  77   9.081   8.344  -1.727
  590   HG23  THR  77          2HG2      THR  77  10.351   7.219  -2.210
  591    H    SER  78           H        SER  78   9.645   8.425  -6.524
  592    HA   SER  78           HA       SER  78  12.059   9.861  -5.630
  593    HG   SER  78           HG       SER  78  13.954   8.789  -7.303
  594    HB2  SER  78           2HB      SER  78  11.410   8.862  -8.403
  595    HB3  SER  78           1HB      SER  78  12.563  10.169  -8.129
  596    H    ASP  79           H        ASP  79   9.963  10.361  -8.459
  597    HA   ASP  79           HA       ASP  79   9.449  13.091  -7.513
  598    HB2  ASP  79           2HB      ASP  79   9.103  11.836 -10.248
  599    HB3  ASP  79           1HB      ASP  79   8.695  13.504  -9.859
  600    H    PHE  80           H        PHE  80   7.689  10.465  -9.169
  601    HA   PHE  80           HA       PHE  80   5.277  11.223  -7.654
  602    HD1  PHE  80           1HD      PHE  80   5.367  13.451  -9.528
  603    HD2  PHE  80           2HD      PHE  80   2.297  10.523  -9.841
  604    HE1  PHE  80           1HE      PHE  80   3.672  15.230  -9.451
  605    HE2  PHE  80           2HE      PHE  80   0.592  12.300  -9.764
  606    HZ   PHE  80           HZ       PHE  80   1.281  14.657  -9.569
  607    HB2  PHE  80           2HB      PHE  80   5.691  11.036 -10.505
  608    HB3  PHE  80           1HB      PHE  80   4.483   9.860  -9.996
  609    H    VAL  81           H        VAL  81   3.654   9.304  -7.589
  610    HA   VAL  81           HA       VAL  81   5.018   6.720  -7.535
  611    HB   VAL  81           HB       VAL  81   4.305   8.216  -5.181
  612   HG11  VAL  81          1HG1      VAL  81   2.860   5.582  -5.464
  613   HG12  VAL  81          2HG1      VAL  81   2.119   7.172  -5.291
  614   HG13  VAL  81          3HG1      VAL  81   3.050   6.485  -3.961
  615   HG21  VAL  81          3HG2      VAL  81   5.280   5.388  -5.185
  616   HG22  VAL  81          1HG2      VAL  81   5.713   6.720  -4.114
  617   HG23  VAL  81          2HG2      VAL  81   6.309   6.694  -5.772
  618    H    TYR  82           H        TYR  82   3.648   4.962  -7.931
  619    HA   TYR  82           HA       TYR  82   0.822   5.624  -8.419
  620    HD1  TYR  82           1HD      TYR  82   0.713   2.213 -10.428
  621    HD2  TYR  82           2HD      TYR  82   0.034   6.317 -11.323
  622    HE1  TYR  82           1HE      TYR  82  -1.336   1.606 -11.627
  623    HE2  TYR  82           2HE      TYR  82  -2.025   5.718 -12.521
  624    HH   TYR  82           HH       TYR  82  -2.739   3.046 -13.729
  625    HB2  TYR  82           2HB      TYR  82   2.199   5.555 -10.529
  626    HB3  TYR  82           1HB      TYR  82   2.487   3.852 -10.200
  627    H    LEU  83           H        LEU  83   0.000   4.626  -6.705
  628    HA   LEU  83           HA       LEU  83   0.727   1.880  -6.058
  629    HG   LEU  83           HG       LEU  83  -0.687   1.021  -4.095
  630    HB2  LEU  83           2HB      LEU  83   0.405   3.759  -4.353
  631    HB3  LEU  83           1HB      LEU  83  -1.313   3.589  -4.654
  632   HD11  LEU  83          1HD1      LEU  83   1.425   2.720  -2.899
  633   HD12  LEU  83          2HD1      LEU  83   1.484   1.041  -3.433
  634   HD13  LEU  83          3HD1      LEU  83   0.735   1.450  -1.890
  635   HD21  LEU  83          3HD2      LEU  83  -1.972   1.332  -2.243
  636   HD22  LEU  83          1HD2      LEU  83  -2.305   2.855  -3.068
  637   HD23  LEU  83          2HD2      LEU  83  -1.121   2.800  -1.762
  638    H    LYS  84           H        LYS  84  -0.469   0.148  -6.567
  639    HA   LYS  84           HA       LYS  84  -3.090   0.594  -7.807
  640    HB2  LYS  84           2HB      LYS  84  -0.916  -1.366  -8.328
  641    HB3  LYS  84           1HB      LYS  84  -2.572  -1.882  -8.604
  642    HG2  LYS  84           2HG      LYS  84  -1.238   0.505  -9.869
  643    HG3  LYS  84           1HG      LYS  84  -1.528  -1.052 -10.645
  644    HD2  LYS  84           2HD      LYS  84  -3.658   0.807  -9.588
  645    HD3  LYS  84           1HD      LYS  84  -3.209   0.624 -11.284
  646    HE2  LYS  84           2HE      LYS  84  -3.761  -1.856 -10.969
  647    HE3  LYS  84           1HE      LYS  84  -4.550  -1.362  -9.472
  648    HZ1  LYS  84           3HZ      LYS  84  -6.212  -1.389 -11.108
  649    HZ2  LYS  84           1HZ      LYS  84  -5.250  -0.581 -12.241
  650    HZ3  LYS  84           2HZ      LYS  84  -5.845   0.248 -10.893
  651    H    VAL  85           H        VAL  85  -4.704   0.252  -6.440
  652    HA   VAL  85           HA       VAL  85  -4.447  -1.951  -4.494
  653    HB   VAL  85           HB       VAL  85  -6.100   0.579  -4.358
  654   HG11  VAL  85          1HG1      VAL  85  -7.522  -0.615  -3.110
  655   HG12  VAL  85          2HG1      VAL  85  -6.254  -0.594  -1.882
  656   HG13  VAL  85          3HG1      VAL  85  -6.401  -1.972  -2.972
  657   HG21  VAL  85          3HG2      VAL  85  -4.708   0.932  -2.284
  658   HG22  VAL  85          1HG2      VAL  85  -3.842   1.056  -3.815
  659   HG23  VAL  85          2HG2      VAL  85  -3.696  -0.404  -2.835
  660    H    ALA  86           H        ALA  86  -5.700  -3.673  -4.814
  661    HA   ALA  86           HA       ALA  86  -8.144  -3.362  -6.439
  662    HB1  ALA  86           3HB      ALA  86  -7.846  -5.732  -7.084
  663    HB2  ALA  86           1HB      ALA  86  -6.315  -5.748  -6.211
  664    HB3  ALA  86           2HB      ALA  86  -6.520  -4.698  -7.613
  665    H    LYS  87           H        LYS  87  -9.992  -3.674  -5.403
  666    HA   LYS  87           HA       LYS  87 -10.100  -4.573  -2.709
  667    HB2  LYS  87           2HB      LYS  87 -12.077  -3.695  -4.755
  668    HB3  LYS  87           1HB      LYS  87 -12.681  -4.625  -3.392
  669    HG2  LYS  87           2HG      LYS  87 -11.846  -3.001  -1.836
  670    HG3  LYS  87           1HG      LYS  87 -11.044  -2.112  -3.133
  671    HD2  LYS  87           2HD      LYS  87 -13.145  -1.492  -4.099
  672    HD3  LYS  87           1HD      LYS  87 -14.023  -2.561  -3.003
  673    HE2  LYS  87           2HE      LYS  87 -13.381  -1.192  -1.108
  674    HE3  LYS  87           1HE      LYS  87 -12.402  -0.163  -2.152
  675    HZ1  LYS  87           3HZ      LYS  87 -14.403   0.518  -3.311
  676    HZ2  LYS  87           1HZ      LYS  87 -14.550   0.837  -1.655
  677    HZ3  LYS  87           2HZ      LYS  87 -15.350  -0.489  -2.337
  678    HA   PRO  88           HA       PRO  88 -10.060  -8.966  -3.668
  679    HB2  PRO  88           2HB      PRO  88 -10.828  -9.150  -0.806
  680    HB3  PRO  88           1HB      PRO  88  -9.480  -9.907  -1.659
  681    HG2  PRO  88           2HG      PRO  88  -9.070  -7.868   0.000
  682    HG3  PRO  88           1HG      PRO  88  -8.151  -8.016  -1.509
  683    HD2  PRO  88           2HD      PRO  88 -10.483  -6.247  -0.876
  684    HD3  PRO  88           1HD      PRO  88  -9.008  -5.881  -1.795
  685    H    THR  89           H        THR  89 -11.665 -10.286  -4.361
  686    HA   THR  89           HA       THR  89 -14.306 -10.155  -3.128
  687    HB   THR  89           HB       THR  89 -15.311 -10.080  -5.501
  688    HG1  THR  89           1HG      THR  89 -12.837  -8.820  -6.072
  689   HG21  THR  89          3HG2      THR  89 -15.452  -7.707  -5.559
  690   HG22  THR  89          1HG2      THR  89 -13.996  -7.539  -4.577
  691   HG23  THR  89          2HG2      THR  89 -15.465  -8.212  -3.869
  692    H    GLY  90           H        GLY  90 -15.239 -12.103  -2.987
  693    HA2  GLY  90           2HA      GLY  90 -15.829 -14.197  -4.150
  694    HA3  GLY  90           1HA      GLY  90 -14.157 -14.278  -4.675
  695    H    SER  91           H        SER  91 -14.339 -13.170  -1.481
  696    HA   SER  91           HA       SER  91 -13.125 -15.529  -0.457
  697    HG   SER  91           HG       SER  91 -14.127 -12.261   1.760
  698    HB2  SER  91           2HB      SER  91 -13.239 -14.356   1.732
  699    HB3  SER  91           1HB      SER  91 -12.546 -13.351   0.459
  700    H    HIS  92           H        HIS  92 -16.391 -14.193  -0.311
  701    HA   HIS  92           HA       HIS  92 -17.354 -16.120   1.585
  702    HD1  HIS  92           1HD      HIS  92 -17.252 -12.291   0.570
  703    HD2  HIS  92           2HD      HIS  92 -19.470 -14.171   3.538
  704    HE1  HIS  92           1HE      HIS  92 -17.137 -10.763   2.564
  705    HE2  HIS  92           2HE      HIS  92 -18.583 -11.867   4.306
  706    HB2  HIS  92           2HB      HIS  92 -18.836 -14.235  -0.263
  707    HB3  HIS  92           1HB      HIS  92 -19.597 -15.213   0.988
  708    HA   ARG 301           HA       ARG 301   2.339 -11.091   9.974
  709    HE   ARG 301           HE       ARG 301  -2.043 -11.095  12.081
  710    H1   ARG 301           1HT      ARG 301   3.372 -12.807  11.062
  711    H2   ARG 301           2HT      ARG 301   1.718 -12.927  11.502
  712    H3   ARG 301           3HT      ARG 301   2.858 -12.273  12.607
  713    HB2  ARG 301           2HB      ARG 301   0.879  -9.478  11.260
  714    HB3  ARG 301           1HB      ARG 301   0.213 -11.087  11.033
  715    HG2  ARG 301           2HG      ARG 301   1.649 -11.062  13.488
  716    HG3  ARG 301           1HG      ARG 301   0.591  -9.650  13.442
  717    HD2  ARG 301           2HD      ARG 301  -0.323 -12.452  12.818
  718    HD3  ARG 301           1HD      ARG 301  -0.438 -11.722  14.418
  719   HH11  ARG 301          1HH1      ARG 301  -1.108 -10.164  15.327
  720   HH12  ARG 301          2HH1      ARG 301  -2.502  -9.170  15.573
  721   HH21  ARG 301          1HH2      ARG 301  -3.873  -9.780  12.411
  722   HH22  ARG 301          2HH2      ARG 301  -4.072  -8.950  13.919
  723    H    ARG 302           H        ARG 302   3.312  -9.104   9.696
  724    HA   ARG 302           HA       ARG 302   4.842  -7.933  11.877
  725    HE   ARG 302           HE       ARG 302   8.321  -9.435  12.179
  726    HB2  ARG 302           2HB      ARG 302   6.392  -9.552  10.862
  727    HB3  ARG 302           1HB      ARG 302   6.141  -8.806   9.290
  728    HG2  ARG 302           2HG      ARG 302   7.241  -6.817   9.954
  729    HG3  ARG 302           1HG      ARG 302   7.243  -7.303  11.649
  730    HD2  ARG 302           2HD      ARG 302   8.665  -8.886   9.524
  731    HD3  ARG 302           1HD      ARG 302   9.429  -7.535  10.357
  732   HH11  ARG 302          1HH1      ARG 302  11.090  -8.793  10.135
  733   HH12  ARG 302          2HH1      ARG 302  12.169  -9.757  11.085
  734   HH21  ARG 302          1HH2      ARG 302   9.750 -10.703  13.428
  735   HH22  ARG 302          2HH2      ARG 302  11.410 -10.842  12.953
  736    H    GLU 303           H        GLU 303   4.996  -5.762  11.735
  737    HA   GLU 303           HA       GLU 303   4.040  -4.490   9.251
  738    HB2  GLU 303           2HB      GLU 303   3.661  -3.514  12.090
  739    HB3  GLU 303           1HB      GLU 303   3.074  -2.716  10.639
  740    HG2  GLU 303           2HG      GLU 303   1.190  -3.788  11.419
  741    HG3  GLU 303           1HG      GLU 303   1.801  -4.922  10.216
  742    H    THR 304           H        THR 304   5.067  -2.609   8.557
  743    HA   THR 304           HA       THR 304   7.273  -1.534  10.101
  744    HB   THR 304           HB       THR 304   7.636  -3.338   7.820
  745    HG1  THR 304           1HG      THR 304   9.330  -2.340   9.859
  746   HG21  THR 304          3HG2      THR 304   9.641  -2.228   6.960
  747   HG22  THR 304          1HG2      THR 304   9.219  -0.786   7.885
  748   HG23  THR 304          2HG2      THR 304   8.160  -1.346   6.590
  749    H    GLN 305           H        GLN 305   7.887   0.543   9.499
  750    HA   GLN 305           HA       GLN 305   5.912   2.013   8.018
  751    HB2  GLN 305           2HB      GLN 305   8.211   2.670   9.750
  752    HB3  GLN 305           1HB      GLN 305   7.835   3.850   8.500
  753    HG2  GLN 305           2HG      GLN 305   5.677   4.222   9.348
  754    HG3  GLN 305           1HG      GLN 305   5.748   2.790  10.374
  755   HE21  GLN 305          1HE2      GLN 305   6.555   2.960  12.390
  756   HE22  GLN 305          2HE2      GLN 305   7.196   4.414  13.066
  757    H    VAL 306           H        VAL 306   6.335   3.420   6.247
  758    HA   VAL 306           HA       VAL 306   8.719   2.845   4.651
  759    HB   VAL 306           HB       VAL 306   7.228   2.609   2.605
  760   HG11  VAL 306          1HG1      VAL 306   6.918   0.227   2.940
  761   HG12  VAL 306          2HG1      VAL 306   7.083   0.425   4.684
  762   HG13  VAL 306          3HG1      VAL 306   8.457   0.743   3.625
  763   HG21  VAL 306          3HG2      VAL 306   5.111   1.805   4.584
  764   HG22  VAL 306          1HG2      VAL 306   4.960   2.028   2.841
  765   HG23  VAL 306          2HG2      VAL 306   5.182   3.426   3.893
  Start of MODEL    3
    1    HA   MET   1           HA       MET   1  -9.426   4.512  -8.077
    2    H1   MET   1           1HT      MET   1  -9.326   2.317 -10.038
    3    H2   MET   1           2HT      MET   1  -9.245   3.996 -10.385
    4    H3   MET   1           3HT      MET   1 -10.673   3.325  -9.708
    5    HB2  MET   1           2HB      MET   1 -10.182   1.714  -8.001
    6    HB3  MET   1           1HB      MET   1  -8.890   2.040  -6.856
    7    HG2  MET   1           2HG      MET   1 -10.329   3.996  -6.065
    8    HG3  MET   1           1HG      MET   1 -11.634   3.231  -6.968
    9    HE1  MET   1           3HE      MET   1 -12.106   3.935  -4.282
   10    HE2  MET   1           1HE      MET   1 -12.275   2.607  -3.133
   11    HE3  MET   1           2HE      MET   1 -13.258   2.637  -4.596
   12    H    GLU   2           H        GLU   2  -7.473   5.443  -8.706
   13    HA   GLU   2           HA       GLU   2  -5.106   3.783  -8.167
   14    HB2  GLU   2           2HB      GLU   2  -3.915   5.146  -9.954
   15    HB3  GLU   2           1HB      GLU   2  -5.062   3.940 -10.517
   16    HG2  GLU   2           2HG      GLU   2  -6.231   6.584 -10.119
   17    HG3  GLU   2           1HG      GLU   2  -4.958   6.537 -11.337
   18    H    ILE   3           H        ILE   3  -3.807   4.582  -6.729
   19    HA   ILE   3           HA       ILE   3  -4.214   7.321  -5.767
   20    HB   ILE   3           HB       ILE   3  -2.537   5.143  -4.510
   21   HG12  ILE   3          2HG1      ILE   3  -4.975   5.778  -3.093
   22   HG13  ILE   3          1HG1      ILE   3  -5.341   5.253  -4.734
   23   HG21  ILE   3          1HG2      ILE   3  -2.993   6.610  -2.454
   24   HG22  ILE   3          2HG2      ILE   3  -3.425   7.861  -3.620
   25   HG23  ILE   3          3HG2      ILE   3  -1.804   7.167  -3.630
   26   HD11  ILE   3          3HD1      ILE   3  -5.217   3.503  -2.856
   27   HD12  ILE   3          1HD1      ILE   3  -3.469   3.680  -3.016
   28   HD13  ILE   3          2HD1      ILE   3  -4.432   3.153  -4.397
   29    H    LYS   4           H        LYS   4  -3.059   8.725  -6.991
   30    HA   LYS   4           HA       LYS   4  -0.258   8.080  -7.584
   31    HB2  LYS   4           2HB      LYS   4  -2.309   9.285  -9.105
   32    HB3  LYS   4           1HB      LYS   4  -1.145  10.556  -8.760
   33    HG2  LYS   4           2HG      LYS   4   0.617   8.846  -9.555
   34    HG3  LYS   4           1HG      LYS   4  -0.760   8.007 -10.274
   35    HD2  LYS   4           2HD      LYS   4  -0.406  10.931 -10.761
   36    HD3  LYS   4           1HD      LYS   4   0.585   9.779 -11.656
   37    HE2  LYS   4           2HE      LYS   4  -1.105   9.286 -13.013
   38    HE3  LYS   4           1HE      LYS   4  -2.163   8.934 -11.648
   39    HZ1  LYS   4           3HZ      LYS   4  -1.654  11.626 -12.799
   40    HZ2  LYS   4           1HZ      LYS   4  -2.662  11.297 -11.478
   41    HZ3  LYS   4           2HZ      LYS   4  -3.058  10.707 -13.013
   42    H    LEU   5           H        LEU   5   0.642   8.492  -5.644
   43    HA   LEU   5           HA       LEU   5   0.299  11.078  -4.358
   44    HG   LEU   5           HG       LEU   5   0.399  10.446  -1.631
   45    HB2  LEU   5           2HB      LEU   5   1.452   8.471  -3.608
   46    HB3  LEU   5           1HB      LEU   5   2.241   9.867  -2.901
   47   HD11  LEU   5          1HD1      LEU   5  -1.896   9.390  -2.127
   48   HD12  LEU   5          2HD1      LEU   5  -1.221   9.037  -3.718
   49   HD13  LEU   5          3HD1      LEU   5  -1.331  10.705  -3.156
   50   HD21  LEU   5          3HD2      LEU   5   0.017   7.469  -1.889
   51   HD22  LEU   5          1HD2      LEU   5  -0.339   8.481  -0.488
   52   HD23  LEU   5          2HD2      LEU   5   1.333   8.224  -0.988
   53    H    ILE   6           H        ILE   6   1.630  12.760  -4.436
   54    HA   ILE   6           HA       ILE   6   3.928  12.625  -6.210
   55    HB   ILE   6           HB       ILE   6   2.327  14.500  -6.412
   56   HG12  ILE   6          2HG1      ILE   6   5.108  15.358  -5.578
   57   HG13  ILE   6          1HG1      ILE   6   4.675  14.725  -7.162
   58   HG21  ILE   6          1HG2      ILE   6   3.447  15.640  -3.876
   59   HG22  ILE   6          2HG2      ILE   6   2.001  14.631  -3.867
   60   HG23  ILE   6          3HG2      ILE   6   2.018  16.138  -4.782
   61   HD11  ILE   6          3HD1      ILE   6   4.234  17.392  -5.998
   62   HD12  ILE   6          1HD1      ILE   6   2.935  16.753  -7.006
   63   HD13  ILE   6          2HD1      ILE   6   4.564  16.914  -7.663
   64    H    LYS   7           H        LYS   7   5.956  12.407  -5.525
   65    HA   LYS   7           HA       LYS   7   6.648  12.056  -2.832
   66    HB2  LYS   7           2HB      LYS   7   7.899  11.075  -4.720
   67    HB3  LYS   7           1HB      LYS   7   8.482  12.675  -5.150
   68    HG2  LYS   7           2HG      LYS   7  10.251  11.736  -3.976
   69    HG3  LYS   7           1HG      LYS   7   9.450  12.753  -2.778
   70    HD2  LYS   7           2HD      LYS   7   8.148  10.331  -2.531
   71    HD3  LYS   7           1HD      LYS   7   9.823   9.864  -2.832
   72    HE2  LYS   7           2HE      LYS   7   9.040  11.907  -0.765
   73    HE3  LYS   7           1HE      LYS   7   9.160  10.185  -0.408
   74    HZ1  LYS   7           3HZ      LYS   7  11.484  10.261  -1.136
   75    HZ2  LYS   7           1HZ      LYS   7  11.200  11.300   0.168
   76    HZ3  LYS   7           2HZ      LYS   7  11.355  11.927  -1.394
   77    H    GLY   8           H        GLY   8   6.769  13.521  -1.289
   78    HA2  GLY   8           2HA      GLY   8   7.747  16.229  -1.975
   79    HA3  GLY   8           1HA      GLY   8   6.502  15.932  -0.770
   80    HA   PRO   9           HA       PRO   9  10.588  16.420   1.446
   81    HB2  PRO   9           2HB      PRO   9   8.762  17.587   3.461
   82    HB3  PRO   9           1HB      PRO   9  10.281  18.220   2.817
   83    HG2  PRO   9           2HG      PRO   9   7.931  19.290   2.124
   84    HG3  PRO   9           1HG      PRO   9   9.261  19.150   0.961
   85    HD2  PRO   9           2HD      PRO   9   6.804  17.464   1.246
   86    HD3  PRO   9           1HD      PRO   9   7.613  18.039  -0.227
   87    H    LYS  10           H        LYS  10   7.406  15.441   2.667
   88    HA   LYS  10           HA       LYS  10   8.614  13.730   4.691
   89    HB2  LYS  10           2HB      LYS  10   5.728  14.316   4.007
   90    HB3  LYS  10           1HB      LYS  10   6.229  13.215   5.283
   91    HG2  LYS  10           2HG      LYS  10   6.876  14.890   6.671
   92    HG3  LYS  10           1HG      LYS  10   7.342  15.961   5.348
   93    HD2  LYS  10           2HD      LYS  10   4.478  15.264   5.966
   94    HD3  LYS  10           1HD      LYS  10   5.302  16.653   6.676
   95    HE2  LYS  10           2HE      LYS  10   5.102  16.191   3.706
   96    HE3  LYS  10           1HE      LYS  10   3.918  17.126   4.619
   97    HZ1  LYS  10           3HZ      LYS  10   6.805  17.734   4.289
   98    HZ2  LYS  10           1HZ      LYS  10   5.782  18.568   5.349
   99    HZ3  LYS  10           2HZ      LYS  10   5.499  18.620   3.683
  100    H    GLY  11           H        GLY  11   6.223  13.277   2.070
  101    HA2  GLY  11           2HA      GLY  11   6.411  11.586   0.399
  102    HA3  GLY  11           1HA      GLY  11   7.455  10.674   1.480
  103    H    LEU  12           H        LEU  12   6.193   8.801   1.181
  104    HA   LEU  12           HA       LEU  12   3.570   8.306   1.276
  105    HG   LEU  12           HG       LEU  12   4.477   6.487   0.038
  106    HB2  LEU  12           2HB      LEU  12   5.756   6.824   2.725
  107    HB3  LEU  12           1HB      LEU  12   4.117   6.216   2.623
  108   HD11  LEU  12          1HD1      LEU  12   7.179   6.851   1.154
  109   HD12  LEU  12          2HD1      LEU  12   6.504   7.377  -0.388
  110   HD13  LEU  12          3HD1      LEU  12   7.047   5.712  -0.186
  111   HD21  LEU  12          3HD2      LEU  12   4.705   4.381   1.873
  112   HD22  LEU  12          1HD2      LEU  12   6.057   4.200   0.755
  113   HD23  LEU  12          2HD2      LEU  12   4.405   4.271   0.139
  114    H    GLY  13           H        GLY  13   5.448   8.336   4.321
  115    HA2  GLY  13           2HA      GLY  13   4.881   9.049   6.435
  116    HA3  GLY  13           1HA      GLY  13   3.577   9.969   5.706
  117    H    PHE  14           H        PHE  14   4.206   6.466   5.824
  118    HA   PHE  14           HA       PHE  14   2.134   5.960   7.719
  119    HD1  PHE  14           2HD      PHE  14   2.172   3.091   4.884
  120    HD2  PHE  14           1HD      PHE  14   1.051   6.993   3.606
  121    HE1  PHE  14           2HE      PHE  14   2.672   2.468   2.561
  122    HE2  PHE  14           1HE      PHE  14   1.546   6.376   1.278
  123    HZ   PHE  14           HZ       PHE  14   2.356   4.110   0.753
  124    HB2  PHE  14           2HB      PHE  14   0.638   4.675   6.236
  125    HB3  PHE  14           1HB      PHE  14   0.688   6.377   5.806
  126    H    SER  15           H        SER  15   1.609   3.296   7.330
  127    HA   SER  15           HA       SER  15   4.230   2.043   6.998
  128    HG   SER  15           HG       SER  15   2.331   3.029   9.700
  129    HB2  SER  15           2HB      SER  15   3.256   0.478   8.926
  130    HB3  SER  15           1HB      SER  15   4.210   1.912   9.289
  131    H    ILE  16           H        ILE  16   3.940  -0.433   6.877
  132    HA   ILE  16           HA       ILE  16   1.368  -1.306   5.849
  133    HB   ILE  16           HB       ILE  16   1.901  -1.724   3.674
  134   HG12  ILE  16          2HG1      ILE  16   3.979  -3.004   4.167
  135   HG13  ILE  16          1HG1      ILE  16   4.055  -2.052   2.692
  136   HG21  ILE  16          1HG2      ILE  16   1.808   0.650   3.868
  137   HG22  ILE  16          2HG2      ILE  16   3.039   0.234   2.679
  138   HG23  ILE  16          3HG2      ILE  16   3.515   0.726   4.303
  139   HD11  ILE  16          3HD1      ILE  16   5.832  -2.050   4.864
  140   HD12  ILE  16          1HD1      ILE  16   5.025  -0.480   4.842
  141   HD13  ILE  16          2HD1      ILE  16   5.874  -1.053   3.406
  142    H    ALA  17           H        ALA  17   1.480  -3.587   5.122
  143    HA   ALA  17           HA       ALA  17   3.590  -5.185   6.373
  144    HB1  ALA  17           3HB      ALA  17   2.006  -5.437   8.043
  145    HB2  ALA  17           1HB      ALA  17   1.614  -6.787   6.978
  146    HB3  ALA  17           2HB      ALA  17   0.650  -5.308   6.922
  147    H    GLY  18           H        GLY  18   3.378  -7.545   5.439
  148    HA2  GLY  18           2HA      GLY  18   1.858  -8.201   3.270
  149    HA3  GLY  18           1HA      GLY  18   3.131  -7.225   2.579
  150    H    GLY  19           H        GLY  19   2.234 -10.384   2.890
  151    HA2  GLY  19           2HA      GLY  19   3.819 -11.940   1.916
  152    HA3  GLY  19           1HA      GLY  19   5.075 -11.171   2.867
  153    H    VAL  20           H        VAL  20   4.484 -13.957   2.722
  154    HA   VAL  20           HA       VAL  20   3.034 -14.839   4.993
  155    HB   VAL  20           HB       VAL  20   5.262 -16.302   3.553
  156   HG11  VAL  20          1HG1      VAL  20   3.082 -17.205   5.418
  157   HG12  VAL  20          2HG1      VAL  20   4.824 -17.427   5.580
  158   HG13  VAL  20          3HG1      VAL  20   3.934 -18.314   4.342
  159   HG21  VAL  20          3HG2      VAL  20   3.586 -15.642   1.946
  160   HG22  VAL  20          1HG2      VAL  20   2.298 -16.245   2.991
  161   HG23  VAL  20          2HG2      VAL  20   3.440 -17.371   2.260
  162    H    GLY  21           H        GLY  21   3.833 -15.605   7.011
  163    HA2  GLY  21           2HA      GLY  21   5.361 -15.795   8.773
  164    HA3  GLY  21           1HA      GLY  21   6.618 -15.171   7.716
  165    H    ASN  22           H        ASN  22   4.591 -12.924   7.078
  166    HA   ASN  22           HA       ASN  22   4.719 -11.372   9.548
  167    HB2  ASN  22           2HB      ASN  22   5.728  -9.472   8.480
  168    HB3  ASN  22           1HB      ASN  22   6.761 -10.839   8.085
  169   HD21  ASN  22          1HD2      ASN  22   4.611  -8.459   6.917
  170   HD22  ASN  22          2HD2      ASN  22   4.859  -8.770   5.241
  171    H    GLN  23           H        GLN  23   2.695 -12.745   7.683
  172    HA   GLN  23           HA       GLN  23   1.174 -11.116   6.159
  173    HB2  GLN  23           2HB      GLN  23   0.923 -13.613   6.748
  174    HB3  GLN  23           1HB      GLN  23  -0.120 -13.053   8.049
  175    HG2  GLN  23           2HG      GLN  23  -1.558 -11.941   6.398
  176    HG3  GLN  23           1HG      GLN  23  -0.527 -12.556   5.107
  177   HE21  GLN  23          1HE2      GLN  23  -1.988 -13.951   8.042
  178   HE22  GLN  23          2HE2      GLN  23  -2.704 -15.303   7.242
  179    H    HIS  24           H        HIS  24  -0.383  -9.617   6.356
  180    HA   HIS  24           HA       HIS  24  -0.776  -8.380   8.977
  181    HD1  HIS  24           1HD      HIS  24  -0.195  -5.448   9.120
  182    HD2  HIS  24           2HD      HIS  24  -3.755  -5.908   7.037
  183    HE1  HIS  24           1HE      HIS  24  -1.669  -3.583   9.898
  184    HE2  HIS  24           2HE      HIS  24  -3.779  -3.802   8.545
  185    HB2  HIS  24           2HB      HIS  24  -0.090  -7.003   7.008
  186    HB3  HIS  24           1HB      HIS  24  -1.615  -7.392   6.243
  187    H    ILE  25           H        ILE  25  -2.531 -10.035   6.449
  188    HA   ILE  25           HA       ILE  25  -4.942  -9.991   8.135
  189    HB   ILE  25           HB       ILE  25  -4.969  -9.787   5.120
  190   HG12  ILE  25          2HG1      ILE  25  -4.152  -7.712   6.214
  191   HG13  ILE  25          1HG1      ILE  25  -5.696  -7.491   5.402
  192   HG21  ILE  25          1HG2      ILE  25  -7.263  -9.426   7.030
  193   HG22  ILE  25          2HG2      ILE  25  -6.886 -10.966   6.256
  194   HG23  ILE  25          3HG2      ILE  25  -7.321  -9.567   5.273
  195   HD11  ILE  25          3HD1      ILE  25  -4.998  -7.092   8.166
  196   HD12  ILE  25          1HD1      ILE  25  -6.374  -8.182   8.003
  197   HD13  ILE  25          2HD1      ILE  25  -6.430  -6.575   7.278
  198    HA   PRO  26           HA       PRO  26  -4.521 -14.417   7.857
  199    HB2  PRO  26           2HB      PRO  26  -7.166 -14.991   8.468
  200    HB3  PRO  26           1HB      PRO  26  -5.883 -14.719   9.652
  201    HG2  PRO  26           2HG      PRO  26  -7.964 -12.831   8.640
  202    HG3  PRO  26           1HG      PRO  26  -7.325 -13.025  10.283
  203    HD2  PRO  26           2HD      PRO  26  -6.551 -10.998   8.716
  204    HD3  PRO  26           1HD      PRO  26  -5.410 -11.799   9.815
  205    H    GLY  27           H        GLY  27  -4.311 -15.259   5.879
  206    HA2  GLY  27           2HA      GLY  27  -5.355 -16.549   4.142
  207    HA3  GLY  27           1HA      GLY  27  -6.716 -15.441   4.190
  208    H    ASP  28           H        ASP  28  -5.465 -12.983   4.028
  209    HA   ASP  28           HA       ASP  28  -4.411 -13.097   1.294
  210    HB2  ASP  28           2HB      ASP  28  -6.332 -11.441   2.570
  211    HB3  ASP  28           1HB      ASP  28  -4.969 -10.415   2.139
  212    H    ASN  29           H        ASN  29  -2.273 -13.151   1.210
  213    HA   ASN  29           HA       ASN  29  -0.622 -11.859   3.214
  214    HB2  ASN  29           2HB      ASN  29   0.062 -13.477   0.755
  215    HB3  ASN  29           1HB      ASN  29   1.270 -12.789   1.836
  216   HD21  ASN  29          1HD2      ASN  29  -1.178 -15.215   1.441
  217   HD22  ASN  29          2HD2      ASN  29  -0.782 -16.131   2.852
  218    H    SER  30           H        SER  30  -2.310 -10.270   1.210
  219    HA   SER  30           HA       SER  30  -0.565  -8.946  -0.580
  220    HG   SER  30           HG       SER  30  -4.375  -8.843  -0.440
  221    HB2  SER  30           2HB      SER  30  -2.927  -7.477   0.477
  222    HB3  SER  30           1HB      SER  30  -2.387  -7.693  -1.186
  223    H    ILE  31           H        ILE  31  -0.581  -6.342  -0.333
  224    HA   ILE  31           HA       ILE  31   0.832  -5.896   2.194
  225    HB   ILE  31           HB       ILE  31   0.918  -4.106  -0.233
  226   HG12  ILE  31          2HG1      ILE  31   2.171  -5.704  -1.186
  227   HG13  ILE  31          1HG1      ILE  31   3.409  -5.226  -0.043
  228   HG21  ILE  31          1HG2      ILE  31   2.836  -4.203   2.069
  229   HG22  ILE  31          2HG2      ILE  31   1.448  -3.118   2.016
  230   HG23  ILE  31          3HG2      ILE  31   2.718  -2.987   0.799
  231   HD11  ILE  31          3HD1      ILE  31   1.905  -7.704  -0.250
  232   HD12  ILE  31          1HD1      ILE  31   1.948  -7.054   1.386
  233   HD13  ILE  31          2HD1      ILE  31   3.451  -7.378   0.526
  234    H    TYR  32           H        TYR  32  -0.378  -5.116   3.764
  235    HA   TYR  32           HA       TYR  32  -2.501  -3.165   3.150
  236    HD1  TYR  32           2HD      TYR  32  -2.172  -6.674   3.357
  237    HD2  TYR  32           1HD      TYR  32  -5.479  -4.338   4.652
  238    HE1  TYR  32           2HE      TYR  32  -3.694  -8.193   2.178
  239    HE2  TYR  32           1HE      TYR  32  -7.020  -5.847   3.494
  240    HH   TYR  32           HH       TYR  32  -6.606  -8.659   2.715
  241    HB2  TYR  32           2HB      TYR  32  -2.153  -5.076   5.454
  242    HB3  TYR  32           1HB      TYR  32  -3.375  -3.813   5.431
  243    H    VAL  33           H        VAL  33  -2.722  -1.279   4.331
  244    HA   VAL  33           HA       VAL  33  -0.315  -0.267   5.584
  245    HB   VAL  33           HB       VAL  33  -2.962   1.099   5.031
  246   HG11  VAL  33          1HG1      VAL  33  -0.553   2.726   5.496
  247   HG12  VAL  33          2HG1      VAL  33  -1.186   1.894   6.915
  248   HG13  VAL  33          3HG1      VAL  33  -2.220   2.991   6.003
  249   HG21  VAL  33          3HG2      VAL  33  -1.283   2.351   3.410
  250   HG22  VAL  33          1HG2      VAL  33  -2.098   0.862   2.931
  251   HG23  VAL  33          2HG2      VAL  33  -0.431   0.811   3.501
  252    H    THR  34           H        THR  34   0.017  -0.263   7.731
  253    HA   THR  34           HA       THR  34  -2.209  -1.032   9.469
  254    HB   THR  34           HB       THR  34  -0.177  -2.415   9.501
  255    HG1  THR  34           1HG      THR  34  -0.641  -2.768  11.501
  256   HG21  THR  34          3HG2      THR  34   1.684  -1.273  11.013
  257   HG22  THR  34          1HG2      THR  34   1.134   0.153  10.135
  258   HG23  THR  34          2HG2      THR  34   1.737  -1.248   9.250
  259    H    LYS  35           H        LYS  35  -0.085   1.708   8.935
  260    HA   LYS  35           HA       LYS  35  -1.621   3.252  10.840
  261    HB2  LYS  35           2HB      LYS  35   1.337   2.813  11.295
  262    HB3  LYS  35           1HB      LYS  35   0.380   4.041  12.105
  263    HG2  LYS  35           2HG      LYS  35  -1.031   2.236  13.058
  264    HG3  LYS  35           1HG      LYS  35   0.066   1.058  12.334
  265    HD2  LYS  35           2HD      LYS  35   1.532   1.294  13.995
  266    HD3  LYS  35           1HD      LYS  35   1.527   3.050  13.829
  267    HE2  LYS  35           2HE      LYS  35  -0.926   2.392  15.010
  268    HE3  LYS  35           1HE      LYS  35   0.276   1.393  15.824
  269    HZ1  LYS  35           3HZ      LYS  35   0.010   3.510  16.938
  270    HZ2  LYS  35           1HZ      LYS  35   0.392   4.346  15.517
  271    HZ3  LYS  35           2HZ      LYS  35   1.565   3.395  16.280
  272    H    ILE  36           H        ILE  36  -2.014   5.134   9.862
  273    HA   ILE  36           HA       ILE  36  -0.085   6.124   7.891
  274    HB   ILE  36           HB       ILE  36  -2.929   7.023   8.378
  275   HG12  ILE  36          2HG1      ILE  36  -1.682   5.137   6.380
  276   HG13  ILE  36          1HG1      ILE  36  -3.037   4.837   7.461
  277   HG21  ILE  36          1HG2      ILE  36  -2.710   8.310   6.353
  278   HG22  ILE  36          2HG2      ILE  36  -1.069   7.710   6.104
  279   HG23  ILE  36          3HG2      ILE  36  -1.423   8.771   7.467
  280   HD11  ILE  36          3HD1      ILE  36  -4.078   5.080   5.430
  281   HD12  ILE  36          1HD1      ILE  36  -2.962   6.334   4.887
  282   HD13  ILE  36          2HD1      ILE  36  -4.198   6.712   6.090
  283    H    ILE  37           H        ILE  37   1.267   7.720   8.432
  284    HA   ILE  37           HA       ILE  37   1.067   9.084  10.942
  285    HB   ILE  37           HB       ILE  37   2.999   9.209   8.640
  286   HG12  ILE  37          2HG1      ILE  37   4.525   8.708  10.735
  287   HG13  ILE  37          1HG1      ILE  37   3.002   8.198  11.454
  288   HG21  ILE  37          1HG2      ILE  37   2.860  11.096  10.974
  289   HG22  ILE  37          2HG2      ILE  37   2.958  11.478   9.255
  290   HG23  ILE  37          3HG2      ILE  37   4.353  10.790  10.084
  291   HD11  ILE  37          3HD1      ILE  37   4.416   6.413  10.352
  292   HD12  ILE  37          1HD1      ILE  37   3.953   7.142   8.814
  293   HD13  ILE  37          2HD1      ILE  37   2.717   6.480   9.885
  294    H    GLU  38           H        GLU  38   0.744  11.300  11.314
  295    HA   GLU  38           HA       GLU  38  -1.230  12.556   9.753
  296    HB2  GLU  38           2HB      GLU  38   0.508  13.431  12.029
  297    HB3  GLU  38           1HB      GLU  38  -0.440  14.631  11.163
  298    HG2  GLU  38           2HG      GLU  38  -2.475  13.319  11.639
  299    HG3  GLU  38           1HG      GLU  38  -1.497  12.199  12.587
  300    H    GLY  39           H        GLY  39  -1.178  14.286   8.340
  301    HA2  GLY  39           2HA      GLY  39  -0.362  15.648   6.691
  302    HA3  GLY  39           1HA      GLY  39   1.087  15.802   7.665
  303    H    GLY  40           H        GLY  40   0.232  12.591   6.707
  304    HA2  GLY  40           2HA      GLY  40   2.588  12.502   4.991
  305    HA3  GLY  40           1HA      GLY  40   1.685  11.121   5.594
  306    H    ALA  41           H        ALA  41   2.493  11.166   2.995
  307    HA   ALA  41           HA       ALA  41   0.970  12.265   1.022
  308    HB1  ALA  41           3HB      ALA  41   2.951  10.708   0.793
  309    HB2  ALA  41           1HB      ALA  41   1.669  10.518  -0.400
  310    HB3  ALA  41           2HB      ALA  41   1.802   9.378   0.939
  311    H    ALA  42           H        ALA  42   0.231   9.142   2.611
  312    HA   ALA  42           HA       ALA  42  -2.255   8.788   1.299
  313    HB1  ALA  42           3HB      ALA  42  -1.227   6.848   2.146
  314    HB2  ALA  42           1HB      ALA  42  -2.652   7.102   3.155
  315    HB3  ALA  42           2HB      ALA  42  -1.055   7.544   3.758
  316    H    HIS  43           H        HIS  43  -1.458   9.893   4.593
  317    HA   HIS  43           HA       HIS  43  -4.007  10.293   5.580
  318    HD1  HIS  43           1HD      HIS  43  -2.868  14.078   6.840
  319    HD2  HIS  43           2HD      HIS  43  -3.958  10.619   8.869
  320    HE1  HIS  43           1HE      HIS  43  -4.234  14.854   8.800
  321    HE2  HIS  43           2HE      HIS  43  -4.959  12.739   9.964
  322    HB2  HIS  43           2HB      HIS  43  -1.944  10.469   6.919
  323    HB3  HIS  43           1HB      HIS  43  -1.559  11.985   6.117
  324    H    LYS  44           H        LYS  44  -1.972  12.669   3.866
  325    HA   LYS  44           HA       LYS  44  -3.889  14.746   3.883
  326    HB2  LYS  44           2HB      LYS  44  -1.447  14.241   2.189
  327    HB3  LYS  44           1HB      LYS  44  -2.445  15.676   1.997
  328    HG2  LYS  44           2HG      LYS  44  -2.044  16.162   4.425
  329    HG3  LYS  44           1HG      LYS  44  -0.865  14.850   4.418
  330    HD2  LYS  44           2HD      LYS  44   0.490  15.980   2.806
  331    HD3  LYS  44           1HD      LYS  44  -0.755  17.204   2.539
  332    HE2  LYS  44           2HE      LYS  44  -0.405  17.492   5.183
  333    HE3  LYS  44           1HE      LYS  44   1.203  16.925   4.739
  334    HZ1  LYS  44           3HZ      LYS  44   1.302  18.718   3.085
  335    HZ2  LYS  44           1HZ      LYS  44   1.127  19.312   4.660
  336    HZ3  LYS  44           2HZ      LYS  44  -0.201  19.287   3.612
  337    H    ASP  45           H        ASP  45  -3.141  12.207   1.526
  338    HA   ASP  45           HA       ASP  45  -4.779  13.133  -0.566
  339    HB2  ASP  45           2HB      ASP  45  -2.998  11.279  -0.610
  340    HB3  ASP  45           1HB      ASP  45  -4.264  10.215  -0.004
  341    H    GLY  46           H        GLY  46  -5.446  10.780   2.025
  342    HA2  GLY  46           2HA      GLY  46  -7.502  10.553   3.156
  343    HA3  GLY  46           1HA      GLY  46  -8.284  11.465   1.876
  344    H    LYS  47           H        LYS  47  -6.986   9.713  -0.200
  345    HA   LYS  47           HA       LYS  47  -9.086   7.875  -0.526
  346    HB2  LYS  47           2HB      LYS  47  -7.306   8.879  -2.217
  347    HB3  LYS  47           1HB      LYS  47  -6.459   7.383  -1.853
  348    HG2  LYS  47           2HG      LYS  47  -7.653   6.593  -3.578
  349    HG3  LYS  47           1HG      LYS  47  -8.926   6.424  -2.368
  350    HD2  LYS  47           2HD      LYS  47  -8.996   9.094  -3.324
  351    HD3  LYS  47           1HD      LYS  47  -8.903   8.026  -4.725
  352    HE2  LYS  47           2HE      LYS  47 -11.206   8.329  -4.254
  353    HE3  LYS  47           1HE      LYS  47 -10.788   6.705  -3.710
  354    HZ1  LYS  47           3HZ      LYS  47 -12.191   8.162  -2.177
  355    HZ2  LYS  47           1HZ      LYS  47 -10.756   8.992  -1.840
  356    HZ3  LYS  47           2HZ      LYS  47 -10.881   7.342  -1.491
  357    H    LEU  48           H        LEU  48  -5.735   7.403   0.572
  358    HA   LEU  48           HA       LEU  48  -6.182   4.589   1.055
  359    HG   LEU  48           HG       LEU  48  -4.272   3.313   0.960
  360    HB2  LEU  48           2HB      LEU  48  -3.968   5.826   0.366
  361    HB3  LEU  48           1HB      LEU  48  -3.792   6.050   2.097
  362   HD11  LEU  48          1HD1      LEU  48  -1.488   4.131   1.516
  363   HD12  LEU  48          2HD1      LEU  48  -2.205   4.732   0.021
  364   HD13  LEU  48          3HD1      LEU  48  -2.127   2.997   0.325
  365   HD21  LEU  48          3HD2      LEU  48  -2.572   3.951   3.319
  366   HD22  LEU  48          1HD2      LEU  48  -3.571   2.535   2.990
  367   HD23  LEU  48          2HD2      LEU  48  -4.325   4.051   3.478
  368    H    GLN  49           H        GLN  49  -6.995   3.748   2.818
  369    HA   GLN  49           HA       GLN  49  -6.736   5.155   5.381
  370    HB2  GLN  49           2HB      GLN  49  -9.008   4.576   5.973
  371    HB3  GLN  49           1HB      GLN  49  -9.018   5.481   4.470
  372    HG2  GLN  49           2HG      GLN  49  -9.047   2.492   4.433
  373    HG3  GLN  49           1HG      GLN  49 -10.528   3.400   4.725
  374   HE21  GLN  49          1HE2      GLN  49  -8.500   2.109   2.398
  375   HE22  GLN  49          2HE2      GLN  49  -9.148   2.911   1.012
  376    H    ILE  50           H        ILE  50  -6.462   3.826   7.193
  377    HA   ILE  50           HA       ILE  50  -5.023   1.507   6.948
  378    HB   ILE  50           HB       ILE  50  -6.859   2.202   9.248
  379   HG12  ILE  50          2HG1      ILE  50  -4.072   2.645   9.768
  380   HG13  ILE  50          1HG1      ILE  50  -4.514   3.482   8.284
  381   HG21  ILE  50          1HG2      ILE  50  -6.273  -0.074   9.491
  382   HG22  ILE  50          2HG2      ILE  50  -5.192   0.822  10.557
  383   HG23  ILE  50          3HG2      ILE  50  -4.605   0.227   9.005
  384   HD11  ILE  50          3HD1      ILE  50  -4.715   4.810  10.404
  385   HD12  ILE  50          1HD1      ILE  50  -6.064   3.761  10.841
  386   HD13  ILE  50          2HD1      ILE  50  -6.160   4.763   9.392
  387    H    GLY  51           H        GLY  51  -5.454  -0.492   6.262
  388    HA2  GLY  51           2HA      GLY  51  -6.854  -2.493   6.683
  389    HA3  GLY  51           1HA      GLY  51  -8.245  -1.463   6.417
  390    H    ASP  52           H        ASP  52  -6.691  -0.116   4.117
  391    HA   ASP  52           HA       ASP  52  -7.750  -1.750   2.080
  392    HB2  ASP  52           2HB      ASP  52  -6.418  -0.169   0.553
  393    HB3  ASP  52           1HB      ASP  52  -7.687   0.528   1.545
  394    H    LYS  53           H        LYS  53  -6.612  -2.779   0.337
  395    HA   LYS  53           HA       LYS  53  -4.002  -3.841   1.192
  396    HB2  LYS  53           2HB      LYS  53  -4.545  -5.814  -0.237
  397    HB3  LYS  53           1HB      LYS  53  -5.616  -5.604   1.137
  398    HG2  LYS  53           2HG      LYS  53  -6.688  -4.242  -1.141
  399    HG3  LYS  53           1HG      LYS  53  -6.316  -5.917  -1.550
  400    HD2  LYS  53           2HD      LYS  53  -7.512  -5.951   1.003
  401    HD3  LYS  53           1HD      LYS  53  -8.485  -4.871   0.003
  402    HE2  LYS  53           2HE      LYS  53  -9.427  -6.636  -0.960
  403    HE3  LYS  53           1HE      LYS  53  -7.853  -7.123  -1.582
  404    HZ1  LYS  53           3HZ      LYS  53  -8.780  -7.825   1.144
  405    HZ2  LYS  53           1HZ      LYS  53  -7.477  -8.482   0.287
  406    HZ3  LYS  53           2HZ      LYS  53  -9.062  -8.813  -0.199
  407    H    LEU  54           H        LEU  54  -2.410  -4.102  -0.279
  408    HA   LEU  54           HA       LEU  54  -2.597  -2.311  -2.590
  409    HG   LEU  54           HG       LEU  54  -1.315  -0.631  -1.694
  410    HB2  LEU  54           2HB      LEU  54  -0.546  -2.889  -0.696
  411    HB3  LEU  54           1HB      LEU  54   0.060  -3.228  -2.307
  412   HD11  LEU  54          1HD1      LEU  54   0.415   0.235  -0.595
  413   HD12  LEU  54          2HD1      LEU  54   1.591  -0.519  -1.672
  414   HD13  LEU  54          3HD1      LEU  54   0.923  -1.431  -0.318
  415   HD21  LEU  54          3HD2      LEU  54   0.199  -1.805  -3.913
  416   HD22  LEU  54          1HD2      LEU  54   0.661  -0.156  -3.496
  417   HD23  LEU  54          2HD2      LEU  54  -1.011  -0.524  -3.912
  418    H    LEU  55           H        LEU  55  -3.053  -3.100  -4.461
  419    HA   LEU  55           HA       LEU  55  -2.786  -5.874  -5.114
  420    HG   LEU  55           HG       LEU  55  -2.970  -5.967  -7.862
  421    HB2  LEU  55           2HB      LEU  55  -4.651  -4.447  -5.929
  422    HB3  LEU  55           1HB      LEU  55  -3.501  -3.541  -6.895
  423   HD11  LEU  55          1HD1      LEU  55  -4.604  -7.521  -7.717
  424   HD12  LEU  55          2HD1      LEU  55  -5.891  -6.321  -7.600
  425   HD13  LEU  55          3HD1      LEU  55  -4.914  -6.707  -6.183
  426   HD21  LEU  55          3HD2      LEU  55  -5.335  -5.159  -9.207
  427   HD22  LEU  55          1HD2      LEU  55  -3.656  -4.896  -9.677
  428   HD23  LEU  55          2HD2      LEU  55  -4.487  -3.709  -8.672
  429    H    ALA  56           H        ALA  56  -1.307  -2.842  -6.370
  430    HA   ALA  56           HA       ALA  56   1.163  -4.320  -6.846
  431    HB1  ALA  56           3HB      ALA  56  -0.456  -3.169  -9.126
  432    HB2  ALA  56           1HB      ALA  56   0.056  -4.842  -8.907
  433    HB3  ALA  56           2HB      ALA  56   1.249  -3.591  -9.267
  434    H    VAL  57           H        VAL  57   2.960  -2.911  -7.544
  435    HA   VAL  57           HA       VAL  57   2.523  -0.033  -7.214
  436    HB   VAL  57           HB       VAL  57   4.499  -1.581  -5.530
  437   HG11  VAL  57          1HG1      VAL  57   4.144   1.356  -6.018
  438   HG12  VAL  57          2HG1      VAL  57   5.623   0.397  -6.039
  439   HG13  VAL  57          3HG1      VAL  57   4.829   0.758  -4.506
  440   HG21  VAL  57          3HG2      VAL  57   2.044   0.008  -4.799
  441   HG22  VAL  57          1HG2      VAL  57   3.209  -0.636  -3.641
  442   HG23  VAL  57          2HG2      VAL  57   2.263  -1.735  -4.644
  443    H    ASN  58           H        ASN  58   3.310   0.748  -9.057
  444    HA   ASN  58           HA       ASN  58   4.749   1.292 -10.729
  445    HB2  ASN  58           2HB      ASN  58   6.378   0.900  -8.454
  446    HB3  ASN  58           1HB      ASN  58   7.209   0.117  -9.793
  447   HD21  ASN  58          1HD2      ASN  58   6.634   3.012  -8.219
  448   HD22  ASN  58          2HD2      ASN  58   7.255   4.087  -9.420
  449    H    ASN  59           H        ASN  59   3.284  -0.844 -11.262
  450    HA   ASN  59           HA       ASN  59   3.098  -2.451 -12.866
  451    HB2  ASN  59           2HB      ASN  59   6.101  -2.224 -13.132
  452    HB3  ASN  59           1HB      ASN  59   5.060  -3.173 -14.185
  453   HD21  ASN  59          1HD2      ASN  59   4.015  -2.196 -15.826
  454   HD22  ASN  59          2HD2      ASN  59   4.100  -0.504 -16.166
  455    H    VAL  60           H        VAL  60   4.921  -2.878 -10.000
  456    HA   VAL  60           HA       VAL  60   5.072  -5.780 -10.388
  457    HB   VAL  60           HB       VAL  60   6.425  -5.911  -8.435
  458   HG11  VAL  60          1HG1      VAL  60   7.111  -3.866 -10.449
  459   HG12  VAL  60          2HG1      VAL  60   7.954  -5.348 -10.000
  460   HG13  VAL  60          3HG1      VAL  60   8.111  -3.906  -8.997
  461   HG21  VAL  60          3HG2      VAL  60   5.074  -3.536  -7.643
  462   HG22  VAL  60          1HG2      VAL  60   6.811  -3.244  -7.594
  463   HG23  VAL  60          2HG2      VAL  60   6.116  -4.588  -6.689
  464    H    CYS  61           H        CYS  61   3.919  -7.250  -9.108
  465    HA   CYS  61           HA       CYS  61   1.514  -6.175  -7.934
  466    HG   CYS  61           HG       CYS  61   3.098 -10.008  -8.812
  467    HB2  CYS  61           2HB      CYS  61   0.831  -8.471  -7.602
  468    HB3  CYS  61           1HB      CYS  61   1.441  -8.259  -9.237
  469    H    LEU  62           H        LEU  62   0.999  -6.013  -5.820
  470    HA   LEU  62           HA       LEU  62   3.163  -6.507  -3.914
  471    HG   LEU  62           HG       LEU  62   3.503  -4.818  -2.225
  472    HB2  LEU  62           2HB      LEU  62   1.456  -4.300  -4.381
  473    HB3  LEU  62           1HB      LEU  62   1.044  -4.942  -2.807
  474   HD11  LEU  62          1HD1      LEU  62   4.377  -2.815  -3.906
  475   HD12  LEU  62          2HD1      LEU  62   3.597  -3.961  -4.995
  476   HD13  LEU  62          3HD1      LEU  62   4.895  -4.500  -3.931
  477   HD21  LEU  62          3HD2      LEU  62   1.944  -2.325  -2.860
  478   HD22  LEU  62          1HD2      LEU  62   3.461  -2.317  -1.959
  479   HD23  LEU  62          2HD2      LEU  62   2.058  -3.171  -1.318
  480    H    GLU  63           H        GLU  63   1.314  -8.594  -4.872
  481    HA   GLU  63           HA       GLU  63   0.027  -9.269  -2.307
  482    HB2  GLU  63           2HB      GLU  63  -1.196  -8.953  -4.783
  483    HB3  GLU  63           1HB      GLU  63  -1.061 -10.696  -4.591
  484    HG2  GLU  63           2HG      GLU  63  -2.006  -9.345  -2.194
  485    HG3  GLU  63           1HG      GLU  63  -3.057  -9.112  -3.588
  486    H    GLU  64           H        GLU  64   2.266 -10.325  -4.732
  487    HA   GLU  64           HA       GLU  64   2.364 -12.983  -3.468
  488    HB2  GLU  64           2HB      GLU  64   2.163 -12.250  -6.204
  489    HB3  GLU  64           1HB      GLU  64   3.726 -13.010  -5.959
  490    HG2  GLU  64           2HG      GLU  64   2.672 -14.971  -5.028
  491    HG3  GLU  64           1HG      GLU  64   1.089 -14.203  -5.141
  492    H    VAL  65           H        VAL  65   3.697 -10.883  -2.254
  493    HA   VAL  65           HA       VAL  65   6.477 -11.765  -2.577
  494    HB   VAL  65           HB       VAL  65   7.291  -9.418  -2.318
  495   HG11  VAL  65          1HG1      VAL  65   7.102  -8.866  -4.663
  496   HG12  VAL  65          2HG1      VAL  65   5.706  -9.931  -4.833
  497   HG13  VAL  65          3HG1      VAL  65   7.296 -10.609  -4.478
  498   HG21  VAL  65          3HG2      VAL  65   4.397  -8.784  -2.862
  499   HG22  VAL  65          1HG2      VAL  65   5.706  -7.621  -3.073
  500   HG23  VAL  65          2HG2      VAL  65   5.374  -8.293  -1.477
  501    H    THR  66           H        THR  66   7.885 -11.205  -0.828
  502    HA   THR  66           HA       THR  66   6.676 -11.581   1.733
  503    HB   THR  66           HB       THR  66   9.133 -11.123   2.495
  504    HG1  THR  66           1HG      THR  66   9.691 -10.145   0.440
  505   HG21  THR  66          3HG2      THR  66   8.405 -13.442   0.733
  506   HG22  THR  66          1HG2      THR  66   8.342 -13.358   2.493
  507   HG23  THR  66          2HG2      THR  66   9.899 -13.342   1.666
  508    H    HIS  67           H        HIS  67   7.961  -9.988   3.533
  509    HA   HIS  67           HA       HIS  67   6.524  -7.552   3.206
  510    HD1  HIS  67           1HD      HIS  67   5.179  -6.718   5.930
  511    HD2  HIS  67           2HD      HIS  67   9.069  -5.335   5.554
  512    HE1  HIS  67           1HE      HIS  67   5.109  -4.326   6.641
  513    HE2  HIS  67           2HE      HIS  67   7.435  -3.474   6.261
  514    HB2  HIS  67           2HB      HIS  67   6.827  -8.564   5.418
  515    HB3  HIS  67           1HB      HIS  67   8.532  -8.178   5.386
  516    H    GLU  68           H        GLU  68   9.984  -8.332   3.005
  517    HA   GLU  68           HA       GLU  68  10.993  -5.765   2.799
  518    HB2  GLU  68           2HB      GLU  68  12.805  -6.803   1.358
  519    HB3  GLU  68           1HB      GLU  68  12.560  -7.531   2.939
  520    HG2  GLU  68           2HG      GLU  68  10.953  -8.804   0.891
  521    HG3  GLU  68           1HG      GLU  68  12.672  -8.841   0.512
  522    H    GLU  69           H        GLU  69   9.528  -7.769   0.282
  523    HA   GLU  69           HA       GLU  69  10.017  -5.982  -1.877
  524    HB2  GLU  69           2HB      GLU  69   8.251  -8.345  -1.433
  525    HB3  GLU  69           1HB      GLU  69   7.924  -7.309  -2.814
  526    HG2  GLU  69           2HG      GLU  69   9.386  -8.573  -3.907
  527    HG3  GLU  69           1HG      GLU  69  10.627  -7.708  -3.003
  528    H    ALA  70           H        ALA  70   7.375  -6.366   0.423
  529    HA   ALA  70           HA       ALA  70   5.470  -4.634  -0.730
  530    HB1  ALA  70           3HB      ALA  70   5.021  -6.212   1.122
  531    HB2  ALA  70           1HB      ALA  70   4.477  -4.574   1.480
  532    HB3  ALA  70           2HB      ALA  70   5.964  -5.187   2.199
  533    H    VAL  71           H        VAL  71   7.982  -4.082   1.690
  534    HA   VAL  71           HA       VAL  71   7.496  -1.285   1.985
  535    HB   VAL  71           HB       VAL  71   9.700  -3.112   2.902
  536   HG11  VAL  71          1HG1      VAL  71  10.512  -1.049   4.212
  537   HG12  VAL  71          2HG1      VAL  71   9.684  -0.114   2.968
  538   HG13  VAL  71          3HG1      VAL  71  10.992  -1.209   2.523
  539   HG21  VAL  71          3HG2      VAL  71   8.849  -2.703   5.064
  540   HG22  VAL  71          1HG2      VAL  71   7.446  -2.979   4.033
  541   HG23  VAL  71          2HG2      VAL  71   7.883  -1.338   4.508
  542    H    THR  72           H        THR  72   9.861  -3.198   0.163
  543    HA   THR  72           HA       THR  72  11.446  -1.060  -0.733
  544    HB   THR  72           HB       THR  72  10.968  -3.830  -1.819
  545    HG1  THR  72           1HG      THR  72  12.234  -4.040  -0.118
  546   HG21  THR  72          3HG2      THR  72  13.075  -3.473  -3.136
  547   HG22  THR  72          1HG2      THR  72  12.858  -1.743  -2.870
  548   HG23  THR  72          2HG2      THR  72  11.642  -2.657  -3.763
  549    H    ALA  73           H        ALA  73   8.413  -2.382  -1.932
  550    HA   ALA  73           HA       ALA  73   8.516  -1.117  -4.467
  551    HB1  ALA  73           3HB      ALA  73   6.223  -1.842  -4.706
  552    HB2  ALA  73           1HB      ALA  73   6.130  -2.204  -2.983
  553    HB3  ALA  73           2HB      ALA  73   7.199  -3.143  -4.025
  554    H    LEU  74           H        LEU  74   6.944  -0.287  -1.348
  555    HA   LEU  74           HA       LEU  74   5.705   2.046  -2.493
  556    HG   LEU  74           HG       LEU  74   5.335  -0.410  -0.592
  557    HB2  LEU  74           2HB      LEU  74   6.074   2.225   0.381
  558    HB3  LEU  74           1HB      LEU  74   4.604   2.274  -0.567
  559   HD11  LEU  74          1HD1      LEU  74   5.816  -1.024   1.631
  560   HD12  LEU  74          2HD1      LEU  74   5.554   0.616   2.217
  561   HD13  LEU  74          3HD1      LEU  74   6.962   0.252   1.220
  562   HD21  LEU  74          3HD2      LEU  74   3.083   0.176  -0.456
  563   HD22  LEU  74          1HD2      LEU  74   3.342   1.176   0.975
  564   HD23  LEU  74          2HD2      LEU  74   3.455  -0.580   1.095
  565    H    LYS  75           H        LYS  75   8.809   1.326  -1.056
  566    HA   LYS  75           HA       LYS  75   9.440   4.132  -0.667
  567    HB2  LYS  75           2HB      LYS  75  11.521   3.407   0.228
  568    HB3  LYS  75           1HB      LYS  75  10.288   2.317   0.840
  569    HG2  LYS  75           2HG      LYS  75  11.222   0.537  -0.124
  570    HG3  LYS  75           1HG      LYS  75  11.530   1.392  -1.634
  571    HD2  LYS  75           2HD      LYS  75  13.679   1.590  -1.102
  572    HD3  LYS  75           1HD      LYS  75  13.249   2.456   0.373
  573    HE2  LYS  75           2HE      LYS  75  14.280   0.706   1.361
  574    HE3  LYS  75           1HE      LYS  75  12.705  -0.057   1.150
  575    HZ1  LYS  75           3HZ      LYS  75  14.307  -1.569   0.351
  576    HZ2  LYS  75           1HZ      LYS  75  15.118  -0.382  -0.542
  577    HZ3  LYS  75           2HZ      LYS  75  13.585  -0.906  -1.027
  578    H    ASN  76           H        ASN  76   9.852   1.756  -3.170
  579    HA   ASN  76           HA       ASN  76  12.028   3.006  -4.517
  580    HB2  ASN  76           2HB      ASN  76  11.348   0.609  -4.809
  581    HB3  ASN  76           1HB      ASN  76   9.939   1.166  -5.704
  582   HD21  ASN  76          1HD2      ASN  76  10.140   1.380  -7.829
  583   HD22  ASN  76          2HD2      ASN  76  11.632   1.439  -8.698
  584    H    THR  77           H        THR  77  11.057   5.223  -4.267
  585    HA   THR  77           HA       THR  77   9.527   5.884  -6.690
  586    HB   THR  77           HB       THR  77   8.223   7.535  -5.466
  587    HG1  THR  77           1HG      THR  77   9.561   6.596  -3.145
  588   HG21  THR  77          3HG2      THR  77   8.139   4.847  -4.122
  589   HG22  THR  77          1HG2      THR  77   7.208   5.361  -5.528
  590   HG23  THR  77          2HG2      THR  77   6.912   6.102  -3.955
  591    H    SER  78           H        SER  78   9.722   8.139  -7.355
  592    HA   SER  78           HA       SER  78  12.207   9.431  -6.448
  593    HG   SER  78           HG       SER  78  13.467  10.544  -8.925
  594    HB2  SER  78           2HB      SER  78  12.121   8.125  -8.817
  595    HB3  SER  78           1HB      SER  78  11.554   9.712  -9.328
  596    H    ASP  79           H        ASP  79   9.789  10.238  -8.944
  597    HA   ASP  79           HA       ASP  79   9.383  12.819  -7.604
  598    HB2  ASP  79           2HB      ASP  79   9.065  11.894 -10.444
  599    HB3  ASP  79           1HB      ASP  79   8.221  13.332  -9.880
  600    H    PHE  80           H        PHE  80   7.628  10.091  -9.037
  601    HA   PHE  80           HA       PHE  80   5.314  10.807  -7.378
  602    HD1  PHE  80           1HD      PHE  80   4.903  13.127  -9.383
  603    HD2  PHE  80           2HD      PHE  80   2.218   9.866  -8.858
  604    HE1  PHE  80           1HE      PHE  80   3.084  14.709  -8.908
  605    HE2  PHE  80           2HE      PHE  80   0.393  11.446  -8.384
  606    HZ   PHE  80           HZ       PHE  80   0.830  13.868  -8.400
  607    HB2  PHE  80           2HB      PHE  80   5.396  10.826 -10.229
  608    HB3  PHE  80           1HB      PHE  80   4.366   9.488  -9.720
  609    H    VAL  81           H        VAL  81   3.713   8.854  -7.281
  610    HA   VAL  81           HA       VAL  81   5.088   6.296  -7.434
  611    HB   VAL  81           HB       VAL  81   5.573   6.907  -5.166
  612   HG11  VAL  81          1HG1      VAL  81   3.436   7.222  -3.637
  613   HG12  VAL  81          2HG1      VAL  81   2.766   7.864  -5.136
  614   HG13  VAL  81          3HG1      VAL  81   4.218   8.582  -4.442
  615   HG21  VAL  81          3HG2      VAL  81   4.766   4.578  -5.658
  616   HG22  VAL  81          1HG2      VAL  81   3.195   5.066  -5.022
  617   HG23  VAL  81          2HG2      VAL  81   4.615   5.088  -3.977
  618    H    TYR  82           H        TYR  82   3.769   4.953  -8.479
  619    HA   TYR  82           HA       TYR  82   0.901   5.549  -8.516
  620    HD1  TYR  82           1HD      TYR  82   0.226   2.169 -10.226
  621    HD2  TYR  82           2HD      TYR  82   0.226   6.240 -11.463
  622    HE1  TYR  82           1HE      TYR  82  -1.968   1.846 -11.268
  623    HE2  TYR  82           2HE      TYR  82  -1.975   5.926 -12.509
  624    HH   TYR  82           HH       TYR  82  -3.227   3.392 -13.444
  625    HB2  TYR  82           2HB      TYR  82   2.250   5.197 -10.654
  626    HB3  TYR  82           1HB      TYR  82   2.277   3.489 -10.225
  627    H    LEU  83           H        LEU  83   0.016   4.728  -6.749
  628    HA   LEU  83           HA       LEU  83   0.634   2.031  -5.870
  629    HG   LEU  83           HG       LEU  83  -0.347   1.504  -3.578
  630    HB2  LEU  83           2HB      LEU  83   0.107   4.321  -4.522
  631    HB3  LEU  83           1HB      LEU  83  -1.479   3.576  -4.517
  632   HD11  LEU  83          1HD1      LEU  83   1.763   2.066  -2.294
  633   HD12  LEU  83          2HD1      LEU  83   1.888   3.497  -3.316
  634   HD13  LEU  83          3HD1      LEU  83   1.935   1.889  -4.040
  635   HD21  LEU  83          3HD2      LEU  83  -0.865   4.081  -2.233
  636   HD22  LEU  83          1HD2      LEU  83  -0.017   2.851  -1.294
  637   HD23  LEU  83          2HD2      LEU  83  -1.603   2.499  -1.980
  638    H    LYS  84           H        LYS  84  -0.525   0.313  -6.404
  639    HA   LYS  84           HA       LYS  84  -3.217   0.684  -7.514
  640    HB2  LYS  84           2HB      LYS  84  -1.049  -1.275  -8.067
  641    HB3  LYS  84           1HB      LYS  84  -2.709  -1.825  -8.221
  642    HG2  LYS  84           2HG      LYS  84  -2.031   0.721  -9.556
  643    HG3  LYS  84           1HG      LYS  84  -1.329  -0.749 -10.234
  644    HD2  LYS  84           2HD      LYS  84  -3.396  -0.374 -11.356
  645    HD3  LYS  84           1HD      LYS  84  -3.641  -1.729 -10.253
  646    HE2  LYS  84           2HE      LYS  84  -5.544  -0.296 -10.087
  647    HE3  LYS  84           1HE      LYS  84  -4.605  -0.120  -8.607
  648    HZ1  LYS  84           3HZ      LYS  84  -4.327   1.744 -10.894
  649    HZ2  LYS  84           1HZ      LYS  84  -3.797   1.960  -9.300
  650    HZ3  LYS  84           2HZ      LYS  84  -5.451   1.991  -9.654
  651    H    VAL  85           H        VAL  85  -4.825   0.253  -6.135
  652    HA   VAL  85           HA       VAL  85  -4.393  -1.915  -4.190
  653    HB   VAL  85           HB       VAL  85  -5.806  -0.701  -2.576
  654   HG11  VAL  85          1HG1      VAL  85  -3.294  -0.529  -2.632
  655   HG12  VAL  85          2HG1      VAL  85  -4.129   0.786  -1.807
  656   HG13  VAL  85          3HG1      VAL  85  -3.497   1.028  -3.435
  657   HG21  VAL  85          3HG2      VAL  85  -5.686   1.519  -4.615
  658   HG22  VAL  85          1HG2      VAL  85  -6.213   1.726  -2.943
  659   HG23  VAL  85          2HG2      VAL  85  -7.125   0.681  -4.033
  660    H    ALA  86           H        ALA  86  -5.873  -3.464  -4.101
  661    HA   ALA  86           HA       ALA  86  -8.279  -3.199  -5.759
  662    HB1  ALA  86           3HB      ALA  86  -8.407  -5.675  -5.547
  663    HB2  ALA  86           1HB      ALA  86  -6.905  -5.630  -4.621
  664    HB3  ALA  86           2HB      ALA  86  -6.921  -5.102  -6.303
  665    H    LYS  87           H        LYS  87 -10.340  -3.962  -4.964
  666    HA   LYS  87           HA       LYS  87 -10.641  -3.473  -2.089
  667    HB2  LYS  87           2HB      LYS  87 -12.051  -2.511  -4.271
  668    HB3  LYS  87           1HB      LYS  87 -13.111  -3.757  -3.623
  669    HG2  LYS  87           2HG      LYS  87 -13.621  -2.556  -1.802
  670    HG3  LYS  87           1HG      LYS  87 -11.971  -1.966  -1.603
  671    HD2  LYS  87           2HD      LYS  87 -12.555  -0.007  -2.475
  672    HD3  LYS  87           1HD      LYS  87 -13.053  -0.806  -3.966
  673    HE2  LYS  87           2HE      LYS  87 -15.269  -1.177  -3.074
  674    HE3  LYS  87           1HE      LYS  87 -14.784  -0.513  -1.514
  675    HZ1  LYS  87           3HZ      LYS  87 -14.450   1.629  -2.549
  676    HZ2  LYS  87           1HZ      LYS  87 -16.023   1.087  -2.854
  677    HZ3  LYS  87           2HZ      LYS  87 -14.850   1.002  -4.068
  678    HA   PRO  88           HA       PRO  88 -11.393  -7.793  -1.378
  679    HB2  PRO  88           2HB      PRO  88 -12.505  -7.612   1.089
  680    HB3  PRO  88           1HB      PRO  88 -10.777  -7.390   0.799
  681    HG2  PRO  88           2HG      PRO  88 -12.916  -5.331   1.169
  682    HG3  PRO  88           1HG      PRO  88 -11.272  -5.370   1.832
  683    HD2  PRO  88           2HD      PRO  88 -11.954  -3.873  -0.326
  684    HD3  PRO  88           1HD      PRO  88 -10.335  -4.565  -0.108
  685    H    THR  89           H        THR  89 -12.998  -8.971  -2.273
  686    HA   THR  89           HA       THR  89 -15.771  -8.372  -1.561
  687    HB   THR  89           HB       THR  89 -16.337  -8.845  -4.052
  688    HG1  THR  89           1HG      THR  89 -14.456  -9.328  -4.982
  689   HG21  THR  89          3HG2      THR  89 -15.137  -6.253  -4.239
  690   HG22  THR  89          1HG2      THR  89 -15.914  -6.455  -2.669
  691   HG23  THR  89          2HG2      THR  89 -16.841  -6.700  -4.149
  692    H    GLY  90           H        GLY  90 -15.569 -10.266  -0.260
  693    HA2  GLY  90           2HA      GLY  90 -15.839 -12.743  -1.840
  694    HA3  GLY  90           1HA      GLY  90 -14.773 -12.702  -0.447
  695    H    SER  91           H        SER  91 -17.597 -10.804  -0.059
  696    HA   SER  91           HA       SER  91 -18.535 -12.393   2.088
  697    HG   SER  91           HG       SER  91 -18.885 -10.012   3.242
  698    HB2  SER  91           2HB      SER  91 -19.817 -10.091   0.601
  699    HB3  SER  91           1HB      SER  91 -20.498 -10.822   2.054
  700    H    HIS  92           H        HIS  92 -19.850 -11.814  -1.179
  701    HA   HIS  92           HA       HIS  92 -21.885 -13.848  -0.794
  702    HD1  HIS  92           1HD      HIS  92 -24.453 -13.811  -2.599
  703    HD2  HIS  92           2HD      HIS  92 -23.033 -10.155  -1.228
  704    HE1  HIS  92           1HE      HIS  92 -26.463 -12.612  -1.682
  705    HE2  HIS  92           2HE      HIS  92 -25.595 -10.367  -0.936
  706    HB2  HIS  92           2HB      HIS  92 -21.337 -11.721  -2.766
  707    HB3  HIS  92           1HB      HIS  92 -22.053 -13.186  -3.432
  708    HA   ARG 301           HA       ARG 301   2.996 -10.630  10.479
  709    HE   ARG 301           HE       ARG 301  -1.159 -12.753  12.292
  710    H1   ARG 301           1HT      ARG 301   3.234 -12.639  11.547
  711    H2   ARG 301           2HT      ARG 301   3.928 -11.925  12.945
  712    H3   ARG 301           3HT      ARG 301   4.813 -11.976  11.475
  713    HB2  ARG 301           2HB      ARG 301   2.381 -10.201  13.413
  714    HB3  ARG 301           1HB      ARG 301   1.624  -9.362  12.066
  715    HG2  ARG 301           2HG      ARG 301   0.975 -11.775  11.306
  716    HG3  ARG 301           1HG      ARG 301   1.253 -12.166  13.003
  717    HD2  ARG 301           2HD      ARG 301  -0.328 -10.364  13.629
  718    HD3  ARG 301           1HD      ARG 301  -0.660 -10.100  11.918
  719   HH11  ARG 301          1HH1      ARG 301  -2.334  -9.813  13.790
  720   HH12  ARG 301          2HH1      ARG 301  -3.875 -10.491  14.192
  721   HH21  ARG 301          1HH2      ARG 301  -3.189 -13.637  12.826
  722   HH22  ARG 301          2HH2      ARG 301  -4.361 -12.661  13.647
  723    H    ARG 302           H        ARG 302   4.074  -8.901   9.770
  724    HA   ARG 302           HA       ARG 302   5.716  -7.363  11.654
  725    HE   ARG 302           HE       ARG 302   9.117 -10.152  10.769
  726    HB2  ARG 302           2HB      ARG 302   6.976  -9.096  10.112
  727    HB3  ARG 302           1HB      ARG 302   6.771  -7.841   8.898
  728    HG2  ARG 302           2HG      ARG 302   8.154  -6.362   9.997
  729    HG3  ARG 302           1HG      ARG 302   7.922  -7.144  11.562
  730    HD2  ARG 302           2HD      ARG 302   9.363  -8.440   9.258
  731    HD3  ARG 302           1HD      ARG 302  10.180  -7.484  10.492
  732   HH11  ARG 302          1HH1      ARG 302  10.155  -7.273  12.474
  733   HH12  ARG 302          2HH1      ARG 302  10.464  -8.114  13.955
  734   HH21  ARG 302          1HH2      ARG 302   9.526 -11.252  12.723
  735   HH22  ARG 302          2HH2      ARG 302  10.107 -10.372  14.098
  736    H    GLU 303           H        GLU 303   5.252  -5.286  11.571
  737    HA   GLU 303           HA       GLU 303   4.163  -4.155   9.073
  738    HB2  GLU 303           2HB      GLU 303   3.342  -3.711  11.935
  739    HB3  GLU 303           1HB      GLU 303   3.004  -2.511  10.698
  740    HG2  GLU 303           2HG      GLU 303   1.059  -3.829  10.940
  741    HG3  GLU 303           1HG      GLU 303   1.808  -4.293   9.415
  742    H    THR 304           H        THR 304   5.725  -2.925   8.205
  743    HA   THR 304           HA       THR 304   7.332  -1.259  10.016
  744    HB   THR 304           HB       THR 304   8.078  -2.997   7.836
  745    HG1  THR 304           1HG      THR 304   9.530  -3.250   9.296
  746   HG21  THR 304          3HG2      THR 304   9.204  -0.215   7.674
  747   HG22  THR 304          1HG2      THR 304   8.169  -0.982   6.469
  748   HG23  THR 304          2HG2      THR 304   9.776  -1.630   6.791
  749    H    GLN 305           H        GLN 305   7.744   0.894   9.505
  750    HA   GLN 305           HA       GLN 305   5.677   2.182   7.965
  751    HB2  GLN 305           2HB      GLN 305   7.960   3.183   9.646
  752    HB3  GLN 305           1HB      GLN 305   7.022   4.280   8.638
  753    HG2  GLN 305           2HG      GLN 305   5.149   4.093   9.927
  754    HG3  GLN 305           1HG      GLN 305   5.557   2.471  10.482
  755   HE21  GLN 305          1HE2      GLN 305   6.380   2.262  12.457
  756   HE22  GLN 305          2HE2      GLN 305   6.995   3.551  13.428
  757    H    VAL 306           H        VAL 306   6.022   3.646   6.231
  758    HA   VAL 306           HA       VAL 306   8.582   3.487   4.832
  759    HB   VAL 306           HB       VAL 306   7.411   2.962   2.680
  760   HG11  VAL 306          1HG1      VAL 306   8.607   1.298   4.261
  761   HG12  VAL 306          2HG1      VAL 306   7.603   0.661   2.960
  762   HG13  VAL 306          3HG1      VAL 306   6.982   0.707   4.610
  763   HG21  VAL 306          3HG2      VAL 306   5.153   1.705   4.086
  764   HG22  VAL 306          1HG2      VAL 306   5.201   2.543   2.535
  765   HG23  VAL 306          2HG2      VAL 306   5.115   3.467   4.036
  Start of MODEL    4
    1    HA   MET   1           HA       MET   1  -8.820   1.539  -8.660
    2    H1   MET   1           1HT      MET   1  -8.224   0.208  -6.101
    3    H2   MET   1           2HT      MET   1  -7.861  -0.410  -7.661
    4    H3   MET   1           3HT      MET   1  -9.494  -0.170  -7.189
    5    HB2  MET   1           2HB      MET   1  -9.279   2.192  -5.760
    6    HB3  MET   1           1HB      MET   1  -9.117   3.479  -6.948
    7    HG2  MET   1           2HG      MET   1 -10.983   2.480  -8.225
    8    HG3  MET   1           1HG      MET   1 -11.178   1.287  -6.941
    9    HE1  MET   1           3HE      MET   1 -13.665   2.716  -4.810
   10    HE2  MET   1           1HE      MET   1 -12.073   2.280  -4.192
   11    HE3  MET   1           2HE      MET   1 -12.790   1.356  -5.512
   12    H    GLU   2           H        GLU   2  -7.441   3.257  -9.217
   13    HA   GLU   2           HA       GLU   2  -4.749   3.047  -8.060
   14    HB2  GLU   2           2HB      GLU   2  -3.967   4.086 -10.159
   15    HB3  GLU   2           1HB      GLU   2  -4.837   2.587 -10.441
   16    HG2  GLU   2           2HG      GLU   2  -6.494   5.006 -10.542
   17    HG3  GLU   2           1HG      GLU   2  -5.253   4.899 -11.787
   18    H    ILE   3           H        ILE   3  -3.486   4.993  -7.747
   19    HA   ILE   3           HA       ILE   3  -4.920   7.523  -7.639
   20    HB   ILE   3           HB       ILE   3  -3.616   6.242  -5.225
   21   HG12  ILE   3          2HG1      ILE   3  -6.040   7.145  -4.397
   22   HG13  ILE   3          1HG1      ILE   3  -6.406   6.749  -6.074
   23   HG21  ILE   3          1HG2      ILE   3  -4.622   9.063  -5.564
   24   HG22  ILE   3          2HG2      ILE   3  -2.942   8.564  -5.369
   25   HG23  ILE   3          3HG2      ILE   3  -4.087   8.341  -4.047
   26   HD11  ILE   3          3HD1      ILE   3  -6.865   4.749  -5.123
   27   HD12  ILE   3          1HD1      ILE   3  -5.710   4.979  -3.812
   28   HD13  ILE   3          2HD1      ILE   3  -5.142   4.513  -5.415
   29    H    LYS   4           H        LYS   4  -3.550   9.218  -8.167
   30    HA   LYS   4           HA       LYS   4  -0.779   8.485  -8.706
   31    HB2  LYS   4           2HB      LYS   4  -2.588  10.693  -9.608
   32    HB3  LYS   4           1HB      LYS   4  -0.848  10.905  -9.725
   33    HG2  LYS   4           2HG      LYS   4  -2.244   8.517 -10.885
   34    HG3  LYS   4           1HG      LYS   4  -2.051  10.027 -11.777
   35    HD2  LYS   4           2HD      LYS   4   0.485   9.528 -10.798
   36    HD3  LYS   4           1HD      LYS   4  -0.115   7.924 -11.220
   37    HE2  LYS   4           2HE      LYS   4  -0.832   9.001 -13.440
   38    HE3  LYS   4           1HE      LYS   4   0.237  10.326 -12.984
   39    HZ1  LYS   4           3HZ      LYS   4   1.020   7.481 -13.329
   40    HZ2  LYS   4           1HZ      LYS   4   2.057   8.715 -12.814
   41    HZ3  LYS   4           2HZ      LYS   4   1.399   8.758 -14.371
   42    H    LEU   5           H        LEU   5   0.123   8.469  -6.695
   43    HA   LEU   5           HA       LEU   5  -0.032  10.840  -5.015
   44    HG   LEU   5           HG       LEU   5  -1.270   8.599  -4.073
   45    HB2  LEU   5           2HB      LEU   5   1.171   8.118  -4.666
   46    HB3  LEU   5           1HB      LEU   5   1.584   9.420  -3.567
   47   HD11  LEU   5          1HD1      LEU   5  -1.205   7.139  -2.224
   48   HD12  LEU   5          2HD1      LEU   5   0.419   7.658  -1.772
   49   HD13  LEU   5          3HD1      LEU   5   0.173   6.702  -3.234
   50   HD21  LEU   5          3HD2      LEU   5  -0.776   9.571  -1.458
   51   HD22  LEU   5          1HD2      LEU   5  -1.735  10.310  -2.739
   52   HD23  LEU   5          2HD2      LEU   5  -0.018  10.686  -2.594
   53    H    ILE   6           H        ILE   6   1.398  12.427  -4.917
   54    HA   ILE   6           HA       ILE   6   3.819  12.253  -6.545
   55    HB   ILE   6           HB       ILE   6   2.333  14.210  -6.832
   56   HG12  ILE   6          2HG1      ILE   6   5.052  14.911  -5.696
   57   HG13  ILE   6          1HG1      ILE   6   4.751  14.353  -7.338
   58   HG21  ILE   6          1HG2      ILE   6   1.740  14.278  -4.341
   59   HG22  ILE   6          2HG2      ILE   6   1.940  15.814  -5.182
   60   HG23  ILE   6          3HG2      ILE   6   3.228  15.202  -4.146
   61   HD11  ILE   6          3HD1      ILE   6   3.118  16.438  -7.346
   62   HD12  ILE   6          1HD1      ILE   6   4.837  16.584  -7.712
   63   HD13  ILE   6          2HD1      ILE   6   4.240  16.993  -6.104
   64    H    LYS   7           H        LYS   7   5.803  12.010  -5.698
   65    HA   LYS   7           HA       LYS   7   6.132  11.671  -2.876
   66    HB2  LYS   7           2HB      LYS   7   7.377  10.271  -4.426
   67    HB3  LYS   7           1HB      LYS   7   8.161  11.685  -5.114
   68    HG2  LYS   7           2HG      LYS   7   9.793  10.871  -3.716
   69    HG3  LYS   7           1HG      LYS   7   9.012  12.072  -2.688
   70    HD2  LYS   7           2HD      LYS   7   7.526   9.853  -2.152
   71    HD3  LYS   7           1HD      LYS   7   9.119   9.149  -2.440
   72    HE2  LYS   7           2HE      LYS   7  10.013  10.912  -0.837
   73    HE3  LYS   7           1HE      LYS   7   8.332  11.210  -0.398
   74    HZ1  LYS   7           3HZ      LYS   7   9.753   8.610  -0.161
   75    HZ2  LYS   7           1HZ      LYS   7   8.133   8.882   0.247
   76    HZ3  LYS   7           2HZ      LYS   7   9.364   9.647   1.118
   77    H    GLY   8           H        GLY   8   6.135  13.383  -1.565
   78    HA2  GLY   8           2HA      GLY   8   7.486  15.849  -2.434
   79    HA3  GLY   8           1HA      GLY   8   6.308  15.732  -1.136
   80    HA   PRO   9           HA       PRO   9  10.588  16.080   0.744
   81    HB2  PRO   9           2HB      PRO   9   8.993  17.578   2.742
   82    HB3  PRO   9           1HB      PRO   9  10.520  18.013   1.966
   83    HG2  PRO   9           2HG      PRO   9   8.236  19.226   1.294
   84    HG3  PRO   9           1HG      PRO   9   9.473  18.854   0.079
   85    HD2  PRO   9           2HD      PRO   9   6.900  17.441   0.661
   86    HD3  PRO   9           1HD      PRO   9   7.664  17.794  -0.902
   87    H    LYS  10           H        LYS  10   7.512  15.766   2.517
   88    HA   LYS  10           HA       LYS  10   8.602  14.181   4.614
   89    HB2  LYS  10           2HB      LYS  10   5.822  14.871   3.725
   90    HB3  LYS  10           1HB      LYS  10   6.054  13.591   4.906
   91    HG2  LYS  10           2HG      LYS  10   7.613  15.631   5.891
   92    HG3  LYS  10           1HG      LYS  10   6.213  16.475   5.224
   93    HD2  LYS  10           2HD      LYS  10   4.714  15.127   6.545
   94    HD3  LYS  10           1HD      LYS  10   6.053  14.131   7.116
   95    HE2  LYS  10           2HE      LYS  10   6.301  15.515   8.833
   96    HE3  LYS  10           1HE      LYS  10   6.737  16.794   7.703
   97    HZ1  LYS  10           3HZ      LYS  10   4.374  17.346   7.507
   98    HZ2  LYS  10           1HZ      LYS  10   4.918  17.489   9.104
   99    HZ3  LYS  10           2HZ      LYS  10   3.992  16.150   8.642
  100    H    GLY  11           H        GLY  11   6.201  13.216   2.146
  101    HA2  GLY  11           2HA      GLY  11   6.606  11.352   0.664
  102    HA3  GLY  11           1HA      GLY  11   7.604  10.634   1.917
  103    H    LEU  12           H        LEU  12   6.267   8.732   1.474
  104    HA   LEU  12           HA       LEU  12   3.623   8.321   1.671
  105    HG   LEU  12           HG       LEU  12   5.130   6.907   0.277
  106    HB2  LEU  12           2HB      LEU  12   5.675   6.678   3.152
  107    HB3  LEU  12           1HB      LEU  12   4.074   6.139   2.687
  108   HD11  LEU  12          1HD1      LEU  12   7.327   6.963   1.850
  109   HD12  LEU  12          2HD1      LEU  12   7.350   6.593   0.126
  110   HD13  LEU  12          3HD1      LEU  12   7.356   5.285   1.308
  111   HD21  LEU  12          3HD2      LEU  12   5.636   4.346   0.127
  112   HD22  LEU  12          1HD2      LEU  12   3.981   4.922   0.302
  113   HD23  LEU  12          2HD2      LEU  12   4.853   4.307   1.706
  114    H    GLY  13           H        GLY  13   5.658   8.199   4.607
  115    HA2  GLY  13           2HA      GLY  13   5.222   8.829   6.779
  116    HA3  GLY  13           1HA      GLY  13   3.950   9.862   6.146
  117    H    PHE  14           H        PHE  14   4.412   6.330   6.177
  118    HA   PHE  14           HA       PHE  14   2.354   5.880   8.088
  119    HD1  PHE  14           2HD      PHE  14   2.295   3.153   5.141
  120    HD2  PHE  14           1HD      PHE  14   1.082   7.089   4.064
  121    HE1  PHE  14           2HE      PHE  14   2.691   2.624   2.775
  122    HE2  PHE  14           1HE      PHE  14   1.473   6.564   1.694
  123    HZ   PHE  14           HZ       PHE  14   2.278   4.330   1.047
  124    HB2  PHE  14           2HB      PHE  14   0.764   4.701   6.604
  125    HB3  PHE  14           1HB      PHE  14   0.871   6.418   6.250
  126    H    SER  15           H        SER  15   1.675   3.263   7.630
  127    HA   SER  15           HA       SER  15   4.234   1.895   7.252
  128    HG   SER  15           HG       SER  15   2.405   2.865  10.026
  129    HB2  SER  15           2HB      SER  15   3.163   0.310   9.115
  130    HB3  SER  15           1HB      SER  15   4.193   1.675   9.531
  131    H    ILE  16           H        ILE  16   3.803  -0.577   7.105
  132    HA   ILE  16           HA       ILE  16   1.235  -1.341   6.030
  133    HB   ILE  16           HB       ILE  16   1.759  -1.739   3.823
  134   HG12  ILE  16          2HG1      ILE  16   3.860  -2.973   4.241
  135   HG13  ILE  16          1HG1      ILE  16   3.945  -1.925   2.830
  136   HG21  ILE  16          1HG2      ILE  16   1.597   0.630   4.066
  137   HG22  ILE  16          2HG2      ILE  16   2.834   0.273   2.862
  138   HG23  ILE  16          3HG2      ILE  16   3.305   0.745   4.493
  139   HD11  ILE  16          3HD1      ILE  16   5.719  -0.928   3.656
  140   HD12  ILE  16          1HD1      ILE  16   5.670  -2.018   5.043
  141   HD13  ILE  16          2HD1      ILE  16   4.819  -0.473   5.102
  142    H    ALA  17           H        ALA  17   1.439  -3.616   5.087
  143    HA   ALA  17           HA       ALA  17   3.516  -5.251   6.323
  144    HB1  ALA  17           3HB      ALA  17   0.728  -5.168   7.169
  145    HB2  ALA  17           1HB      ALA  17   2.121  -5.918   7.949
  146    HB3  ALA  17           2HB      ALA  17   1.247  -6.786   6.688
  147    H    GLY  18           H        GLY  18   3.231  -7.628   5.327
  148    HA2  GLY  18           2HA      GLY  18   1.713  -8.129   3.115
  149    HA3  GLY  18           1HA      GLY  18   3.030  -7.177   2.475
  150    H    GLY  19           H        GLY  19   1.991 -10.263   2.605
  151    HA2  GLY  19           2HA      GLY  19   3.421 -11.913   1.622
  152    HA3  GLY  19           1HA      GLY  19   4.768 -11.225   2.506
  153    H    VAL  20           H        VAL  20   4.206 -13.933   2.426
  154    HA   VAL  20           HA       VAL  20   2.717 -14.879   4.624
  155    HB   VAL  20           HB       VAL  20   3.479 -16.275   2.683
  156   HG11  VAL  20          1HG1      VAL  20   5.869 -15.427   2.809
  157   HG12  VAL  20          2HG1      VAL  20   5.660 -17.160   2.555
  158   HG13  VAL  20          3HG1      VAL  20   6.088 -16.549   4.153
  159   HG21  VAL  20          3HG2      VAL  20   3.702 -18.305   3.959
  160   HG22  VAL  20          1HG2      VAL  20   2.564 -17.232   4.774
  161   HG23  VAL  20          2HG2      VAL  20   4.211 -17.398   5.384
  162    H    GLY  21           H        GLY  21   3.275 -15.359   6.730
  163    HA2  GLY  21           2HA      GLY  21   4.626 -15.516   8.636
  164    HA3  GLY  21           1HA      GLY  21   6.013 -15.063   7.658
  165    H    ASN  22           H        ASN  22   4.410 -12.696   6.650
  166    HA   ASN  22           HA       ASN  22   4.466 -11.004   9.037
  167    HB2  ASN  22           2HB      ASN  22   5.309  -9.213   7.220
  168    HB3  ASN  22           1HB      ASN  22   6.436 -10.173   8.162
  169   HD21  ASN  22          1HD2      ASN  22   4.539 -10.471   5.173
  170   HD22  ASN  22          2HD2      ASN  22   5.818 -11.165   4.244
  171    H    GLN  23           H        GLN  23   2.357 -12.318   7.175
  172    HA   GLN  23           HA       GLN  23   1.035 -10.474   5.631
  173    HB2  GLN  23           2HB      GLN  23  -0.153 -12.694   7.300
  174    HB3  GLN  23           1HB      GLN  23  -0.981 -11.857   5.997
  175    HG2  GLN  23           2HG      GLN  23   0.574 -12.734   4.384
  176    HG3  GLN  23           1HG      GLN  23   1.537 -13.468   5.666
  177   HE21  GLN  23          1HE2      GLN  23   1.146 -15.520   6.117
  178   HE22  GLN  23          2HE2      GLN  23  -0.289 -16.390   5.708
  179    H    HIS  24           H        HIS  24  -0.542  -8.984   5.909
  180    HA   HIS  24           HA       HIS  24  -0.858  -7.867   8.574
  181    HD1  HIS  24           1HD      HIS  24  -0.280  -4.976   8.715
  182    HD2  HIS  24           2HD      HIS  24  -4.052  -5.450   7.059
  183    HE1  HIS  24           1HE      HIS  24  -1.676  -3.172   9.727
  184    HE2  HIS  24           2HE      HIS  24  -3.937  -3.397   8.640
  185    HB2  HIS  24           2HB      HIS  24  -0.407  -6.448   6.535
  186    HB3  HIS  24           1HB      HIS  24  -2.013  -6.860   5.973
  187    H    ILE  25           H        ILE  25  -2.699  -9.718   6.274
  188    HA   ILE  25           HA       ILE  25  -4.950  -9.756   8.145
  189    HB   ILE  25           HB       ILE  25  -5.322  -9.338   5.175
  190   HG12  ILE  25          2HG1      ILE  25  -4.429  -7.329   6.412
  191   HG13  ILE  25          1HG1      ILE  25  -5.986  -7.089   5.630
  192   HG21  ILE  25          1HG2      ILE  25  -7.276 -10.335   5.682
  193   HG22  ILE  25          2HG2      ILE  25  -7.690  -8.728   6.282
  194   HG23  ILE  25          3HG2      ILE  25  -7.138  -9.972   7.403
  195   HD11  ILE  25          3HD1      ILE  25  -6.186  -7.974   8.406
  196   HD12  ILE  25          1HD1      ILE  25  -7.017  -6.668   7.562
  197   HD13  ILE  25          2HD1      ILE  25  -5.392  -6.413   8.196
  198    HA   PRO  26           HA       PRO  26  -4.412 -14.158   7.569
  199    HB2  PRO  26           2HB      PRO  26  -7.287 -14.144   8.367
  200    HB3  PRO  26           1HB      PRO  26  -5.946 -15.100   9.008
  201    HG2  PRO  26           2HG      PRO  26  -6.896 -13.027  10.371
  202    HG3  PRO  26           1HG      PRO  26  -5.153 -13.355  10.317
  203    HD2  PRO  26           2HD      PRO  26  -6.738 -11.270   8.885
  204    HD3  PRO  26           1HD      PRO  26  -5.094 -11.182   9.548
  205    H    GLY  27           H        GLY  27  -4.466 -15.157   5.654
  206    HA2  GLY  27           2HA      GLY  27  -5.654 -16.284   3.917
  207    HA3  GLY  27           1HA      GLY  27  -6.953 -15.114   4.087
  208    H    ASP  28           H        ASP  28  -5.622 -12.723   3.932
  209    HA   ASP  28           HA       ASP  28  -4.768 -12.740   1.134
  210    HB2  ASP  28           2HB      ASP  28  -6.588 -11.165   2.353
  211    HB3  ASP  28           1HB      ASP  28  -5.154 -10.167   2.559
  212    H    ASN  29           H        ASN  29  -2.658 -12.816   0.757
  213    HA   ASN  29           HA       ASN  29  -0.772 -11.888   2.772
  214    HB2  ASN  29           2HB      ASN  29  -0.216 -13.220   0.114
  215    HB3  ASN  29           1HB      ASN  29   0.944 -12.949   1.411
  216   HD21  ASN  29          1HD2      ASN  29   1.394 -14.723   2.480
  217   HD22  ASN  29          2HD2      ASN  29   0.297 -16.010   2.838
  218    H    SER  30           H        SER  30  -2.462 -10.118   0.821
  219    HA   SER  30           HA       SER  30  -0.550  -8.773  -0.809
  220    HG   SER  30           HG       SER  30  -3.037  -6.429  -1.686
  221    HB2  SER  30           2HB      SER  30  -3.062  -8.775  -1.179
  222    HB3  SER  30           1HB      SER  30  -3.178  -7.632   0.159
  223    H    ILE  31           H        ILE  31  -0.588  -6.182  -0.440
  224    HA   ILE  31           HA       ILE  31   0.652  -5.875   2.198
  225    HB   ILE  31           HB       ILE  31   1.009  -4.404  -0.375
  226   HG12  ILE  31          2HG1      ILE  31   3.369  -4.705   0.117
  227   HG13  ILE  31          1HG1      ILE  31   2.984  -5.339   1.710
  228   HG21  ILE  31          1HG2      ILE  31   0.574  -2.570   1.074
  229   HG22  ILE  31          2HG2      ILE  31   2.323  -2.668   0.877
  230   HG23  ILE  31          3HG2      ILE  31   1.568  -3.266   2.355
  231   HD11  ILE  31          3HD1      ILE  31   1.619  -7.073   0.178
  232   HD12  ILE  31          1HD1      ILE  31   3.291  -7.310   0.673
  233   HD13  ILE  31          2HD1      ILE  31   2.929  -6.651  -0.920
  234    H    TYR  32           H        TYR  32  -0.460  -4.994   3.777
  235    HA   TYR  32           HA       TYR  32  -2.607  -3.080   3.135
  236    HD1  TYR  32           2HD      TYR  32  -2.344  -6.568   3.137
  237    HD2  TYR  32           1HD      TYR  32  -5.644  -4.306   4.571
  238    HE1  TYR  32           2HE      TYR  32  -3.873  -8.014   1.865
  239    HE2  TYR  32           1HE      TYR  32  -7.191  -5.734   3.316
  240    HH   TYR  32           HH       TYR  32  -6.875  -8.424   2.392
  241    HB2  TYR  32           2HB      TYR  32  -2.356  -5.096   5.358
  242    HB3  TYR  32           1HB      TYR  32  -3.560  -3.815   5.364
  243    H    VAL  33           H        VAL  33  -2.783  -1.204   4.345
  244    HA   VAL  33           HA       VAL  33  -0.395  -0.236   5.588
  245    HB   VAL  33           HB       VAL  33  -3.135   0.973   5.217
  246   HG11  VAL  33          1HG1      VAL  33  -2.020   3.118   6.002
  247   HG12  VAL  33          2HG1      VAL  33  -0.771   2.090   6.705
  248   HG13  VAL  33          3HG1      VAL  33  -2.442   1.945   7.249
  249   HG21  VAL  33          3HG2      VAL  33  -0.571   1.029   3.791
  250   HG22  VAL  33          1HG2      VAL  33  -1.330   2.605   4.005
  251   HG23  VAL  33          2HG2      VAL  33  -2.208   1.307   3.198
  252    H    THR  34           H        THR  34   0.056   0.023   7.727
  253    HA   THR  34           HA       THR  34  -1.844  -1.202   9.609
  254    HB   THR  34           HB       THR  34  -0.076  -2.011  10.856
  255    HG1  THR  34           1HG      THR  34   1.322  -0.541  11.381
  256   HG21  THR  34          3HG2      THR  34   0.926  -3.361   9.420
  257   HG22  THR  34          1HG2      THR  34   1.767  -2.027   8.634
  258   HG23  THR  34          2HG2      THR  34   0.130  -2.454   8.137
  259    H    LYS  35           H        LYS  35   0.062   1.726   9.099
  260    HA   LYS  35           HA       LYS  35  -1.569   3.145  11.009
  261    HB2  LYS  35           2HB      LYS  35   1.316   2.531  11.587
  262    HB3  LYS  35           1HB      LYS  35   0.589   4.011  12.185
  263    HG2  LYS  35           2HG      LYS  35  -0.354   1.218  12.794
  264    HG3  LYS  35           1HG      LYS  35   0.593   2.248  13.863
  265    HD2  LYS  35           2HD      LYS  35  -1.894   3.447  12.835
  266    HD3  LYS  35           1HD      LYS  35  -2.107   2.073  13.922
  267    HE2  LYS  35           2HE      LYS  35  -0.099   3.777  15.004
  268    HE3  LYS  35           1HE      LYS  35  -1.491   4.767  14.570
  269    HZ1  LYS  35           3HZ      LYS  35  -1.579   2.333  16.274
  270    HZ2  LYS  35           1HZ      LYS  35  -2.899   3.316  15.881
  271    HZ3  LYS  35           2HZ      LYS  35  -1.644   3.926  16.837
  272    H    ILE  36           H        ILE  36  -1.962   5.079  10.113
  273    HA   ILE  36           HA       ILE  36  -0.068   6.120   8.142
  274    HB   ILE  36           HB       ILE  36  -2.871   7.055   8.773
  275   HG12  ILE  36          2HG1      ILE  36  -1.735   5.185   6.706
  276   HG13  ILE  36          1HG1      ILE  36  -3.113   4.940   7.772
  277   HG21  ILE  36          1HG2      ILE  36  -1.286   8.778   7.852
  278   HG22  ILE  36          2HG2      ILE  36  -2.718   8.473   6.870
  279   HG23  ILE  36          3HG2      ILE  36  -1.164   7.783   6.400
  280   HD11  ILE  36          3HD1      ILE  36  -2.957   6.655   5.315
  281   HD12  ILE  36          1HD1      ILE  36  -4.286   6.748   6.470
  282   HD13  ILE  36          2HD1      ILE  36  -3.975   5.244   5.603
  283    H    ILE  37           H        ILE  37   1.344   7.663   8.691
  284    HA   ILE  37           HA       ILE  37   1.193   8.984  11.243
  285    HB   ILE  37           HB       ILE  37   3.175   9.023   8.983
  286   HG12  ILE  37          2HG1      ILE  37   4.493   8.521  11.345
  287   HG13  ILE  37          1HG1      ILE  37   2.925   7.770  11.617
  288   HG21  ILE  37          1HG2      ILE  37   4.583  10.502  10.495
  289   HG22  ILE  37          2HG2      ILE  37   3.076  10.900  11.320
  290   HG23  ILE  37          3HG2      ILE  37   3.271  11.277   9.608
  291   HD11  ILE  37          3HD1      ILE  37   4.884   6.422  10.558
  292   HD12  ILE  37          1HD1      ILE  37   4.373   7.228   9.075
  293   HD13  ILE  37          2HD1      ILE  37   3.236   6.215   9.964
  294    H    GLU  38           H        GLU  38   0.928  11.193  11.632
  295    HA   GLU  38           HA       GLU  38  -0.929  12.569  10.047
  296    HB2  GLU  38           2HB      GLU  38  -0.227  12.900  12.558
  297    HB3  GLU  38           1HB      GLU  38   0.905  14.065  11.887
  298    HG2  GLU  38           2HG      GLU  38  -0.743  15.514  11.259
  299    HG3  GLU  38           1HG      GLU  38  -1.946  14.238  11.073
  300    H    GLY  39           H        GLY  39  -0.771  14.311   8.639
  301    HA2  GLY  39           2HA      GLY  39   0.133  15.614   6.990
  302    HA3  GLY  39           1HA      GLY  39   1.583  15.686   7.976
  303    H    GLY  40           H        GLY  40   0.433  12.575   6.917
  304    HA2  GLY  40           2HA      GLY  40   2.832  12.300   5.266
  305    HA3  GLY  40           1HA      GLY  40   1.822  10.989   5.855
  306    H    ALA  41           H        ALA  41   2.655  10.972   3.267
  307    HA   ALA  41           HA       ALA  41   1.219  12.190   1.288
  308    HB1  ALA  41           3HB      ALA  41   2.049   9.292   1.315
  309    HB2  ALA  41           1HB      ALA  41   3.085  10.654   0.888
  310    HB3  ALA  41           2HB      ALA  41   1.687  10.263  -0.114
  311    H    ALA  42           H        ALA  42   0.288   9.104   2.865
  312    HA   ALA  42           HA       ALA  42  -2.206   8.919   1.522
  313    HB1  ALA  42           3HB      ALA  42  -2.705   7.240   3.381
  314    HB2  ALA  42           1HB      ALA  42  -1.064   7.555   3.942
  315    HB3  ALA  42           2HB      ALA  42  -1.333   6.898   2.328
  316    H    HIS  43           H        HIS  43  -1.364   9.880   4.850
  317    HA   HIS  43           HA       HIS  43  -3.858  10.431   5.862
  318    HD1  HIS  43           1HD      HIS  43  -2.489  14.160   7.103
  319    HD2  HIS  43           2HD      HIS  43  -3.747  10.770   9.149
  320    HE1  HIS  43           1HE      HIS  43  -3.779  15.013   9.083
  321    HE2  HIS  43           2HE      HIS  43  -4.440  12.946  10.364
  322    HB2  HIS  43           2HB      HIS  43  -1.774  10.507   7.171
  323    HB3  HIS  43           1HB      HIS  43  -1.318  11.997   6.357
  324    H    LYS  44           H        LYS  44  -1.765  12.665   4.040
  325    HA   LYS  44           HA       LYS  44  -3.609  14.832   4.101
  326    HB2  LYS  44           2HB      LYS  44  -1.171  14.262   2.423
  327    HB3  LYS  44           1HB      LYS  44  -2.120  15.731   2.240
  328    HG2  LYS  44           2HG      LYS  44  -1.591  16.456   4.429
  329    HG3  LYS  44           1HG      LYS  44  -0.912  14.885   4.859
  330    HD2  LYS  44           2HD      LYS  44   1.027  15.247   3.675
  331    HD3  LYS  44           1HD      LYS  44   0.260  16.383   2.563
  332    HE2  LYS  44           2HE      LYS  44   0.000  17.752   4.858
  333    HE3  LYS  44           1HE      LYS  44   1.464  16.839   5.225
  334    HZ1  LYS  44           3HZ      LYS  44   1.057  18.593   2.861
  335    HZ2  LYS  44           1HZ      LYS  44   2.460  17.706   3.194
  336    HZ3  LYS  44           2HZ      LYS  44   1.991  18.964   4.221
  337    H    ASP  45           H        ASP  45  -2.939  12.257   1.769
  338    HA   ASP  45           HA       ASP  45  -4.483  13.248  -0.361
  339    HB2  ASP  45           2HB      ASP  45  -2.800  11.266  -0.291
  340    HB3  ASP  45           1HB      ASP  45  -4.194  10.303   0.185
  341    H    GLY  46           H        GLY  46  -5.334  10.885   2.181
  342    HA2  GLY  46           2HA      GLY  46  -7.417  10.782   3.280
  343    HA3  GLY  46           1HA      GLY  46  -8.115  11.770   2.011
  344    H    LYS  47           H        LYS  47  -6.765   9.851   0.005
  345    HA   LYS  47           HA       LYS  47  -9.046   8.164  -0.326
  346    HB2  LYS  47           2HB      LYS  47  -6.595   8.780  -1.840
  347    HB3  LYS  47           1HB      LYS  47  -7.212   7.152  -2.072
  348    HG2  LYS  47           2HG      LYS  47  -8.178   8.453  -3.768
  349    HG3  LYS  47           1HG      LYS  47  -9.452   8.210  -2.573
  350    HD2  LYS  47           2HD      LYS  47  -9.638  10.469  -3.051
  351    HD3  LYS  47           1HD      LYS  47  -8.630  10.471  -1.603
  352    HE2  LYS  47           2HE      LYS  47  -6.928  11.413  -2.691
  353    HE3  LYS  47           1HE      LYS  47  -7.031  10.238  -4.000
  354    HZ1  LYS  47           3HZ      LYS  47  -8.802  11.558  -4.991
  355    HZ2  LYS  47           1HZ      LYS  47  -7.393  12.476  -4.811
  356    HZ3  LYS  47           2HZ      LYS  47  -8.685  12.692  -3.741
  357    H    LEU  48           H        LEU  48  -5.758   7.678   0.888
  358    HA   LEU  48           HA       LEU  48  -6.193   4.815   1.145
  359    HG   LEU  48           HG       LEU  48  -4.296   3.535   1.008
  360    HB2  LEU  48           2HB      LEU  48  -3.983   6.077   0.491
  361    HB3  LEU  48           1HB      LEU  48  -3.791   6.227   2.228
  362   HD11  LEU  48          1HD1      LEU  48  -2.426   4.551  -0.242
  363   HD12  LEU  48          2HD1      LEU  48  -1.925   3.178   0.746
  364   HD13  LEU  48          3HD1      LEU  48  -1.584   4.823   1.285
  365   HD21  LEU  48          3HD2      LEU  48  -2.456   3.982   3.272
  366   HD22  LEU  48          1HD2      LEU  48  -3.653   2.713   3.004
  367   HD23  LEU  48          2HD2      LEU  48  -4.164   4.303   3.569
  368    H    GLN  49           H        GLN  49  -6.859   3.842   2.927
  369    HA   GLN  49           HA       GLN  49  -6.650   5.206   5.517
  370    HB2  GLN  49           2HB      GLN  49  -8.906   4.400   6.104
  371    HB3  GLN  49           1HB      GLN  49  -8.938   5.528   4.759
  372    HG2  GLN  49           2HG      GLN  49  -8.869   2.590   4.234
  373    HG3  GLN  49           1HG      GLN  49 -10.380   3.370   4.694
  374   HE21  GLN  49          1HE2      GLN  49  -8.420   2.520   2.149
  375   HE22  GLN  49          2HE2      GLN  49  -9.098   3.541   0.932
  376    H    ILE  50           H        ILE  50  -6.269   3.849   7.278
  377    HA   ILE  50           HA       ILE  50  -4.809   1.550   6.922
  378    HB   ILE  50           HB       ILE  50  -5.431   0.950   9.304
  379   HG12  ILE  50          2HG1      ILE  50  -6.527   3.510   9.995
  380   HG13  ILE  50          1HG1      ILE  50  -7.554   2.763   8.775
  381   HG21  ILE  50          1HG2      ILE  50  -4.535   3.449   9.990
  382   HG22  ILE  50          2HG2      ILE  50  -4.036   3.306   8.305
  383   HG23  ILE  50          3HG2      ILE  50  -3.525   2.096   9.482
  384   HD11  ILE  50          3HD1      ILE  50  -7.808   0.795  10.158
  385   HD12  ILE  50          1HD1      ILE  50  -8.272   2.242  11.053
  386   HD13  ILE  50          2HD1      ILE  50  -6.713   1.476  11.360
  387    H    GLY  51           H        GLY  51  -5.260  -0.430   6.214
  388    HA2  GLY  51           2HA      GLY  51  -6.620  -2.457   6.662
  389    HA3  GLY  51           1HA      GLY  51  -8.030  -1.431   6.493
  390    H    ASP  52           H        ASP  52  -6.533  -0.035   4.152
  391    HA   ASP  52           HA       ASP  52  -7.715  -1.603   2.126
  392    HB2  ASP  52           2HB      ASP  52  -6.447  -0.007   0.573
  393    HB3  ASP  52           1HB      ASP  52  -7.638   0.693   1.657
  394    H    LYS  53           H        LYS  53  -6.559  -2.449   0.209
  395    HA   LYS  53           HA       LYS  53  -4.039  -3.726   1.036
  396    HB2  LYS  53           2HB      LYS  53  -4.661  -5.480  -0.694
  397    HB3  LYS  53           1HB      LYS  53  -5.631  -5.438   0.768
  398    HG2  LYS  53           2HG      LYS  53  -6.654  -3.821  -1.463
  399    HG3  LYS  53           1HG      LYS  53  -6.642  -5.566  -1.725
  400    HD2  LYS  53           2HD      LYS  53  -7.648  -4.713   0.903
  401    HD3  LYS  53           1HD      LYS  53  -8.634  -4.207  -0.470
  402    HE2  LYS  53           2HE      LYS  53  -9.243  -6.330  -0.988
  403    HE3  LYS  53           1HE      LYS  53  -7.702  -7.014  -0.474
  404    HZ1  LYS  53           3HZ      LYS  53  -8.385  -6.789   1.817
  405    HZ2  LYS  53           1HZ      LYS  53  -9.537  -7.688   0.965
  406    HZ3  LYS  53           2HZ      LYS  53  -9.844  -6.072   1.355
  407    H    LEU  54           H        LEU  54  -2.412  -3.954  -0.413
  408    HA   LEU  54           HA       LEU  54  -2.426  -1.997  -2.595
  409    HG   LEU  54           HG       LEU  54  -1.310  -0.506  -1.098
  410    HB2  LEU  54           2HB      LEU  54  -0.394  -2.902  -0.699
  411    HB3  LEU  54           1HB      LEU  54   0.193  -2.782  -2.348
  412   HD11  LEU  54          1HD1      LEU  54   1.587  -1.203  -0.738
  413   HD12  LEU  54          2HD1      LEU  54   0.389  -0.800   0.491
  414   HD13  LEU  54          3HD1      LEU  54   0.987   0.449  -0.601
  415   HD21  LEU  54          3HD2      LEU  54  -1.042   0.205  -3.198
  416   HD22  LEU  54          1HD2      LEU  54   0.182  -1.012  -3.555
  417   HD23  LEU  54          2HD2      LEU  54   0.638   0.485  -2.742
  418    H    LEU  55           H        LEU  55  -3.098  -2.880  -4.398
  419    HA   LEU  55           HA       LEU  55  -2.625  -5.581  -5.155
  420    HG   LEU  55           HG       LEU  55  -2.945  -5.574  -7.969
  421    HB2  LEU  55           2HB      LEU  55  -4.594  -4.212  -5.865
  422    HB3  LEU  55           1HB      LEU  55  -3.524  -3.279  -6.891
  423   HD11  LEU  55          1HD1      LEU  55  -4.219  -6.798  -6.145
  424   HD12  LEU  55          2HD1      LEU  55  -4.553  -7.282  -7.807
  425   HD13  LEU  55          3HD1      LEU  55  -5.689  -6.244  -6.947
  426   HD21  LEU  55          3HD2      LEU  55  -4.890  -5.345  -9.491
  427   HD22  LEU  55          1HD2      LEU  55  -4.069  -3.818  -9.170
  428   HD23  LEU  55          2HD2      LEU  55  -5.593  -4.186  -8.363
  429    H    ALA  56           H        ALA  56  -1.329  -2.432  -6.256
  430    HA   ALA  56           HA       ALA  56   1.174  -3.759  -6.932
  431    HB1  ALA  56           3HB      ALA  56   1.179  -2.858  -9.275
  432    HB2  ALA  56           1HB      ALA  56  -0.519  -2.438  -9.062
  433    HB3  ALA  56           2HB      ALA  56  -0.017  -4.126  -8.996
  434    H    VAL  57           H        VAL  57   2.942  -2.324  -7.254
  435    HA   VAL  57           HA       VAL  57   2.430   0.532  -6.783
  436    HB   VAL  57           HB       VAL  57   4.500  -1.037  -5.230
  437   HG11  VAL  57          1HG1      VAL  57   4.895   1.008  -4.026
  438   HG12  VAL  57          2HG1      VAL  57   3.609   1.827  -4.911
  439   HG13  VAL  57          3HG1      VAL  57   5.076   1.322  -5.751
  440   HG21  VAL  57          3HG2      VAL  57   2.435  -1.663  -4.295
  441   HG22  VAL  57          1HG2      VAL  57   1.774  -0.036  -4.459
  442   HG23  VAL  57          2HG2      VAL  57   3.029  -0.361  -3.263
  443    H    ASN  58           H        ASN  58   3.321   1.549  -8.466
  444    HA   ASN  58           HA       ASN  58   4.801   2.226 -10.050
  445    HB2  ASN  58           2HB      ASN  58   6.803   0.676  -8.387
  446    HB3  ASN  58           1HB      ASN  58   7.215   1.784  -9.691
  447   HD21  ASN  58          1HD2      ASN  58   7.296   1.587  -6.521
  448   HD22  ASN  58          2HD2      ASN  58   6.958   3.220  -6.069
  449    H    ASN  59           H        ASN  59   3.227   0.099 -10.703
  450    HA   ASN  59           HA       ASN  59   2.964  -1.282 -12.504
  451    HB2  ASN  59           2HB      ASN  59   5.961  -1.149 -12.862
  452    HB3  ASN  59           1HB      ASN  59   4.811  -1.838 -14.000
  453   HD21  ASN  59          1HD2      ASN  59   6.554   0.872 -13.222
  454   HD22  ASN  59          2HD2      ASN  59   5.670   2.039 -14.140
  455    H    VAL  60           H        VAL  60   4.919  -2.040  -9.796
  456    HA   VAL  60           HA       VAL  60   4.999  -4.886 -10.475
  457    HB   VAL  60           HB       VAL  60   6.363  -5.231  -8.540
  458   HG11  VAL  60          1HG1      VAL  60   8.120  -3.274  -8.968
  459   HG12  VAL  60          2HG1      VAL  60   7.092  -3.031 -10.380
  460   HG13  VAL  60          3HG1      VAL  60   7.866  -4.593 -10.111
  461   HG21  VAL  60          3HG2      VAL  60   6.243  -4.014  -6.697
  462   HG22  VAL  60          1HG2      VAL  60   5.059  -2.978  -7.491
  463   HG23  VAL  60          2HG2      VAL  60   6.773  -2.574  -7.564
  464    H    CYS  61           H        CYS  61   3.955  -6.486  -9.209
  465    HA   CYS  61           HA       CYS  61   1.536  -5.533  -7.929
  466    HG   CYS  61           HG       CYS  61   2.962  -9.281  -7.419
  467    HB2  CYS  61           2HB      CYS  61   0.874  -7.868  -7.815
  468    HB3  CYS  61           1HB      CYS  61   1.439  -7.478  -9.433
  469    H    LEU  62           H        LEU  62   1.158  -5.415  -5.793
  470    HA   LEU  62           HA       LEU  62   3.329  -6.239  -4.011
  471    HG   LEU  62           HG       LEU  62   3.265  -4.993  -1.686
  472    HB2  LEU  62           2HB      LEU  62   2.146  -3.824  -4.234
  473    HB3  LEU  62           1HB      LEU  62   1.172  -4.528  -2.960
  474   HD11  LEU  62          1HD1      LEU  62   4.530  -3.388  -3.898
  475   HD12  LEU  62          2HD1      LEU  62   4.836  -5.082  -3.517
  476   HD13  LEU  62          3HD1      LEU  62   5.314  -3.823  -2.380
  477   HD21  LEU  62          3HD2      LEU  62   1.844  -2.919  -1.421
  478   HD22  LEU  62          1HD2      LEU  62   3.054  -2.082  -2.392
  479   HD23  LEU  62          2HD2      LEU  62   3.508  -2.804  -0.850
  480    H    GLU  63           H        GLU  63   1.431  -8.163  -5.007
  481    HA   GLU  63           HA       GLU  63  -0.224  -8.746  -2.671
  482    HB2  GLU  63           2HB      GLU  63  -0.179  -9.887  -5.464
  483    HB3  GLU  63           1HB      GLU  63  -1.151 -10.577  -4.171
  484    HG2  GLU  63           2HG      GLU  63  -2.533  -8.710  -4.041
  485    HG3  GLU  63           1HG      GLU  63  -1.377  -7.680  -4.886
  486    H    GLU  64           H        GLU  64   0.792 -11.466  -4.571
  487    HA   GLU  64           HA       GLU  64   1.717 -12.889  -2.364
  488    HB2  GLU  64           2HB      GLU  64   2.507 -14.564  -4.044
  489    HB3  GLU  64           1HB      GLU  64   0.824 -14.078  -4.198
  490    HG2  GLU  64           2HG      GLU  64   1.288 -12.726  -6.069
  491    HG3  GLU  64           1HG      GLU  64   3.026 -12.847  -5.812
  492    H    VAL  65           H        VAL  65   3.251 -10.839  -1.909
  493    HA   VAL  65           HA       VAL  65   5.978 -11.787  -2.498
  494    HB   VAL  65           HB       VAL  65   6.759  -9.409  -2.412
  495   HG11  VAL  65          1HG1      VAL  65   4.848  -9.987  -4.674
  496   HG12  VAL  65          2HG1      VAL  65   6.466 -10.672  -4.525
  497   HG13  VAL  65          3HG1      VAL  65   6.261  -8.932  -4.719
  498   HG21  VAL  65          3HG2      VAL  65   3.810  -8.813  -2.648
  499   HG22  VAL  65          1HG2      VAL  65   5.099  -7.639  -2.911
  500   HG23  VAL  65          2HG2      VAL  65   4.882  -8.367  -1.319
  501    H    THR  66           H        THR  66   7.534 -11.412  -0.791
  502    HA   THR  66           HA       THR  66   6.450 -11.651   1.809
  503    HB   THR  66           HB       THR  66   8.823 -11.499   2.548
  504    HG1  THR  66           1HG      THR  66   9.840 -10.151   1.219
  505   HG21  THR  66          3HG2      THR  66   8.295 -13.682   1.982
  506   HG22  THR  66          1HG2      THR  66   9.740 -13.343   1.029
  507   HG23  THR  66          2HG2      THR  66   8.151 -13.305   0.265
  508    H    HIS  67           H        HIS  67   7.963 -10.043   3.473
  509    HA   HIS  67           HA       HIS  67   6.575  -7.544   3.124
  510    HD1  HIS  67           1HD      HIS  67   5.202  -6.848   5.979
  511    HD2  HIS  67           2HD      HIS  67   8.970  -5.243   5.286
  512    HE1  HIS  67           1HE      HIS  67   5.025  -4.417   6.581
  513    HE2  HIS  67           2HE      HIS  67   7.285  -3.452   6.061
  514    HB2  HIS  67           2HB      HIS  67   6.889  -8.599   5.380
  515    HB3  HIS  67           1HB      HIS  67   8.579  -8.132   5.312
  516    H    GLU  68           H        GLU  68   9.859  -8.717   2.741
  517    HA   GLU  68           HA       GLU  68  11.286  -6.370   2.555
  518    HB2  GLU  68           2HB      GLU  68  11.583  -8.818   0.803
  519    HB3  GLU  68           1HB      GLU  68  12.794  -7.561   1.003
  520    HG2  GLU  68           2HG      GLU  68  13.410  -8.282   3.064
  521    HG3  GLU  68           1HG      GLU  68  11.809  -8.907   3.451
  522    H    GLU  69           H        GLU  69   9.434  -7.993  -0.024
  523    HA   GLU  69           HA       GLU  69   9.935  -6.005  -1.999
  524    HB2  GLU  69           2HB      GLU  69   7.846  -8.168  -1.753
  525    HB3  GLU  69           1HB      GLU  69   7.907  -7.074  -3.128
  526    HG2  GLU  69           2HG      GLU  69   9.118  -8.785  -3.979
  527    HG3  GLU  69           1HG      GLU  69  10.421  -7.887  -3.203
  528    H    ALA  70           H        ALA  70   7.426  -6.505   0.417
  529    HA   ALA  70           HA       ALA  70   5.557  -4.578  -0.427
  530    HB1  ALA  70           3HB      ALA  70   4.944  -6.198   1.216
  531    HB2  ALA  70           1HB      ALA  70   4.859  -4.611   1.983
  532    HB3  ALA  70           2HB      ALA  70   6.229  -5.671   2.299
  533    H    VAL  71           H        VAL  71   8.263  -4.362   1.852
  534    HA   VAL  71           HA       VAL  71   7.846  -1.590   2.421
  535    HB   VAL  71           HB       VAL  71   9.028  -3.463   3.847
  536   HG11  VAL  71          1HG1      VAL  71  10.829  -3.883   2.227
  537   HG12  VAL  71          2HG1      VAL  71  11.443  -3.372   3.798
  538   HG13  VAL  71          3HG1      VAL  71  11.401  -2.230   2.455
  539   HG21  VAL  71          3HG2      VAL  71  10.202  -1.708   5.121
  540   HG22  VAL  71          1HG2      VAL  71   8.555  -1.262   4.680
  541   HG23  VAL  71          2HG2      VAL  71   9.919  -0.587   3.788
  542    H    THR  72           H        THR  72   9.977  -3.389   0.258
  543    HA   THR  72           HA       THR  72  11.612  -1.208  -0.468
  544    HB   THR  72           HB       THR  72  11.020  -3.831  -1.836
  545    HG1  THR  72           1HG      THR  72  12.286  -4.318  -0.201
  546   HG21  THR  72          3HG2      THR  72  13.035  -1.734  -2.608
  547   HG22  THR  72          1HG2      THR  72  11.734  -2.392  -3.602
  548   HG23  THR  72          2HG2      THR  72  13.097  -3.414  -3.141
  549    H    ALA  73           H        ALA  73   8.602  -2.503  -1.852
  550    HA   ALA  73           HA       ALA  73   8.594  -0.934  -4.187
  551    HB1  ALA  73           3HB      ALA  73   6.304  -1.599  -4.439
  552    HB2  ALA  73           1HB      ALA  73   6.194  -2.040  -2.735
  553    HB3  ALA  73           2HB      ALA  73   7.217  -2.976  -3.824
  554    H    LEU  74           H        LEU  74   7.182  -0.434  -0.949
  555    HA   LEU  74           HA       LEU  74   5.921   2.043  -1.617
  556    HG   LEU  74           HG       LEU  74   4.361   0.523   1.418
  557    HB2  LEU  74           2HB      LEU  74   6.650   0.653   0.944
  558    HB3  LEU  74           1HB      LEU  74   6.074   2.307   0.972
  559   HD11  LEU  74          1HD1      LEU  74   2.643   1.598  -0.059
  560   HD12  LEU  74          2HD1      LEU  74   3.959   2.495  -0.816
  561   HD13  LEU  74          3HD1      LEU  74   3.615   2.714   0.899
  562   HD21  LEU  74          3HD2      LEU  74   5.332  -0.861  -0.577
  563   HD22  LEU  74          1HD2      LEU  74   4.187   0.089  -1.521
  564   HD23  LEU  74          2HD2      LEU  74   3.614  -0.920  -0.193
  565    H    LYS  75           H        LYS  75   9.056   1.031  -0.441
  566    HA   LYS  75           HA       LYS  75   9.985   3.662   0.235
  567    HB2  LYS  75           2HB      LYS  75  11.162   2.111   1.431
  568    HB3  LYS  75           1HB      LYS  75  11.130   0.925   0.136
  569    HG2  LYS  75           2HG      LYS  75  12.954   1.908  -0.963
  570    HG3  LYS  75           1HG      LYS  75  12.831   3.392  -0.016
  571    HD2  LYS  75           2HD      LYS  75  13.411   0.744   1.280
  572    HD3  LYS  75           1HD      LYS  75  14.696   1.733   0.585
  573    HE2  LYS  75           2HE      LYS  75  14.302   3.494   2.097
  574    HE3  LYS  75           1HE      LYS  75  12.738   2.840   2.578
  575    HZ1  LYS  75           3HZ      LYS  75  13.863   1.002   3.654
  576    HZ2  LYS  75           1HZ      LYS  75  14.436   2.472   4.267
  577    HZ3  LYS  75           2HZ      LYS  75  15.370   1.594   3.164
  578    H    ASN  76           H        ASN  76   9.934   1.779  -2.703
  579    HA   ASN  76           HA       ASN  76  12.007   3.275  -4.011
  580    HB2  ASN  76           2HB      ASN  76  11.373   0.876  -4.508
  581    HB3  ASN  76           1HB      ASN  76   9.942   1.505  -5.321
  582   HD21  ASN  76          1HD2      ASN  76  10.113   2.090  -7.388
  583   HD22  ASN  76          2HD2      ASN  76  11.594   2.243  -8.262
  584    H    THR  77           H        THR  77  10.740   5.322  -3.262
  585    HA   THR  77           HA       THR  77   8.987   6.166  -5.477
  586    HB   THR  77           HB       THR  77   8.170   7.899  -3.721
  587    HG1  THR  77           1HG      THR  77   8.419   7.315  -1.618
  588   HG21  THR  77          3HG2      THR  77   7.172   5.440  -4.472
  589   HG22  THR  77          1HG2      THR  77   6.316   6.697  -3.581
  590   HG23  THR  77          2HG2      THR  77   7.130   5.399  -2.710
  591    H    SER  78           H        SER  78   9.950   7.546  -6.787
  592    HA   SER  78           HA       SER  78  12.117   9.245  -5.761
  593    HG   SER  78           HG       SER  78  12.853   6.883  -7.642
  594    HB2  SER  78           2HB      SER  78  11.446   8.240  -8.523
  595    HB3  SER  78           1HB      SER  78  12.561   9.585  -8.281
  596    H    ASP  79           H        ASP  79  10.105   9.844  -8.621
  597    HA   ASP  79           HA       ASP  79   9.533  12.519  -7.581
  598    HB2  ASP  79           2HB      ASP  79   9.398  11.284 -10.327
  599    HB3  ASP  79           1HB      ASP  79   8.630  12.831  -9.982
  600    H    PHE  80           H        PHE  80   7.801   9.850  -9.187
  601    HA   PHE  80           HA       PHE  80   5.404  10.567  -7.639
  602    HD1  PHE  80           1HD      PHE  80   5.114  12.989  -9.706
  603    HD2  PHE  80           2HD      PHE  80   2.446   9.697  -9.275
  604    HE1  PHE  80           1HE      PHE  80   3.255  14.551  -9.326
  605    HE2  PHE  80           2HE      PHE  80   0.585  11.260  -8.895
  606    HZ   PHE  80           HZ       PHE  80   0.987  13.686  -8.917
  607    HB2  PHE  80           2HB      PHE  80   5.710  10.723 -10.460
  608    HB3  PHE  80           1HB      PHE  80   4.639   9.366 -10.122
  609    H    VAL  81           H        VAL  81   3.786   8.714  -7.570
  610    HA   VAL  81           HA       VAL  81   5.002   6.092  -7.870
  611    HB   VAL  81           HB       VAL  81   5.527   6.667  -5.558
  612   HG11  VAL  81          1HG1      VAL  81   2.563   6.993  -5.119
  613   HG12  VAL  81          2HG1      VAL  81   3.721   8.319  -5.221
  614   HG13  VAL  81          3HG1      VAL  81   3.836   7.147  -3.909
  615   HG21  VAL  81          3HG2      VAL  81   3.237   4.738  -5.408
  616   HG22  VAL  81          1HG2      VAL  81   4.786   4.694  -4.567
  617   HG23  VAL  81          2HG2      VAL  81   4.710   4.343  -6.293
  618    H    TYR  82           H        TYR  82   3.589   4.758  -8.802
  619    HA   TYR  82           HA       TYR  82   0.785   5.583  -8.953
  620    HD1  TYR  82           1HD      TYR  82   0.160   1.960 -10.399
  621    HD2  TYR  82           2HD      TYR  82   0.043   5.925 -11.936
  622    HE1  TYR  82           1HE      TYR  82  -1.984   1.470 -11.480
  623    HE2  TYR  82           2HE      TYR  82  -2.109   5.446 -13.020
  624    HH   TYR  82           HH       TYR  82  -3.929   3.939 -12.941
  625    HB2  TYR  82           2HB      TYR  82   2.090   5.009 -11.021
  626    HB3  TYR  82           1HB      TYR  82   2.152   3.348 -10.443
  627    H    LEU  83           H        LEU  83  -0.171   4.971  -7.124
  628    HA   LEU  83           HA       LEU  83   0.263   2.366  -5.963
  629    HG   LEU  83           HG       LEU  83  -1.279   1.937  -4.044
  630    HB2  LEU  83           2HB      LEU  83  -0.023   4.467  -4.639
  631    HB3  LEU  83           1HB      LEU  83  -1.704   4.493  -5.135
  632   HD11  LEU  83          1HD1      LEU  83  -0.461   2.464  -1.791
  633   HD12  LEU  83          2HD1      LEU  83  -0.084   4.104  -2.321
  634   HD13  LEU  83          3HD1      LEU  83   0.775   2.731  -3.022
  635   HD21  LEU  83          3HD2      LEU  83  -2.562   4.363  -2.794
  636   HD22  LEU  83          1HD2      LEU  83  -2.879   2.675  -2.388
  637   HD23  LEU  83          2HD2      LEU  83  -3.331   3.301  -3.974
  638    H    LYS  84           H        LYS  84  -0.906   0.615  -6.218
  639    HA   LYS  84           HA       LYS  84  -3.558   0.802  -7.482
  640    HB2  LYS  84           2HB      LYS  84  -1.254  -0.933  -8.039
  641    HB3  LYS  84           1HB      LYS  84  -2.785  -1.783  -7.914
  642    HG2  LYS  84           2HG      LYS  84  -2.779   0.654  -9.576
  643    HG3  LYS  84           1HG      LYS  84  -1.861  -0.723 -10.191
  644    HD2  LYS  84           2HD      LYS  84  -3.743  -1.707 -10.851
  645    HD3  LYS  84           1HD      LYS  84  -4.363  -1.666  -9.199
  646    HE2  LYS  84           2HE      LYS  84  -5.974  -0.475 -10.348
  647    HE3  LYS  84           1HE      LYS  84  -4.928   0.808  -9.744
  648    HZ1  LYS  84           3HZ      LYS  84  -5.667   0.834 -12.198
  649    HZ2  LYS  84           1HZ      LYS  84  -4.463  -0.335 -12.421
  650    HZ3  LYS  84           2HZ      LYS  84  -4.057   1.196 -11.828
  651    H    VAL  85           H        VAL  85  -5.263  -0.331  -6.512
  652    HA   VAL  85           HA       VAL  85  -4.577  -1.898  -4.131
  653    HB   VAL  85           HB       VAL  85  -6.725   0.225  -4.275
  654   HG11  VAL  85          1HG1      VAL  85  -6.413  -0.623  -1.630
  655   HG12  VAL  85          2HG1      VAL  85  -6.478  -2.101  -2.588
  656   HG13  VAL  85          3HG1      VAL  85  -7.789  -0.925  -2.693
  657   HG21  VAL  85          3HG2      VAL  85  -5.384   1.198  -2.357
  658   HG22  VAL  85          1HG2      VAL  85  -4.651   1.306  -3.957
  659   HG23  VAL  85          2HG2      VAL  85  -4.098   0.081  -2.815
  660    H    ALA  86           H        ALA  86  -5.868  -3.657  -3.729
  661    HA   ALA  86           HA       ALA  86  -7.647  -4.462  -5.887
  662    HB1  ALA  86           3HB      ALA  86  -7.303  -6.619  -5.232
  663    HB2  ALA  86           1HB      ALA  86  -7.206  -6.204  -3.521
  664    HB3  ALA  86           2HB      ALA  86  -5.832  -5.895  -4.583
  665    H    LYS  87           H        LYS  87  -9.833  -4.722  -5.716
  666    HA   LYS  87           HA       LYS  87 -11.081  -3.580  -3.335
  667    HB2  LYS  87           2HB      LYS  87 -11.916  -3.975  -6.166
  668    HB3  LYS  87           1HB      LYS  87 -13.176  -3.949  -4.941
  669    HG2  LYS  87           2HG      LYS  87 -12.080  -1.758  -4.158
  670    HG3  LYS  87           1HG      LYS  87 -11.273  -1.776  -5.727
  671    HD2  LYS  87           2HD      LYS  87 -14.163  -2.276  -5.841
  672    HD3  LYS  87           1HD      LYS  87 -13.723  -0.678  -5.236
  673    HE2  LYS  87           2HE      LYS  87 -13.770  -0.226  -7.469
  674    HE3  LYS  87           1HE      LYS  87 -12.090  -0.739  -7.319
  675    HZ1  LYS  87           3HZ      LYS  87 -13.171  -1.792  -9.202
  676    HZ2  LYS  87           1HZ      LYS  87 -14.354  -2.457  -8.190
  677    HZ3  LYS  87           2HZ      LYS  87 -12.742  -2.952  -8.048
  678    HA   PRO  88           HA       PRO  88 -11.933  -7.790  -2.008
  679    HB2  PRO  88           2HB      PRO  88 -13.006  -7.122   0.391
  680    HB3  PRO  88           1HB      PRO  88 -11.265  -7.129   0.087
  681    HG2  PRO  88           2HG      PRO  88 -13.172  -4.825   0.125
  682    HG3  PRO  88           1HG      PRO  88 -11.536  -4.935   0.799
  683    HD2  PRO  88           2HD      PRO  88 -12.082  -3.719  -1.568
  684    HD3  PRO  88           1HD      PRO  88 -10.538  -4.527  -1.231
  685    H    THR  89           H        THR  89 -13.725  -9.086  -2.089
  686    HA   THR  89           HA       THR  89 -16.380  -7.864  -1.993
  687    HB   THR  89           HB       THR  89 -15.794  -9.825  -4.190
  688    HG1  THR  89           1HG      THR  89 -14.422  -8.352  -4.883
  689   HG21  THR  89          3HG2      THR  89 -17.542  -8.300  -5.316
  690   HG22  THR  89          1HG2      THR  89 -17.881  -7.751  -3.674
  691   HG23  THR  89          2HG2      THR  89 -18.071  -9.454  -4.090
  692    H    GLY  90           H        GLY  90 -14.857 -11.027  -2.715
  693    HA2  GLY  90           2HA      GLY  90 -15.215 -12.455  -0.502
  694    HA3  GLY  90           1HA      GLY  90 -16.872 -12.357  -1.079
  695    H    SER  91           H        SER  91 -13.957 -14.042  -1.253
  696    HA   SER  91           HA       SER  91 -14.067 -15.110  -3.859
  697    HG   SER  91           HG       SER  91 -13.077 -17.242  -0.892
  698    HB2  SER  91           2HB      SER  91 -12.579 -16.897  -2.949
  699    HB3  SER  91           1HB      SER  91 -12.032 -15.266  -2.564
  700    H    HIS  92           H        HIS  92 -15.627 -16.098  -0.856
  701    HA   HIS  92           HA       HIS  92 -16.456 -18.664  -1.584
  702    HD1  HIS  92           1HD      HIS  92 -16.398 -15.214   0.941
  703    HD2  HIS  92           2HD      HIS  92 -20.234 -16.551   0.065
  704    HE1  HIS  92           1HE      HIS  92 -17.914 -13.265   1.416
  705    HE2  HIS  92           2HE      HIS  92 -20.235 -14.110   0.916
  706    HB2  HIS  92           2HB      HIS  92 -18.194 -18.421   0.138
  707    HB3  HIS  92           1HB      HIS  92 -16.640 -17.824   0.707
  708    HA   ARG 301           HA       ARG 301   2.849 -10.791   9.983
  709    HE   ARG 301           HE       ARG 301  -0.299 -10.863  15.501
  710    H1   ARG 301           1HT      ARG 301   4.258 -11.909  11.391
  711    H2   ARG 301           2HT      ARG 301   2.675 -12.380  11.853
  712    H3   ARG 301           3HT      ARG 301   3.544 -11.240  12.798
  713    HB2  ARG 301           2HB      ARG 301   0.957  -9.421  10.892
  714    HB3  ARG 301           1HB      ARG 301   0.766 -11.153  11.114
  715    HG2  ARG 301           2HG      ARG 301   2.075  -9.962  13.388
  716    HG3  ARG 301           1HG      ARG 301   0.541  -9.163  13.045
  717    HD2  ARG 301           2HD      ARG 301  -0.169 -11.763  12.772
  718    HD3  ARG 301           1HD      ARG 301   1.089 -11.894  13.999
  719   HH11  ARG 301          1HH1      ARG 301  -1.627 -10.441  12.285
  720   HH12  ARG 301          2HH1      ARG 301  -3.123  -9.787  12.857
  721   HH21  ARG 301          1HH2      ARG 301  -2.274 -10.000  16.245
  722   HH22  ARG 301          2HH2      ARG 301  -3.491  -9.536  15.104
  723    H    ARG 302           H        ARG 302   5.208 -10.044  10.343
  724    HA   ARG 302           HA       ARG 302   5.784  -7.782  11.903
  725    HE   ARG 302           HE       ARG 302   9.035  -7.293  12.860
  726    HB2  ARG 302           2HB      ARG 302   7.661  -8.958  11.173
  727    HB3  ARG 302           1HB      ARG 302   7.079  -9.062   9.520
  728    HG2  ARG 302           2HG      ARG 302   8.971  -7.569   9.654
  729    HG3  ARG 302           1HG      ARG 302   7.519  -6.667   9.222
  730    HD2  ARG 302           2HD      ARG 302   8.508  -5.311  10.821
  731    HD3  ARG 302           1HD      ARG 302   7.323  -6.217  11.759
  732   HH11  ARG 302          1HH1      ARG 302  10.347  -5.477  10.168
  733   HH12  ARG 302          2HH1      ARG 302  11.989  -5.680  10.673
  734   HH21  ARG 302          1HH2      ARG 302  11.202  -7.557  13.520
  735   HH22  ARG 302          2HH2      ARG 302  12.476  -6.862  12.577
  736    H    GLU 303           H        GLU 303   5.187  -5.749  11.707
  737    HA   GLU 303           HA       GLU 303   4.322  -4.753   9.071
  738    HB2  GLU 303           2HB      GLU 303   3.272  -4.016  11.811
  739    HB3  GLU 303           1HB      GLU 303   2.797  -3.230  10.312
  740    HG2  GLU 303           2HG      GLU 303   1.537  -5.000   9.616
  741    HG3  GLU 303           1HG      GLU 303   2.503  -6.177  10.499
  742    H    THR 304           H        THR 304   5.864  -3.470   8.303
  743    HA   THR 304           HA       THR 304   7.357  -1.765  10.167
  744    HB   THR 304           HB       THR 304   8.092  -3.331   7.824
  745    HG1  THR 304           1HG      THR 304   9.561  -2.081   9.899
  746   HG21  THR 304          3HG2      THR 304   9.841  -1.851   6.997
  747   HG22  THR 304          1HG2      THR 304   9.198  -0.540   7.986
  748   HG23  THR 304          2HG2      THR 304   8.230  -1.211   6.673
  749    H    GLN 305           H        GLN 305   7.856   0.408   9.590
  750    HA   GLN 305           HA       GLN 305   5.682   1.724   8.200
  751    HB2  GLN 305           2HB      GLN 305   8.000   2.710   9.847
  752    HB3  GLN 305           1HB      GLN 305   6.974   3.816   8.943
  753    HG2  GLN 305           2HG      GLN 305   5.146   3.438  10.279
  754    HG3  GLN 305           1HG      GLN 305   5.717   1.852  10.796
  755   HE21  GLN 305          1HE2      GLN 305   5.101   4.820  11.893
  756   HE22  GLN 305          2HE2      GLN 305   6.259   4.938  13.169
  757    H    VAL 306           H        VAL 306   5.948   3.203   6.473
  758    HA   VAL 306           HA       VAL 306   8.496   3.091   5.025
  759    HB   VAL 306           HB       VAL 306   7.257   2.753   2.876
  760   HG11  VAL 306          1HG1      VAL 306   8.471   0.937   4.013
  761   HG12  VAL 306          2HG1      VAL 306   7.072   0.349   3.114
  762   HG13  VAL 306          3HG1      VAL 306   6.991   0.502   4.870
  763   HG21  VAL 306          3HG2      VAL 306   4.976   2.191   4.765
  764   HG22  VAL 306          1HG2      VAL 306   5.006   1.641   3.090
  765   HG23  VAL 306          2HG2      VAL 306   5.032   3.366   3.451
  Start of MODEL    5
    1    HA   MET   1           HA       MET   1  -9.195   2.490  -6.652
    2    H1   MET   1           1HT      MET   1  -8.922   4.801  -5.843
    3    H2   MET   1           2HT      MET   1 -10.510   4.324  -6.280
    4    H3   MET   1           3HT      MET   1  -9.591   5.319  -7.334
    5    HB2  MET   1           2HB      MET   1 -10.742   3.531  -8.536
    6    HB3  MET   1           1HB      MET   1  -9.216   3.666  -9.398
    7    HG2  MET   1           2HG      MET   1  -8.944   1.161  -8.736
    8    HG3  MET   1           1HG      MET   1 -10.694   1.229  -8.533
    9    HE1  MET   1           3HE      MET   1 -12.227   0.965  -9.967
   10    HE2  MET   1           1HE      MET   1 -11.612  -0.328 -10.996
   11    HE3  MET   1           2HE      MET   1 -12.239   1.153 -11.720
   12    H    GLU   2           H        GLU   2  -7.723   5.295  -8.302
   13    HA   GLU   2           HA       GLU   2  -5.129   3.923  -8.077
   14    HB2  GLU   2           2HB      GLU   2  -4.368   5.262 -10.009
   15    HB3  GLU   2           1HB      GLU   2  -5.705   4.193 -10.403
   16    HG2  GLU   2           2HG      GLU   2  -6.558   6.855  -9.590
   17    HG3  GLU   2           1HG      GLU   2  -5.529   6.852 -11.021
   18    H    ILE   3           H        ILE   3  -3.905   4.699  -6.600
   19    HA   ILE   3           HA       ILE   3  -4.215   7.463  -5.671
   20    HB   ILE   3           HB       ILE   3  -2.613   5.209  -4.446
   21   HG12  ILE   3          2HG1      ILE   3  -4.590   5.688  -2.678
   22   HG13  ILE   3          1HG1      ILE   3  -5.433   6.095  -4.168
   23   HG21  ILE   3          1HG2      ILE   3  -3.321   7.925  -3.344
   24   HG22  ILE   3          2HG2      ILE   3  -1.722   7.401  -3.874
   25   HG23  ILE   3          3HG2      ILE   3  -2.478   6.643  -2.473
   26   HD11  ILE   3          3HD1      ILE   3  -5.517   3.956  -4.857
   27   HD12  ILE   3          1HD1      ILE   3  -5.353   3.632  -3.132
   28   HD13  ILE   3          2HD1      ILE   3  -3.937   3.559  -4.182
   29    H    LYS   4           H        LYS   4  -3.064   8.846  -6.919
   30    HA   LYS   4           HA       LYS   4  -0.316   8.113  -7.644
   31    HB2  LYS   4           2HB      LYS   4  -2.357   9.278  -9.128
   32    HB3  LYS   4           1HB      LYS   4  -1.300  10.629  -8.744
   33    HG2  LYS   4           2HG      LYS   4   0.591   9.455  -9.717
   34    HG3  LYS   4           1HG      LYS   4  -0.431   8.056 -10.049
   35    HD2  LYS   4           2HD      LYS   4  -0.309   9.213 -12.090
   36    HD3  LYS   4           1HD      LYS   4  -1.881   9.647 -11.417
   37    HE2  LYS   4           2HE      LYS   4  -1.170  11.730 -11.981
   38    HE3  LYS   4           1HE      LYS   4  -0.445  11.633 -10.379
   39    HZ1  LYS   4           3HZ      LYS   4   0.872  11.268 -13.004
   40    HZ2  LYS   4           1HZ      LYS   4   1.592  10.753 -11.562
   41    HZ3  LYS   4           2HZ      LYS   4   1.241  12.391 -11.794
   42    H    LEU   5           H        LEU   5   0.691   8.501  -5.742
   43    HA   LEU   5           HA       LEU   5   0.488  11.106  -4.458
   44    HG   LEU   5           HG       LEU   5  -0.330   8.417  -3.348
   45    HB2  LEU   5           2HB      LEU   5   2.112   8.669  -3.746
   46    HB3  LEU   5           1HB      LEU   5   2.085  10.143  -2.801
   47   HD11  LEU   5          1HD1      LEU   5   1.693   8.413  -1.169
   48   HD12  LEU   5          2HD1      LEU   5   0.837   7.068  -1.923
   49   HD13  LEU   5          3HD1      LEU   5   0.007   8.098  -0.758
   50   HD21  LEU   5          3HD2      LEU   5  -1.136  10.565  -2.935
   51   HD22  LEU   5          1HD2      LEU   5   0.123  10.914  -1.752
   52   HD23  LEU   5          2HD2      LEU   5  -1.178   9.796  -1.350
   53    H    ILE   6           H        ILE   6   1.857  12.753  -4.657
   54    HA   ILE   6           HA       ILE   6   4.093  12.483  -6.498
   55    HB   ILE   6           HB       ILE   6   2.547  14.405  -6.723
   56   HG12  ILE   6          2HG1      ILE   6   5.368  15.224  -5.988
   57   HG13  ILE   6          1HG1      ILE   6   4.898  14.507  -7.526
   58   HG21  ILE   6          1HG2      ILE   6   3.775  15.574  -4.248
   59   HG22  ILE   6          2HG2      ILE   6   2.277  14.646  -4.191
   60   HG23  ILE   6          3HG2      ILE   6   2.362  16.124  -5.149
   61   HD11  ILE   6          3HD1      ILE   6   3.205  16.571  -7.484
   62   HD12  ILE   6          1HD1      ILE   6   4.837  16.672  -8.145
   63   HD13  ILE   6          2HD1      ILE   6   4.512  17.246  -6.510
   64    H    LYS   7           H        LYS   7   6.145  12.271  -5.881
   65    HA   LYS   7           HA       LYS   7   6.930  11.872  -3.246
   66    HB2  LYS   7           2HB      LYS   7   8.134  11.098  -5.314
   67    HB3  LYS   7           1HB      LYS   7   8.765  12.731  -5.478
   68    HG2  LYS   7           2HG      LYS   7  10.497  11.859  -4.337
   69    HG3  LYS   7           1HG      LYS   7   9.483  12.247  -2.947
   70    HD2  LYS   7           2HD      LYS   7   8.909   9.636  -4.137
   71    HD3  LYS   7           1HD      LYS   7  10.549   9.782  -3.505
   72    HE2  LYS   7           2HE      LYS   7   9.459   9.072  -1.624
   73    HE3  LYS   7           1HE      LYS   7   9.303  10.816  -1.428
   74    HZ1  LYS   7           3HZ      LYS   7   7.098  10.713  -1.660
   75    HZ2  LYS   7           1HZ      LYS   7   7.260   9.057  -1.360
   76    HZ3  LYS   7           2HZ      LYS   7   7.166   9.622  -2.951
   77    H    GLY   8           H        GLY   8   7.154  13.220  -1.618
   78    HA2  GLY   8           2HA      GLY   8   7.985  16.003  -2.179
   79    HA3  GLY   8           1HA      GLY   8   6.789  15.599  -0.958
   80    HA   PRO   9           HA       PRO   9  11.039  16.091   1.028
   81    HB2  PRO   9           2HB      PRO   9   9.314  17.391   3.062
   82    HB3  PRO   9           1HB      PRO   9  10.857  17.924   2.387
   83    HG2  PRO   9           2HG      PRO   9   8.576  19.113   1.686
   84    HG3  PRO   9           1HG      PRO   9   9.869  18.841   0.503
   85    HD2  PRO   9           2HD      PRO   9   7.315  17.334   0.900
   86    HD3  PRO   9           1HD      PRO   9   8.129  17.795  -0.609
   87    H    LYS  10           H        LYS  10   7.872  15.185   2.333
   88    HA   LYS  10           HA       LYS  10   9.014  13.662   4.502
   89    HB2  LYS  10           2HB      LYS  10   6.784  14.865   4.588
   90    HB3  LYS  10           1HB      LYS  10   6.152  13.605   3.540
   91    HG2  LYS  10           2HG      LYS  10   5.755  12.326   5.299
   92    HG3  LYS  10           1HG      LYS  10   7.469  12.350   5.719
   93    HD2  LYS  10           2HD      LYS  10   6.440  13.201   7.626
   94    HD3  LYS  10           1HD      LYS  10   6.953  14.653   6.765
   95    HE2  LYS  10           2HE      LYS  10   4.793  15.184   6.113
   96    HE3  LYS  10           1HE      LYS  10   4.219  13.529   6.308
   97    HZ1  LYS  10           3HZ      LYS  10   3.407  15.046   8.045
   98    HZ2  LYS  10           1HZ      LYS  10   5.000  15.315   8.550
   99    HZ3  LYS  10           2HZ      LYS  10   4.320  13.772   8.681
  100    H    GLY  11           H        GLY  11   6.833  12.703   1.830
  101    HA2  GLY  11           2HA      GLY  11   7.830  10.917   0.331
  102    HA3  GLY  11           1HA      GLY  11   8.158  10.062   1.830
  103    H    LEU  12           H        LEU  12   6.725   8.532   2.336
  104    HA   LEU  12           HA       LEU  12   4.127   8.514   1.027
  105    HG   LEU  12           HG       LEU  12   6.169   6.654   0.261
  106    HB2  LEU  12           2HB      LEU  12   5.629   6.524   2.708
  107    HB3  LEU  12           1HB      LEU  12   3.950   6.277   2.269
  108   HD11  LEU  12          1HD1      LEU  12   5.670   4.133  -0.084
  109   HD12  LEU  12          2HD1      LEU  12   5.082   4.204   1.577
  110   HD13  LEU  12          3HD1      LEU  12   6.753   4.637   1.213
  111   HD21  LEU  12          3HD2      LEU  12   3.341   6.692   0.044
  112   HD22  LEU  12          1HD2      LEU  12   3.924   5.208  -0.713
  113   HD23  LEU  12          2HD2      LEU  12   4.543   6.772  -1.243
  114    H    GLY  13           H        GLY  13   5.360   8.230   4.370
  115    HA2  GLY  13           2HA      GLY  13   4.541   9.241   6.288
  116    HA3  GLY  13           1HA      GLY  13   3.229   9.920   5.347
  117    H    PHE  14           H        PHE  14   4.018   6.471   5.507
  118    HA   PHE  14           HA       PHE  14   2.019   5.918   7.487
  119    HD1  PHE  14           2HD      PHE  14   1.975   3.003   4.623
  120    HD2  PHE  14           1HD      PHE  14   0.991   6.971   3.430
  121    HE1  PHE  14           2HE      PHE  14   2.478   2.421   2.288
  122    HE2  PHE  14           1HE      PHE  14   1.488   6.393   1.093
  123    HZ   PHE  14           HZ       PHE  14   2.233   4.119   0.518
  124    HB2  PHE  14           2HB      PHE  14   0.548   4.568   6.028
  125    HB3  PHE  14           1HB      PHE  14   0.527   6.274   5.608
  126    H    SER  15           H        SER  15   1.555   3.274   7.193
  127    HA   SER  15           HA       SER  15   4.169   2.029   6.799
  128    HG   SER  15           HG       SER  15   1.871   1.127   9.958
  129    HB2  SER  15           2HB      SER  15   3.511   0.561   8.791
  130    HB3  SER  15           1HB      SER  15   4.058   2.193   9.154
  131    H    ILE  16           H        ILE  16   3.841  -0.481   6.853
  132    HA   ILE  16           HA       ILE  16   1.248  -1.367   5.881
  133    HB   ILE  16           HB       ILE  16   1.831  -2.033   3.747
  134   HG12  ILE  16          2HG1      ILE  16   4.045  -3.049   4.479
  135   HG13  ILE  16          1HG1      ILE  16   3.964  -2.416   2.842
  136   HG21  ILE  16          1HG2      ILE  16   1.578   0.353   3.761
  137   HG22  ILE  16          2HG2      ILE  16   2.801  -0.101   2.575
  138   HG23  ILE  16          3HG2      ILE  16   3.290   0.563   4.134
  139   HD11  ILE  16          3HD1      ILE  16   5.568  -0.948   3.224
  140   HD12  ILE  16          1HD1      ILE  16   5.903  -1.877   4.687
  141   HD13  ILE  16          2HD1      ILE  16   4.866  -0.450   4.763
  142    H    ALA  17           H        ALA  17   1.303  -3.702   5.341
  143    HA   ALA  17           HA       ALA  17   3.382  -5.255   6.711
  144    HB1  ALA  17           3HB      ALA  17   0.497  -5.126   7.351
  145    HB2  ALA  17           1HB      ALA  17   1.862  -5.591   8.366
  146    HB3  ALA  17           2HB      ALA  17   1.179  -6.750   7.227
  147    H    GLY  18           H        GLY  18   3.283  -7.638   5.825
  148    HA2  GLY  18           2HA      GLY  18   1.721  -8.407   3.722
  149    HA3  GLY  18           1HA      GLY  18   2.917  -7.388   2.963
  150    H    GLY  19           H        GLY  19   2.168 -10.482   3.091
  151    HA2  GLY  19           2HA      GLY  19   3.740 -12.013   2.120
  152    HA3  GLY  19           1HA      GLY  19   5.006 -11.259   3.071
  153    H    VAL  20           H        VAL  20   4.521 -14.034   2.932
  154    HA   VAL  20           HA       VAL  20   3.016 -14.967   5.139
  155    HB   VAL  20           HB       VAL  20   5.381 -16.346   3.842
  156   HG11  VAL  20          1HG1      VAL  20   4.256 -18.410   4.614
  157   HG12  VAL  20          2HG1      VAL  20   3.080 -17.415   5.473
  158   HG13  VAL  20          3HG1      VAL  20   4.780 -17.374   5.941
  159   HG21  VAL  20          3HG2      VAL  20   3.506 -17.560   2.587
  160   HG22  VAL  20          1HG2      VAL  20   3.914 -15.925   2.067
  161   HG23  VAL  20          2HG2      VAL  20   2.485 -16.203   3.063
  162    H    GLY  21           H        GLY  21   3.577 -15.335   7.264
  163    HA2  GLY  21           2HA      GLY  21   4.927 -15.451   9.167
  164    HA3  GLY  21           1HA      GLY  21   6.328 -15.124   8.161
  165    H    ASN  22           H        ASN  22   4.656 -12.741   7.106
  166    HA   ASN  22           HA       ASN  22   4.808 -10.918   9.381
  167    HB2  ASN  22           2HB      ASN  22   5.893  -9.252   7.679
  168    HB3  ASN  22           1HB      ASN  22   6.925 -10.401   8.506
  169   HD21  ASN  22          1HD2      ASN  22   8.462 -11.002   7.162
  170   HD22  ASN  22          2HD2      ASN  22   8.238 -11.482   5.518
  171    H    GLN  23           H        GLN  23   2.663 -12.171   7.708
  172    HA   GLN  23           HA       GLN  23   1.627 -10.191   5.957
  173    HB2  GLN  23           2HB      GLN  23  -0.460 -11.658   6.069
  174    HB3  GLN  23           1HB      GLN  23   1.009 -12.389   5.439
  175    HG2  GLN  23           2HG      GLN  23   1.091 -13.907   7.069
  176    HG3  GLN  23           1HG      GLN  23   0.697 -12.727   8.317
  177   HE21  GLN  23          1HE2      GLN  23  -0.458 -15.246   6.332
  178   HE22  GLN  23          2HE2      GLN  23  -2.104 -15.216   6.858
  179    H    HIS  24           H        HIS  24  -0.378  -9.137   6.101
  180    HA   HIS  24           HA       HIS  24  -0.871  -7.982   8.738
  181    HD1  HIS  24           1HD      HIS  24  -0.676  -5.125   8.938
  182    HD2  HIS  24           2HD      HIS  24  -4.224  -5.871   6.915
  183    HE1  HIS  24           1HE      HIS  24  -2.296  -3.431   9.796
  184    HE2  HIS  24           2HE      HIS  24  -4.421  -3.826   8.500
  185    HB2  HIS  24           2HB      HIS  24  -0.491  -6.550   6.701
  186    HB3  HIS  24           1HB      HIS  24  -2.008  -7.152   6.064
  187    H    ILE  25           H        ILE  25  -2.487  -9.831   6.238
  188    HA   ILE  25           HA       ILE  25  -4.801 -10.166   8.031
  189    HB   ILE  25           HB       ILE  25  -4.965  -9.912   5.026
  190   HG12  ILE  25          2HG1      ILE  25  -4.398  -7.768   6.117
  191   HG13  ILE  25          1HG1      ILE  25  -6.002  -7.745   5.393
  192   HG21  ILE  25          1HG2      ILE  25  -7.399  -9.562   6.581
  193   HG22  ILE  25          2HG2      ILE  25  -6.706 -11.177   6.728
  194   HG23  ILE  25          3HG2      ILE  25  -7.105 -10.530   5.138
  195   HD11  ILE  25          3HD1      ILE  25  -6.401  -8.569   8.028
  196   HD12  ILE  25          1HD1      ILE  25  -6.770  -6.994   7.325
  197   HD13  ILE  25          2HD1      ILE  25  -5.216  -7.266   8.111
  198    HA   PRO  26           HA       PRO  26  -3.837 -14.501   7.630
  199    HB2  PRO  26           2HB      PRO  26  -6.333 -15.435   8.359
  200    HB3  PRO  26           1HB      PRO  26  -5.064 -14.965   9.495
  201    HG2  PRO  26           2HG      PRO  26  -7.427 -13.402   8.537
  202    HG3  PRO  26           1HG      PRO  26  -6.739 -13.509  10.168
  203    HD2  PRO  26           2HD      PRO  26  -6.285 -11.386   8.603
  204    HD3  PRO  26           1HD      PRO  26  -5.021 -12.027   9.674
  205    H    GLY  27           H        GLY  27  -3.721 -15.544   5.746
  206    HA2  GLY  27           2HA      GLY  27  -4.692 -16.816   3.987
  207    HA3  GLY  27           1HA      GLY  27  -6.143 -15.833   4.115
  208    H    ASP  28           H        ASP  28  -5.227 -13.289   3.941
  209    HA   ASP  28           HA       ASP  28  -4.264 -13.186   1.185
  210    HB2  ASP  28           2HB      ASP  28  -6.201 -11.726   2.658
  211    HB3  ASP  28           1HB      ASP  28  -4.919 -10.596   2.233
  212    H    ASN  29           H        ASN  29  -2.081 -13.309   1.187
  213    HA   ASN  29           HA       ASN  29  -0.475 -11.910   3.141
  214    HB2  ASN  29           2HB      ASN  29   0.343 -13.460   0.681
  215    HB3  ASN  29           1HB      ASN  29   1.444 -12.848   1.912
  216   HD21  ASN  29          1HD2      ASN  29  -0.450 -15.440   0.937
  217   HD22  ASN  29          2HD2      ASN  29  -0.386 -16.363   2.396
  218    H    SER  30           H        SER  30  -2.183 -10.339   1.192
  219    HA   SER  30           HA       SER  30  -0.448  -8.993  -0.616
  220    HG   SER  30           HG       SER  30  -3.927  -9.557  -0.388
  221    HB2  SER  30           2HB      SER  30  -3.026  -7.902   0.534
  222    HB3  SER  30           1HB      SER  30  -2.269  -7.482  -1.001
  223    H    ILE  31           H        ILE  31  -0.538  -6.348  -0.276
  224    HA   ILE  31           HA       ILE  31   0.761  -6.010   2.341
  225    HB   ILE  31           HB       ILE  31   1.126  -4.135   0.017
  226   HG12  ILE  31          2HG1      ILE  31   2.141  -5.942  -0.942
  227   HG13  ILE  31          1HG1      ILE  31   3.473  -5.366   0.040
  228   HG21  ILE  31          1HG2      ILE  31   2.910  -4.564   2.383
  229   HG22  ILE  31          2HG2      ILE  31   1.610  -3.374   2.361
  230   HG23  ILE  31          3HG2      ILE  31   2.942  -3.246   1.214
  231   HD11  ILE  31          3HD1      ILE  31   3.590  -7.336   1.041
  232   HD12  ILE  31          1HD1      ILE  31   2.273  -7.914   0.024
  233   HD13  ILE  31          2HD1      ILE  31   1.924  -7.184   1.587
  234    H    TYR  32           H        TYR  32  -0.565  -5.265   3.771
  235    HA   TYR  32           HA       TYR  32  -2.590  -3.255   3.081
  236    HD1  TYR  32           2HD      TYR  32  -2.219  -6.745   3.373
  237    HD2  TYR  32           1HD      TYR  32  -5.616  -4.465   4.537
  238    HE1  TYR  32           2HE      TYR  32  -3.673  -8.333   2.194
  239    HE2  TYR  32           1HE      TYR  32  -7.090  -6.040   3.375
  240    HH   TYR  32           HH       TYR  32  -6.553  -8.881   2.661
  241    HB2  TYR  32           2HB      TYR  32  -2.310  -5.091   5.453
  242    HB3  TYR  32           1HB      TYR  32  -3.546  -3.847   5.331
  243    H    VAL  33           H        VAL  33  -2.835  -1.356   4.265
  244    HA   VAL  33           HA       VAL  33  -0.420  -0.283   5.413
  245    HB   VAL  33           HB       VAL  33  -3.155   0.939   4.996
  246   HG11  VAL  33          1HG1      VAL  33  -2.071   1.950   6.953
  247   HG12  VAL  33          2HG1      VAL  33  -2.177   3.082   5.606
  248   HG13  VAL  33          3HG1      VAL  33  -0.644   2.296   5.978
  249   HG21  VAL  33          3HG2      VAL  33  -0.788   0.638   3.357
  250   HG22  VAL  33          1HG2      VAL  33  -1.240   2.332   3.546
  251   HG23  VAL  33          2HG2      VAL  33  -2.407   1.173   2.911
  252    H    THR  34           H        THR  34   0.085  -0.291   7.510
  253    HA   THR  34           HA       THR  34  -1.912  -1.244   9.417
  254    HB   THR  34           HB       THR  34  -0.126  -1.901  10.816
  255    HG1  THR  34           1HG      THR  34   1.654  -0.820  10.919
  256   HG21  THR  34          3HG2      THR  34   0.409  -3.598   9.516
  257   HG22  THR  34          1HG2      THR  34   1.580  -2.583   8.677
  258   HG23  THR  34          2HG2      THR  34  -0.079  -2.687   8.090
  259    H    LYS  35           H        LYS  35  -0.064   1.670   8.762
  260    HA   LYS  35           HA       LYS  35  -1.624   3.134  10.695
  261    HB2  LYS  35           2HB      LYS  35   1.294   2.586  11.183
  262    HB3  LYS  35           1HB      LYS  35   0.532   4.042  11.800
  263    HG2  LYS  35           2HG      LYS  35  -1.205   2.246  12.729
  264    HG3  LYS  35           1HG      LYS  35   0.239   1.233  12.660
  265    HD2  LYS  35           2HD      LYS  35   1.414   3.139  13.897
  266    HD3  LYS  35           1HD      LYS  35  -0.204   3.767  14.216
  267    HE2  LYS  35           2HE      LYS  35  -0.470   2.336  15.895
  268    HE3  LYS  35           1HE      LYS  35  -0.130   0.972  14.830
  269    HZ1  LYS  35           3HZ      LYS  35   1.920   2.614  16.221
  270    HZ2  LYS  35           1HZ      LYS  35   2.223   1.270  15.238
  271    HZ3  LYS  35           2HZ      LYS  35   1.405   1.077  16.706
  272    H    ILE  36           H        ILE  36  -2.033   5.071   9.811
  273    HA   ILE  36           HA       ILE  36  -0.175   6.088   7.781
  274    HB   ILE  36           HB       ILE  36  -2.985   7.043   8.342
  275   HG12  ILE  36          2HG1      ILE  36  -1.906   4.891   6.551
  276   HG13  ILE  36          1HG1      ILE  36  -3.346   4.876   7.563
  277   HG21  ILE  36          1HG2      ILE  36  -2.822   8.317   6.384
  278   HG22  ILE  36          2HG2      ILE  36  -1.388   7.453   5.832
  279   HG23  ILE  36          3HG2      ILE  36  -1.276   8.567   7.194
  280   HD11  ILE  36          3HD1      ILE  36  -4.215   4.971   5.433
  281   HD12  ILE  36          1HD1      ILE  36  -2.951   6.054   4.850
  282   HD13  ILE  36          2HD1      ILE  36  -4.218   6.669   5.912
  283    H    ILE  37           H        ILE  37   1.168   7.697   8.294
  284    HA   ILE  37           HA       ILE  37   1.017   9.049  10.816
  285    HB   ILE  37           HB       ILE  37   2.880   9.307   8.455
  286   HG12  ILE  37          2HG1      ILE  37   4.499   8.591  10.372
  287   HG13  ILE  37          1HG1      ILE  37   3.027   8.080  11.191
  288   HG21  ILE  37          1HG2      ILE  37   2.874  11.500   9.282
  289   HG22  ILE  37          2HG2      ILE  37   4.273  10.738  10.035
  290   HG23  ILE  37          3HG2      ILE  37   2.788  10.961  10.959
  291   HD11  ILE  37          3HD1      ILE  37   3.726   7.156   8.425
  292   HD12  ILE  37          1HD1      ILE  37   2.561   6.465   9.555
  293   HD13  ILE  37          2HD1      ILE  37   4.289   6.328   9.876
  294    H    GLU  38           H        GLU  38   0.684  11.262  11.197
  295    HA   GLU  38           HA       GLU  38  -1.328  12.505   9.672
  296    HB2  GLU  38           2HB      GLU  38   0.443  13.390  11.921
  297    HB3  GLU  38           1HB      GLU  38  -0.542  14.579  11.080
  298    HG2  GLU  38           2HG      GLU  38  -1.763  13.880  12.978
  299    HG3  GLU  38           1HG      GLU  38  -2.536  13.149  11.571
  300    H    GLY  39           H        GLY  39  -1.298  14.302   8.312
  301    HA2  GLY  39           2HA      GLY  39  -0.514  15.645   6.633
  302    HA3  GLY  39           1HA      GLY  39   0.949  15.801   7.588
  303    H    GLY  40           H        GLY  40   0.131  12.579   6.667
  304    HA2  GLY  40           2HA      GLY  40   2.462  12.487   4.931
  305    HA3  GLY  40           1HA      GLY  40   1.532  11.113   5.507
  306    H    ALA  41           H        ALA  41   2.361  11.192   2.911
  307    HA   ALA  41           HA       ALA  41   0.850  12.342   0.951
  308    HB1  ALA  41           3HB      ALA  41   1.708   9.460   0.836
  309    HB2  ALA  41           1HB      ALA  41   2.827  10.813   0.666
  310    HB3  ALA  41           2HB      ALA  41   1.526  10.596  -0.501
  311    H    ALA  42           H        ALA  42   0.112   9.145   2.404
  312    HA   ALA  42           HA       ALA  42  -2.398   8.900   1.102
  313    HB1  ALA  42           3HB      ALA  42  -1.208   7.468   3.467
  314    HB2  ALA  42           1HB      ALA  42  -1.327   6.903   1.801
  315    HB3  ALA  42           2HB      ALA  42  -2.783   7.064   2.783
  316    H    HIS  43           H        HIS  43  -1.520   9.752   4.448
  317    HA   HIS  43           HA       HIS  43  -4.003  10.086   5.570
  318    HD1  HIS  43           1HD      HIS  43  -3.015  13.839   6.824
  319    HD2  HIS  43           2HD      HIS  43  -3.624  10.322   8.952
  320    HE1  HIS  43           1HE      HIS  43  -4.244  14.521   8.906
  321    HE2  HIS  43           2HE      HIS  43  -4.529  12.389  10.220
  322    HB2  HIS  43           2HB      HIS  43  -1.873  10.271   6.797
  323    HB3  HIS  43           1HB      HIS  43  -1.568  11.822   6.030
  324    H    LYS  44           H        LYS  44  -2.171  12.501   3.704
  325    HA   LYS  44           HA       LYS  44  -4.193  14.512   3.930
  326    HB2  LYS  44           2HB      LYS  44  -1.738  14.264   2.198
  327    HB3  LYS  44           1HB      LYS  44  -2.813  15.654   2.135
  328    HG2  LYS  44           2HG      LYS  44  -2.384  16.071   4.520
  329    HG3  LYS  44           1HG      LYS  44  -1.261  14.710   4.536
  330    HD2  LYS  44           2HD      LYS  44   0.349  15.848   3.413
  331    HD3  LYS  44           1HD      LYS  44  -0.816  16.766   2.457
  332    HE2  LYS  44           2HE      LYS  44  -0.758  18.487   3.875
  333    HE3  LYS  44           1HE      LYS  44  -0.961  17.435   5.274
  334    HZ1  LYS  44           3HZ      LYS  44   1.601  18.008   3.883
  335    HZ2  LYS  44           1HZ      LYS  44   1.419  16.964   5.202
  336    HZ3  LYS  44           2HZ      LYS  44   1.128  18.620   5.386
  337    H    ASP  45           H        ASP  45  -3.358  12.075   1.514
  338    HA   ASP  45           HA       ASP  45  -4.978  13.029  -0.583
  339    HB2  ASP  45           2HB      ASP  45  -3.158  11.185  -0.611
  340    HB3  ASP  45           1HB      ASP  45  -4.453  10.102  -0.117
  341    H    GLY  46           H        GLY  46  -5.622  10.525   1.870
  342    HA2  GLY  46           2HA      GLY  46  -7.691  10.256   2.993
  343    HA3  GLY  46           1HA      GLY  46  -8.476  11.168   1.715
  344    H    LYS  47           H        LYS  47  -7.204   9.575  -0.427
  345    HA   LYS  47           HA       LYS  47  -9.190   7.668  -0.834
  346    HB2  LYS  47           2HB      LYS  47  -7.608   8.686  -2.549
  347    HB3  LYS  47           1HB      LYS  47  -6.423   7.499  -2.023
  348    HG2  LYS  47           2HG      LYS  47  -7.705   5.704  -2.824
  349    HG3  LYS  47           1HG      LYS  47  -9.152   6.702  -2.985
  350    HD2  LYS  47           2HD      LYS  47  -6.876   7.686  -4.532
  351    HD3  LYS  47           1HD      LYS  47  -7.405   6.073  -5.010
  352    HE2  LYS  47           2HE      LYS  47  -9.694   6.907  -5.271
  353    HE3  LYS  47           1HE      LYS  47  -9.160   8.518  -4.798
  354    HZ1  LYS  47           3HZ      LYS  47  -9.371   8.103  -7.252
  355    HZ2  LYS  47           1HZ      LYS  47  -8.026   7.083  -7.129
  356    HZ3  LYS  47           2HZ      LYS  47  -7.880   8.725  -6.747
  357    H    LEU  48           H        LEU  48  -5.830   7.168   0.261
  358    HA   LEU  48           HA       LEU  48  -6.329   4.372   0.785
  359    HG   LEU  48           HG       LEU  48  -4.414   3.033   0.829
  360    HB2  LEU  48           2HB      LEU  48  -4.110   5.474   0.018
  361    HB3  LEU  48           1HB      LEU  48  -3.897   5.861   1.715
  362   HD11  LEU  48          1HD1      LEU  48  -2.470   3.937  -0.426
  363   HD12  LEU  48          2HD1      LEU  48  -2.056   2.633   0.686
  364   HD13  LEU  48          3HD1      LEU  48  -1.697   4.306   1.117
  365   HD21  LEU  48          3HD2      LEU  48  -4.079   2.508   2.959
  366   HD22  LEU  48          1HD2      LEU  48  -4.233   4.228   3.309
  367   HD23  LEU  48          2HD2      LEU  48  -2.637   3.519   3.071
  368    H    GLN  49           H        GLN  49  -7.214   3.619   2.552
  369    HA   GLN  49           HA       GLN  49  -6.815   5.001   5.107
  370    HB2  GLN  49           2HB      GLN  49  -9.087   4.800   5.705
  371    HB3  GLN  49           1HB      GLN  49  -9.096   5.442   4.074
  372    HG2  GLN  49           2HG      GLN  49  -9.423   2.515   4.660
  373    HG3  GLN  49           1HG      GLN  49 -10.783   3.635   4.615
  374   HE21  GLN  49          1HE2      GLN  49  -8.692   1.679   2.805
  375   HE22  GLN  49          2HE2      GLN  49  -9.221   2.151   1.229
  376    H    ILE  50           H        ILE  50  -6.724   3.648   6.934
  377    HA   ILE  50           HA       ILE  50  -5.417   1.282   6.805
  378    HB   ILE  50           HB       ILE  50  -6.437   0.682   9.033
  379   HG12  ILE  50          2HG1      ILE  50  -7.638   3.321   9.388
  380   HG13  ILE  50          1HG1      ILE  50  -8.496   2.350   8.198
  381   HG21  ILE  50          1HG2      ILE  50  -5.159   2.247  10.177
  382   HG22  ILE  50          2HG2      ILE  50  -5.531   3.536   9.031
  383   HG23  ILE  50          3HG2      ILE  50  -4.435   2.232   8.569
  384   HD11  ILE  50          3HD1      ILE  50  -7.913   1.594  11.049
  385   HD12  ILE  50          1HD1      ILE  50  -8.684   0.542   9.862
  386   HD13  ILE  50          2HD1      ILE  50  -9.477   2.035  10.365
  387    H    GLY  51           H        GLY  51  -5.849  -0.890   6.553
  388    HA2  GLY  51           2HA      GLY  51  -7.293  -2.775   6.544
  389    HA3  GLY  51           1HA      GLY  51  -8.649  -1.714   6.233
  390    H    ASP  52           H        ASP  52  -6.846  -0.376   4.038
  391    HA   ASP  52           HA       ASP  52  -7.870  -1.998   1.950
  392    HB2  ASP  52           2HB      ASP  52  -6.594  -0.375   0.461
  393    HB3  ASP  52           1HB      ASP  52  -7.854   0.304   1.478
  394    H    LYS  53           H        LYS  53  -6.694  -3.015   0.271
  395    HA   LYS  53           HA       LYS  53  -4.076  -4.015   1.163
  396    HB2  LYS  53           2HB      LYS  53  -4.533  -5.987  -0.278
  397    HB3  LYS  53           1HB      LYS  53  -5.676  -5.804   1.040
  398    HG2  LYS  53           2HG      LYS  53  -6.551  -4.497  -1.405
  399    HG3  LYS  53           1HG      LYS  53  -6.307  -6.235  -1.587
  400    HD2  LYS  53           2HD      LYS  53  -7.623  -5.931   0.859
  401    HD3  LYS  53           1HD      LYS  53  -8.424  -4.807  -0.239
  402    HE2  LYS  53           2HE      LYS  53  -9.586  -6.849  -0.449
  403    HE3  LYS  53           1HE      LYS  53  -8.571  -6.724  -1.884
  404    HZ1  LYS  53           3HZ      LYS  53  -7.861  -8.278   0.545
  405    HZ2  LYS  53           1HZ      LYS  53  -7.004  -8.237  -0.915
  406    HZ3  LYS  53           2HZ      LYS  53  -8.539  -8.944  -0.854
  407    H    LEU  54           H        LEU  54  -2.440  -4.209  -0.283
  408    HA   LEU  54           HA       LEU  54  -2.562  -2.302  -2.491
  409    HG   LEU  54           HG       LEU  54  -1.381  -1.009  -0.899
  410    HB2  LEU  54           2HB      LEU  54  -0.421  -3.491  -0.865
  411    HB3  LEU  54           1HB      LEU  54   0.006  -3.088  -2.512
  412   HD11  LEU  54          1HD1      LEU  54   0.630  -2.227   0.365
  413   HD12  LEU  54          2HD1      LEU  54   0.338  -0.492   0.478
  414   HD13  LEU  54          3HD1      LEU  54   1.562  -1.110  -0.631
  415   HD21  LEU  54          3HD2      LEU  54   0.692  -1.096  -3.068
  416   HD22  LEU  54          1HD2      LEU  54   0.352   0.376  -2.159
  417   HD23  LEU  54          2HD2      LEU  54  -0.922  -0.388  -3.111
  418    H    LEU  55           H        LEU  55  -3.143  -2.967  -4.412
  419    HA   LEU  55           HA       LEU  55  -2.953  -5.692  -5.255
  420    HG   LEU  55           HG       LEU  55  -3.400  -5.916  -7.723
  421    HB2  LEU  55           2HB      LEU  55  -4.801  -4.207  -5.946
  422    HB3  LEU  55           1HB      LEU  55  -3.660  -3.208  -6.824
  423   HD11  LEU  55          1HD1      LEU  55  -5.653  -6.293  -6.959
  424   HD12  LEU  55          2HD1      LEU  55  -5.644  -6.179  -8.719
  425   HD13  LEU  55          3HD1      LEU  55  -6.205  -4.817  -7.750
  426   HD21  LEU  55          3HD2      LEU  55  -2.791  -4.524  -9.371
  427   HD22  LEU  55          1HD2      LEU  55  -3.828  -3.221  -8.789
  428   HD23  LEU  55          2HD2      LEU  55  -4.508  -4.514  -9.777
  429    H    ALA  56           H        ALA  56  -1.432  -2.611  -6.308
  430    HA   ALA  56           HA       ALA  56   1.036  -4.039  -6.859
  431    HB1  ALA  56           3HB      ALA  56  -0.603  -2.884  -9.125
  432    HB2  ALA  56           1HB      ALA  56  -0.064  -4.552  -8.929
  433    HB3  ALA  56           2HB      ALA  56   1.109  -3.277  -9.270
  434    H    VAL  57           H        VAL  57   2.818  -2.584  -7.456
  435    HA   VAL  57           HA       VAL  57   2.295   0.279  -7.170
  436    HB   VAL  57           HB       VAL  57   4.389   0.318  -5.581
  437   HG11  VAL  57          1HG1      VAL  57   1.601  -0.373  -4.666
  438   HG12  VAL  57          2HG1      VAL  57   2.243   1.237  -4.988
  439   HG13  VAL  57          3HG1      VAL  57   2.867   0.294  -3.634
  440   HG21  VAL  57          3HG2      VAL  57   4.503  -1.538  -4.047
  441   HG22  VAL  57          1HG2      VAL  57   4.746  -2.127  -5.691
  442   HG23  VAL  57          2HG2      VAL  57   3.192  -2.362  -4.891
  443    H    ASN  58           H        ASN  58   3.237   1.182  -8.854
  444    HA   ASN  58           HA       ASN  58   4.768   1.781 -10.421
  445    HB2  ASN  58           2HB      ASN  58   6.552   0.504  -8.374
  446    HB3  ASN  58           1HB      ASN  58   7.217   0.990  -9.930
  447   HD21  ASN  58          1HD2      ASN  58   5.558   2.139  -7.051
  448   HD22  ASN  58          2HD2      ASN  58   6.070   3.782  -7.191
  449    H    ASN  59           H        ASN  59   3.197  -0.420 -10.931
  450    HA   ASN  59           HA       ASN  59   2.970  -1.861 -12.703
  451    HB2  ASN  59           2HB      ASN  59   5.095  -0.671 -13.596
  452    HB3  ASN  59           1HB      ASN  59   5.941  -2.111 -13.038
  453   HD21  ASN  59          1HD2      ASN  59   5.957  -3.862 -14.301
  454   HD22  ASN  59          2HD2      ASN  59   5.028  -4.051 -15.746
  455    H    VAL  60           H        VAL  60   4.895  -2.509  -9.913
  456    HA   VAL  60           HA       VAL  60   4.904  -5.389 -10.442
  457    HB   VAL  60           HB       VAL  60   6.196  -5.649  -8.412
  458   HG11  VAL  60          1HG1      VAL  60   7.773  -5.295  -9.985
  459   HG12  VAL  60          2HG1      VAL  60   8.057  -3.822  -9.056
  460   HG13  VAL  60          3HG1      VAL  60   7.061  -3.769 -10.511
  461   HG21  VAL  60          3HG2      VAL  60   6.286  -4.191  -6.735
  462   HG22  VAL  60          1HG2      VAL  60   4.994  -3.320  -7.557
  463   HG23  VAL  60          2HG2      VAL  60   6.673  -2.851  -7.813
  464    H    CYS  61           H        CYS  61   3.789  -6.900  -9.152
  465    HA   CYS  61           HA       CYS  61   1.383  -5.846  -7.935
  466    HG   CYS  61           HG       CYS  61   2.342 -10.023  -8.881
  467    HB2  CYS  61           2HB      CYS  61   0.788  -8.243  -7.609
  468    HB3  CYS  61           1HB      CYS  61   1.115  -7.813  -9.282
  469    H    LEU  62           H        LEU  62   0.922  -5.736  -5.797
  470    HA   LEU  62           HA       LEU  62   3.088  -6.439  -3.954
  471    HG   LEU  62           HG       LEU  62   3.169  -4.843  -1.803
  472    HB2  LEU  62           2HB      LEU  62   1.672  -4.079  -4.309
  473    HB3  LEU  62           1HB      LEU  62   0.983  -4.771  -2.858
  474   HD11  LEU  62          1HD1      LEU  62   4.775  -5.275  -3.364
  475   HD12  LEU  62          2HD1      LEU  62   5.008  -3.540  -3.146
  476   HD13  LEU  62          3HD1      LEU  62   4.100  -4.140  -4.534
  477   HD21  LEU  62          3HD2      LEU  62   2.076  -2.331  -2.892
  478   HD22  LEU  62          1HD2      LEU  62   3.700  -2.251  -2.210
  479   HD23  LEU  62          2HD2      LEU  62   2.355  -2.821  -1.222
  480    H    GLU  63           H        GLU  63   1.027  -8.335  -4.984
  481    HA   GLU  63           HA       GLU  63  -0.353  -8.953  -2.458
  482    HB2  GLU  63           2HB      GLU  63  -1.063  -9.530  -5.320
  483    HB3  GLU  63           1HB      GLU  63  -1.807 -10.410  -3.992
  484    HG2  GLU  63           2HG      GLU  63  -2.770  -8.427  -3.107
  485    HG3  GLU  63           1HG      GLU  63  -1.839  -7.413  -4.207
  486    H    GLU  64           H        GLU  64   2.000 -10.157  -4.711
  487    HA   GLU  64           HA       GLU  64   2.061 -12.690  -3.215
  488    HB2  GLU  64           2HB      GLU  64   3.233 -13.488  -5.464
  489    HB3  GLU  64           1HB      GLU  64   1.490 -13.542  -5.247
  490    HG2  GLU  64           2HG      GLU  64   1.220 -11.495  -6.464
  491    HG3  GLU  64           1HG      GLU  64   2.967 -11.285  -6.573
  492    H    VAL  65           H        VAL  65   3.440 -10.726  -2.118
  493    HA   VAL  65           HA       VAL  65   6.221 -11.518  -2.598
  494    HB   VAL  65           HB       VAL  65   6.993  -9.156  -2.316
  495   HG11  VAL  65          1HG1      VAL  65   5.327  -9.768  -4.760
  496   HG12  VAL  65          2HG1      VAL  65   7.013 -10.213  -4.498
  497   HG13  VAL  65          3HG1      VAL  65   6.564  -8.515  -4.658
  498   HG21  VAL  65          3HG2      VAL  65   5.378  -7.795  -1.515
  499   HG22  VAL  65          1HG2      VAL  65   4.074  -8.700  -2.285
  500   HG23  VAL  65          2HG2      VAL  65   5.031  -7.559  -3.228
  501    H    THR  66           H        THR  66   7.662 -11.129  -0.877
  502    HA   THR  66           HA       THR  66   6.532 -11.509   1.710
  503    HB   THR  66           HB       THR  66   8.900 -11.310   2.500
  504    HG1  THR  66           1HG      THR  66   9.954  -9.994   1.188
  505   HG21  THR  66          3HG2      THR  66   8.998 -13.468   2.052
  506   HG22  THR  66          1HG2      THR  66   9.624 -13.069   0.453
  507   HG23  THR  66          2HG2      THR  66   7.890 -13.284   0.692
  508    H    HIS  67           H        HIS  67   7.658 -10.005   3.553
  509    HA   HIS  67           HA       HIS  67   6.358  -7.507   3.245
  510    HD1  HIS  67           1HD      HIS  67   5.060  -6.833   6.190
  511    HD2  HIS  67           2HD      HIS  67   8.849  -5.305   5.491
  512    HE1  HIS  67           1HE      HIS  67   4.966  -4.437   6.917
  513    HE2  HIS  67           2HE      HIS  67   7.207  -3.491   6.301
  514    HB2  HIS  67           2HB      HIS  67   6.671  -8.587   5.452
  515    HB3  HIS  67           1HB      HIS  67   8.378  -8.175   5.401
  516    H    GLU  68           H        GLU  68   9.780  -8.431   3.040
  517    HA   GLU  68           HA       GLU  68  10.974  -5.972   2.870
  518    HB2  GLU  68           2HB      GLU  68  11.615  -8.425   1.217
  519    HB3  GLU  68           1HB      GLU  68  12.676  -7.038   1.408
  520    HG2  GLU  68           2HG      GLU  68  12.382  -7.571   3.963
  521    HG3  GLU  68           1HG      GLU  68  11.973  -9.174   3.353
  522    H    GLU  69           H        GLU  69   9.675  -7.827   0.105
  523    HA   GLU  69           HA       GLU  69  10.075  -5.857  -1.843
  524    HB2  GLU  69           2HB      GLU  69   9.163  -8.405  -1.913
  525    HB3  GLU  69           1HB      GLU  69   7.659  -7.532  -2.162
  526    HG2  GLU  69           2HG      GLU  69  10.150  -7.184  -3.813
  527    HG3  GLU  69           1HG      GLU  69   8.758  -8.168  -4.262
  528    H    ALA  70           H        ALA  70   7.489  -6.255   0.507
  529    HA   ALA  70           HA       ALA  70   5.608  -4.465  -0.612
  530    HB1  ALA  70           3HB      ALA  70   6.008  -4.966   2.330
  531    HB2  ALA  70           1HB      ALA  70   5.234  -6.129   1.257
  532    HB3  ALA  70           2HB      ALA  70   4.522  -4.533   1.491
  533    H    VAL  71           H        VAL  71   8.248  -4.022   1.704
  534    HA   VAL  71           HA       VAL  71   7.763  -1.200   2.018
  535    HB   VAL  71           HB       VAL  71   9.976  -3.021   2.957
  536   HG11  VAL  71          1HG1      VAL  71  11.242  -1.119   2.764
  537   HG12  VAL  71          2HG1      VAL  71  10.559  -0.887   4.373
  538   HG13  VAL  71          3HG1      VAL  71   9.862  -0.044   2.989
  539   HG21  VAL  71          3HG2      VAL  71   9.003  -2.916   5.037
  540   HG22  VAL  71          1HG2      VAL  71   7.584  -2.856   3.993
  541   HG23  VAL  71          2HG2      VAL  71   8.213  -1.374   4.710
  542    H    THR  72           H        THR  72  10.062  -3.216   0.234
  543    HA   THR  72           HA       THR  72  11.709  -1.138  -0.707
  544    HB   THR  72           HB       THR  72  11.150  -3.834  -1.962
  545    HG1  THR  72           1HG      THR  72  13.135  -2.997  -0.115
  546   HG21  THR  72          3HG2      THR  72  12.269  -2.486  -3.589
  547   HG22  THR  72          1HG2      THR  72  13.443  -3.605  -2.894
  548   HG23  THR  72          2HG2      THR  72  13.429  -1.916  -2.390
  549    H    ALA  73           H        ALA  73   8.692  -2.497  -1.925
  550    HA   ALA  73           HA       ALA  73   8.781  -1.191  -4.458
  551    HB1  ALA  73           3HB      ALA  73   7.464  -3.251  -3.993
  552    HB2  ALA  73           1HB      ALA  73   6.529  -1.961  -4.747
  553    HB3  ALA  73           2HB      ALA  73   6.364  -2.275  -3.021
  554    H    LEU  74           H        LEU  74   7.372  -0.460  -1.286
  555    HA   LEU  74           HA       LEU  74   5.979   1.888  -2.155
  556    HG   LEU  74           HG       LEU  74   4.405   0.661   0.964
  557    HB2  LEU  74           2HB      LEU  74   6.691   0.644   0.467
  558    HB3  LEU  74           1HB      LEU  74   6.214   2.329   0.449
  559   HD11  LEU  74          1HD1      LEU  74   2.718   1.827  -0.380
  560   HD12  LEU  74          2HD1      LEU  74   4.000   2.504  -1.384
  561   HD13  LEU  74          3HD1      LEU  74   3.891   2.940   0.321
  562   HD21  LEU  74          3HD2      LEU  74   4.036   0.161  -1.922
  563   HD22  LEU  74          1HD2      LEU  74   3.652  -0.854  -0.532
  564   HD23  LEU  74          2HD2      LEU  74   5.311  -0.752  -1.115
  565    H    LYS  75           H        LYS  75   9.130   1.117  -0.826
  566    HA   LYS  75           HA       LYS  75   9.958   3.821  -0.393
  567    HB2  LYS  75           2HB      LYS  75  11.277   2.547   0.918
  568    HB3  LYS  75           1HB      LYS  75  11.099   1.135  -0.107
  569    HG2  LYS  75           2HG      LYS  75  12.744   2.390  -1.681
  570    HG3  LYS  75           1HG      LYS  75  13.132   3.315  -0.229
  571    HD2  LYS  75           2HD      LYS  75  13.220   0.305  -0.421
  572    HD3  LYS  75           1HD      LYS  75  14.623   1.359  -0.607
  573    HE2  LYS  75           2HE      LYS  75  12.896   1.484   1.843
  574    HE3  LYS  75           1HE      LYS  75  14.183   0.289   1.695
  575    HZ1  LYS  75           3HZ      LYS  75  15.724   2.175   1.269
  576    HZ2  LYS  75           1HZ      LYS  75  15.052   2.174   2.821
  577    HZ3  LYS  75           2HZ      LYS  75  14.468   3.242   1.646
  578    H    ASN  76           H        ASN  76  10.066   1.655  -3.138
  579    HA   ASN  76           HA       ASN  76  12.095   3.025  -4.588
  580    HB2  ASN  76           2HB      ASN  76  11.310   0.634  -4.940
  581    HB3  ASN  76           1HB      ASN  76   9.920   1.308  -5.786
  582   HD21  ASN  76          1HD2      ASN  76  10.122   1.786  -7.880
  583   HD22  ASN  76          2HD2      ASN  76  11.607   1.781  -8.763
  584    H    THR  77           H        THR  77  11.118   5.204  -4.065
  585    HA   THR  77           HA       THR  77   9.309   6.011  -6.246
  586    HB   THR  77           HB       THR  77   8.533   7.837  -4.643
  587    HG1  THR  77           1HG      THR  77  10.244   7.477  -3.105
  588   HG21  THR  77          3HG2      THR  77   7.234   5.738  -5.172
  589   HG22  THR  77          1HG2      THR  77   6.849   6.545  -3.653
  590   HG23  THR  77          2HG2      THR  77   7.850   5.093  -3.651
  591    H    SER  78           H        SER  78   9.875   7.756  -7.422
  592    HA   SER  78           HA       SER  78  12.340   9.178  -6.643
  593    HG   SER  78           HG       SER  78  12.789   6.841  -8.595
  594    HB2  SER  78           2HB      SER  78  11.373   8.277  -9.352
  595    HB3  SER  78           1HB      SER  78  12.562   9.568  -9.185
  596    H    ASP  79           H        ASP  79  10.036   9.893  -9.250
  597    HA   ASP  79           HA       ASP  79   9.703  12.583  -8.137
  598    HB2  ASP  79           2HB      ASP  79  10.387  12.377 -10.510
  599    HB3  ASP  79           1HB      ASP  79   8.901  11.495 -10.851
  600    H    PHE  80           H        PHE  80   7.778   9.891  -9.424
  601    HA   PHE  80           HA       PHE  80   5.548  10.735  -7.709
  602    HD1  PHE  80           1HD      PHE  80   5.004  13.045  -9.993
  603    HD2  PHE  80           2HD      PHE  80   2.477   9.823  -8.829
  604    HE1  PHE  80           1HE      PHE  80   3.204  14.642  -9.494
  605    HE2  PHE  80           2HE      PHE  80   0.672  11.418  -8.329
  606    HZ   PHE  80           HZ       PHE  80   1.038  13.829  -8.657
  607    HB2  PHE  80           2HB      PHE  80   5.550  10.750 -10.550
  608    HB3  PHE  80           1HB      PHE  80   4.515   9.421 -10.035
  609    H    VAL  81           H        VAL  81   3.878   8.849  -7.517
  610    HA   VAL  81           HA       VAL  81   5.141   6.240  -7.713
  611    HB   VAL  81           HB       VAL  81   5.735   6.925  -5.459
  612   HG11  VAL  81          1HG1      VAL  81   4.439   8.334  -4.345
  613   HG12  VAL  81          2HG1      VAL  81   3.326   6.998  -4.050
  614   HG13  VAL  81          3HG1      VAL  81   3.091   8.050  -5.444
  615   HG21  VAL  81          3HG2      VAL  81   5.357   4.624  -5.574
  616   HG22  VAL  81          1HG2      VAL  81   3.610   4.821  -5.708
  617   HG23  VAL  81          2HG2      VAL  81   4.419   5.139  -4.174
  618    H    TYR  82           H        TYR  82   3.737   4.944  -8.678
  619    HA   TYR  82           HA       TYR  82   0.890   5.637  -8.591
  620    HD1  TYR  82           2HD      TYR  82  -0.228   6.115 -11.368
  621    HD2  TYR  82           1HD      TYR  82   0.371   2.040 -10.288
  622    HE1  TYR  82           2HE      TYR  82  -2.451   5.559 -12.244
  623    HE2  TYR  82           1HE      TYR  82  -1.846   1.478 -11.167
  624    HH   TYR  82           HH       TYR  82  -4.143   3.037 -11.522
  625    HB2  TYR  82           2HB      TYR  82   2.015   5.251 -10.806
  626    HB3  TYR  82           1HB      TYR  82   2.222   3.566 -10.338
  627    H    LEU  83           H        LEU  83   0.082   4.880  -6.770
  628    HA   LEU  83           HA       LEU  83   0.662   2.169  -5.884
  629    HG   LEU  83           HG       LEU  83   0.025   1.606  -3.728
  630    HB2  LEU  83           2HB      LEU  83   0.629   4.219  -4.368
  631    HB3  LEU  83           1HB      LEU  83  -1.116   4.177  -4.523
  632   HD11  LEU  83          1HD1      LEU  83   1.640   2.952  -2.569
  633   HD12  LEU  83          2HD1      LEU  83   0.473   2.333  -1.401
  634   HD13  LEU  83          3HD1      LEU  83   0.373   4.008  -1.943
  635   HD21  LEU  83          3HD2      LEU  83  -2.106   3.408  -2.585
  636   HD22  LEU  83          1HD2      LEU  83  -1.775   1.756  -2.061
  637   HD23  LEU  83          2HD2      LEU  83  -2.355   2.063  -3.698
  638    H    LYS  84           H        LYS  84  -0.611   0.504  -6.256
  639    HA   LYS  84           HA       LYS  84  -3.378   0.980  -7.124
  640    HB2  LYS  84           2HB      LYS  84  -1.312  -0.944  -8.015
  641    HB3  LYS  84           1HB      LYS  84  -2.958  -1.545  -7.927
  642    HG2  LYS  84           2HG      LYS  84  -2.618   1.047  -9.282
  643    HG3  LYS  84           1HG      LYS  84  -1.909  -0.352 -10.091
  644    HD2  LYS  84           2HD      LYS  84  -4.070  -0.267 -10.957
  645    HD3  LYS  84           1HD      LYS  84  -4.191  -1.477  -9.678
  646    HE2  LYS  84           2HE      LYS  84  -4.797   0.701  -8.254
  647    HE3  LYS  84           1HE      LYS  84  -5.339   1.251  -9.839
  648    HZ1  LYS  84           3HZ      LYS  84  -6.202  -1.269  -8.526
  649    HZ2  LYS  84           1HZ      LYS  84  -6.766  -0.667 -10.005
  650    HZ3  LYS  84           2HZ      LYS  84  -7.104   0.160  -8.569
  651    H    VAL  85           H        VAL  85  -4.963   0.287  -5.838
  652    HA   VAL  85           HA       VAL  85  -4.268  -1.706  -3.787
  653    HB   VAL  85           HB       VAL  85  -6.129  -0.630  -2.417
  654   HG11  VAL  85          1HG1      VAL  85  -4.556   0.467  -1.245
  655   HG12  VAL  85          2HG1      VAL  85  -4.034   1.419  -2.634
  656   HG13  VAL  85          3HG1      VAL  85  -3.454  -0.234  -2.431
  657   HG21  VAL  85          3HG2      VAL  85  -6.600   1.730  -2.878
  658   HG22  VAL  85          1HG2      VAL  85  -7.153   0.690  -4.190
  659   HG23  VAL  85          2HG2      VAL  85  -5.668   1.622  -4.370
  660    H    ALA  86           H        ALA  86  -5.537  -3.453  -3.581
  661    HA   ALA  86           HA       ALA  86  -7.660  -3.830  -5.528
  662    HB1  ALA  86           3HB      ALA  86  -5.774  -5.516  -4.734
  663    HB2  ALA  86           1HB      ALA  86  -7.362  -6.073  -5.260
  664    HB3  ALA  86           2HB      ALA  86  -7.001  -5.934  -3.540
  665    H    LYS  87           H        LYS  87  -9.787  -4.512  -4.988
  666    HA   LYS  87           HA       LYS  87 -10.664  -3.576  -2.340
  667    HB2  LYS  87           2HB      LYS  87 -11.957  -3.552  -5.043
  668    HB3  LYS  87           1HB      LYS  87 -12.960  -3.543  -3.599
  669    HG2  LYS  87           2HG      LYS  87 -10.911  -1.580  -3.308
  670    HG3  LYS  87           1HG      LYS  87 -11.704  -1.364  -4.870
  671    HD2  LYS  87           2HD      LYS  87 -13.509  -1.868  -2.596
  672    HD3  LYS  87           1HD      LYS  87 -12.623  -0.342  -2.534
  673    HE2  LYS  87           2HE      LYS  87 -13.606   0.458  -4.468
  674    HE3  LYS  87           1HE      LYS  87 -14.000  -1.155  -5.059
  675    HZ1  LYS  87           3HZ      LYS  87 -15.311   0.166  -2.743
  676    HZ2  LYS  87           1HZ      LYS  87 -15.728  -1.332  -3.414
  677    HZ3  LYS  87           2HZ      LYS  87 -15.958   0.088  -4.303
  678    HA   PRO  88           HA       PRO  88 -11.583  -7.821  -1.365
  679    HB2  PRO  88           2HB      PRO  88 -13.228  -7.306   0.776
  680    HB3  PRO  88           1HB      PRO  88 -11.465  -7.309   0.857
  681    HG2  PRO  88           2HG      PRO  88 -13.346  -5.001   0.609
  682    HG3  PRO  88           1HG      PRO  88 -11.873  -5.148   1.585
  683    HD2  PRO  88           2HD      PRO  88 -11.915  -3.796  -0.743
  684    HD3  PRO  88           1HD      PRO  88 -10.488  -4.709  -0.212
  685    H    THR  89           H        THR  89 -13.139  -9.228  -2.019
  686    HA   THR  89           HA       THR  89 -15.921  -8.476  -2.127
  687    HB   THR  89           HB       THR  89 -14.554  -9.230  -4.720
  688    HG1  THR  89           1HG      THR  89 -13.930  -7.216  -4.653
  689   HG21  THR  89          3HG2      THR  89 -16.590  -8.559  -5.795
  690   HG22  THR  89          1HG2      THR  89 -17.295  -8.087  -4.249
  691   HG23  THR  89          2HG2      THR  89 -16.949  -9.785  -4.579
  692    H    GLY  90           H        GLY  90 -16.149 -10.239  -0.693
  693    HA2  GLY  90           2HA      GLY  90 -15.250 -12.871  -1.457
  694    HA3  GLY  90           1HA      GLY  90 -16.211 -12.461  -0.045
  695    H    SER  91           H        SER  91 -16.377 -14.513  -2.339
  696    HA   SER  91           HA       SER  91 -18.843 -13.916  -3.674
  697    HG   SER  91           HG       SER  91 -19.327 -16.932  -4.612
  698    HB2  SER  91           2HB      SER  91 -16.986 -15.447  -4.533
  699    HB3  SER  91           1HB      SER  91 -17.597 -16.653  -3.403
  700    H    HIS  92           H        HIS  92 -17.908 -16.115  -1.030
  701    HA   HIS  92           HA       HIS  92 -20.653 -16.873  -0.535
  702    HD1  HIS  92           1HD      HIS  92 -21.724 -18.000   1.442
  703    HD2  HIS  92           2HD      HIS  92 -18.859 -20.734   0.178
  704    HE1  HIS  92           1HE      HIS  92 -22.839 -20.250   1.570
  705    HE2  HIS  92           2HE      HIS  92 -21.054 -21.896   0.900
  706    HB2  HIS  92           2HB      HIS  92 -18.241 -18.093  -0.059
  707    HB3  HIS  92           1HB      HIS  92 -18.672 -17.510   1.543
  708    HA   ARG 301           HA       ARG 301   2.891 -11.015  10.132
  709    HE   ARG 301           HE       ARG 301   1.824  -8.559  15.744
  710    H1   ARG 301           1HT      ARG 301   3.591 -12.159  12.749
  711    H2   ARG 301           2HT      ARG 301   4.169 -12.620  11.201
  712    H3   ARG 301           3HT      ARG 301   2.531 -12.897  11.622
  713    HB2  ARG 301           2HB      ARG 301   1.338  -9.575  11.341
  714    HB3  ARG 301           1HB      ARG 301   0.906 -11.263  11.565
  715    HG2  ARG 301           2HG      ARG 301   0.675 -10.527  13.700
  716    HG3  ARG 301           1HG      ARG 301   2.378 -10.983  13.743
  717    HD2  ARG 301           2HD      ARG 301   3.095  -8.829  13.834
  718    HD3  ARG 301           1HD      ARG 301   1.753  -8.229  12.862
  719   HH11  ARG 301          1HH1      ARG 301  -0.156  -7.967  12.914
  720   HH12  ARG 301          2HH1      ARG 301  -1.451  -7.259  13.820
  721   HH21  ARG 301          1HH2      ARG 301   0.114  -7.629  16.927
  722   HH22  ARG 301          2HH2      ARG 301  -1.298  -7.068  16.096
  723    H    ARG 302           H        ARG 302   3.554  -8.832   9.898
  724    HA   ARG 302           HA       ARG 302   5.237  -7.608  11.901
  725    HE   ARG 302           HE       ARG 302   8.144  -8.400   7.570
  726    HB2  ARG 302           2HB      ARG 302   6.898  -9.025  10.915
  727    HB3  ARG 302           1HB      ARG 302   6.378  -8.607   9.293
  728    HG2  ARG 302           2HG      ARG 302   7.153  -6.248  10.756
  729    HG3  ARG 302           1HG      ARG 302   8.445  -7.449  10.749
  730    HD2  ARG 302           2HD      ARG 302   6.982  -6.545   8.278
  731    HD3  ARG 302           1HD      ARG 302   8.490  -5.827   8.840
  732   HH11  ARG 302          1HH1      ARG 302  10.265  -6.388   9.499
  733   HH12  ARG 302          2HH1      ARG 302  11.695  -7.249   9.044
  734   HH21  ARG 302          1HH2      ARG 302  10.033  -9.526   6.973
  735   HH22  ARG 302          2HH2      ARG 302  11.564  -9.030   7.610
  736    H    GLU 303           H        GLU 303   5.115  -5.449  11.788
  737    HA   GLU 303           HA       GLU 303   4.056  -4.246   9.313
  738    HB2  GLU 303           2HB      GLU 303   3.526  -3.269  12.125
  739    HB3  GLU 303           1HB      GLU 303   2.810  -2.657  10.640
  740    HG2  GLU 303           2HG      GLU 303   1.095  -3.990  11.123
  741    HG3  GLU 303           1HG      GLU 303   2.127  -5.302  10.556
  742    H    THR 304           H        THR 304   5.267  -2.685   8.432
  743    HA   THR 304           HA       THR 304   7.174  -1.242  10.129
  744    HB   THR 304           HB       THR 304   7.790  -3.096   7.970
  745    HG1  THR 304           1HG      THR 304   9.025  -3.472   9.625
  746   HG21  THR 304          3HG2      THR 304   9.118  -0.402   7.856
  747   HG22  THR 304          1HG2      THR 304   8.100  -1.126   6.609
  748   HG23  THR 304          2HG2      THR 304   9.653  -1.855   7.013
  749    H    GLN 305           H        GLN 305   7.620   0.869   9.537
  750    HA   GLN 305           HA       GLN 305   5.620   2.160   7.932
  751    HB2  GLN 305           2HB      GLN 305   7.940   3.102   9.576
  752    HB3  GLN 305           1HB      GLN 305   7.167   4.206   8.446
  753    HG2  GLN 305           2HG      GLN 305   5.237   4.318   9.650
  754    HG3  GLN 305           1HG      GLN 305   5.438   2.707  10.337
  755   HE21  GLN 305          1HE2      GLN 305   6.432   6.060  10.547
  756   HE22  GLN 305          2HE2      GLN 305   7.036   5.978  12.163
  757    H    VAL 306           H        VAL 306   6.003   3.513   6.114
  758    HA   VAL 306           HA       VAL 306   8.516   3.109   4.669
  759    HB   VAL 306           HB       VAL 306   7.198   2.653   2.559
  760   HG11  VAL 306          1HG1      VAL 306   8.470   0.940   3.841
  761   HG12  VAL 306          2HG1      VAL 306   7.101   0.287   2.942
  762   HG13  VAL 306          3HG1      VAL 306   6.980   0.525   4.687
  763   HG21  VAL 306          3HG2      VAL 306   5.007   3.382   3.579
  764   HG22  VAL 306          1HG2      VAL 306   4.996   1.850   4.453
  765   HG23  VAL 306          2HG2      VAL 306   4.962   1.860   2.689
  Start of MODEL    6
    1    HA   MET   1           HA       MET   1  -8.925   1.790  -8.452
    2    H1   MET   1           1HT      MET   1  -8.138  -0.419  -6.668
    3    H2   MET   1           2HT      MET   1  -8.012  -0.415  -8.381
    4    H3   MET   1           3HT      MET   1  -9.553  -0.331  -7.632
    5    HB2  MET   1           2HB      MET   1  -9.060   1.286  -5.499
    6    HB3  MET   1           1HB      MET   1  -8.849   2.930  -6.087
    7    HG2  MET   1           2HG      MET   1 -11.087   1.132  -6.975
    8    HG3  MET   1           1HG      MET   1 -11.208   2.236  -5.607
    9    HE1  MET   1           3HE      MET   1 -13.472   2.912  -7.352
   10    HE2  MET   1           1HE      MET   1 -12.759   1.889  -8.598
   11    HE3  MET   1           2HE      MET   1 -13.167   3.566  -8.961
   12    H    GLU   2           H        GLU   2  -7.485   3.525  -8.559
   13    HA   GLU   2           HA       GLU   2  -4.779   3.027  -7.509
   14    HB2  GLU   2           2HB      GLU   2  -3.857   4.009  -9.582
   15    HB3  GLU   2           1HB      GLU   2  -4.757   2.530  -9.882
   16    HG2  GLU   2           2HG      GLU   2  -6.374   4.952 -10.098
   17    HG3  GLU   2           1HG      GLU   2  -5.042   4.874 -11.249
   18    H    ILE   3           H        ILE   3  -3.439   4.986  -7.270
   19    HA   ILE   3           HA       ILE   3  -4.918   7.499  -7.112
   20    HB   ILE   3           HB       ILE   3  -3.345   6.284  -4.828
   21   HG12  ILE   3          2HG1      ILE   3  -5.724   7.030  -3.773
   22   HG13  ILE   3          1HG1      ILE   3  -6.229   6.633  -5.412
   23   HG21  ILE   3          1HG2      ILE   3  -2.794   8.603  -4.939
   24   HG22  ILE   3          2HG2      ILE   3  -3.937   8.378  -3.614
   25   HG23  ILE   3          3HG2      ILE   3  -4.488   9.050  -5.149
   26   HD11  ILE   3          3HD1      ILE   3  -5.397   4.892  -3.222
   27   HD12  ILE   3          1HD1      ILE   3  -4.678   4.490  -4.781
   28   HD13  ILE   3          2HD1      ILE   3  -6.432   4.561  -4.611
   29    H    LYS   4           H        LYS   4  -3.616   9.306  -7.518
   30    HA   LYS   4           HA       LYS   4  -0.907   8.676  -8.437
   31    HB2  LYS   4           2HB      LYS   4  -2.893  10.122  -9.630
   32    HB3  LYS   4           1HB      LYS   4  -1.944  11.397  -8.883
   33    HG2  LYS   4           2HG      LYS   4  -0.696  11.317 -10.722
   34    HG3  LYS   4           1HG      LYS   4  -0.018   9.835 -10.046
   35    HD2  LYS   4           2HD      LYS   4  -1.957   8.634 -11.203
   36    HD3  LYS   4           1HD      LYS   4  -2.196  10.138 -12.095
   37    HE2  LYS   4           2HE      LYS   4   0.477   9.774 -12.392
   38    HE3  LYS   4           1HE      LYS   4  -0.085   8.104 -12.338
   39    HZ1  LYS   4           3HZ      LYS   4  -1.028  10.219 -14.199
   40    HZ2  LYS   4           1HZ      LYS   4  -1.666   8.653 -14.116
   41    HZ3  LYS   4           2HZ      LYS   4  -0.061   8.888 -14.596
   42    H    LEU   5           H        LEU   5   0.197   8.605  -6.522
   43    HA   LEU   5           HA       LEU   5   0.100  10.843  -4.687
   44    HG   LEU   5           HG       LEU   5  -0.855   8.332  -3.825
   45    HB2  LEU   5           2HB      LEU   5   1.501   8.195  -4.677
   46    HB3  LEU   5           1HB      LEU   5   1.938   9.439  -3.522
   47   HD11  LEU   5          1HD1      LEU   5   0.492   6.535  -3.060
   48   HD12  LEU   5          2HD1      LEU   5  -0.331   7.197  -1.647
   49   HD13  LEU   5          3HD1      LEU   5   1.365   7.578  -1.939
   50   HD21  LEU   5          3HD2      LEU   5  -1.160   9.382  -1.590
   51   HD22  LEU   5          1HD2      LEU   5  -0.865  10.542  -2.885
   52   HD23  LEU   5          2HD2      LEU   5   0.431  10.121  -1.765
   53    H    ILE   6           H        ILE   6   1.355  12.540  -4.713
   54    HA   ILE   6           HA       ILE   6   3.574  12.708  -6.579
   55    HB   ILE   6           HB       ILE   6   2.043  14.681  -4.901
   56   HG12  ILE   6          2HG1      ILE   6   2.215  15.853  -7.261
   57   HG13  ILE   6          1HG1      ILE   6   2.593  14.218  -7.792
   58   HG21  ILE   6          1HG2      ILE   6   4.557  15.537  -6.326
   59   HG22  ILE   6          2HG2      ILE   6   4.516  15.167  -4.601
   60   HG23  ILE   6          3HG2      ILE   6   3.530  16.475  -5.245
   61   HD11  ILE   6          3HD1      ILE   6   0.135  14.954  -6.226
   62   HD12  ILE   6          1HD1      ILE   6   0.493  13.406  -6.992
   63   HD13  ILE   6          2HD1      ILE   6   0.199  14.835  -7.984
   64    H    LYS   7           H        LYS   7   5.581  12.112  -5.939
   65    HA   LYS   7           HA       LYS   7   6.300  11.564  -3.283
   66    HB2  LYS   7           2HB      LYS   7   7.420  10.552  -5.230
   67    HB3  LYS   7           1HB      LYS   7   8.134  12.110  -5.617
   68    HG2  LYS   7           2HG      LYS   7   9.818  10.910  -4.515
   69    HG3  LYS   7           1HG      LYS   7   9.195  12.041  -3.315
   70    HD2  LYS   7           2HD      LYS   7   7.637  10.075  -2.648
   71    HD3  LYS   7           1HD      LYS   7   8.809   9.081  -3.513
   72    HE2  LYS   7           2HE      LYS   7   9.877  11.031  -1.558
   73    HE3  LYS   7           1HE      LYS   7   9.014   9.638  -0.907
   74    HZ1  LYS   7           3HZ      LYS   7  10.514   8.168  -2.024
   75    HZ2  LYS   7           1HZ      LYS   7  11.432   9.286  -1.146
   76    HZ3  LYS   7           2HZ      LYS   7  11.278   9.451  -2.822
   77    H    GLY   8           H        GLY   8   6.655  12.895  -1.673
   78    HA2  GLY   8           2HA      GLY   8   7.687  15.605  -2.252
   79    HA3  GLY   8           1HA      GLY   8   6.668  15.199  -0.879
   80    HA   PRO   9           HA       PRO   9  11.360  15.299   0.172
   81    HB2  PRO   9           2HB      PRO   9  10.233  17.121   2.241
   82    HB3  PRO   9           1HB      PRO   9  11.741  17.248   1.329
   83    HG2  PRO   9           2HG      PRO   9   9.663  18.797   0.730
   84    HG3  PRO   9           1HG      PRO   9  10.685  18.115  -0.549
   85    HD2  PRO   9           2HD      PRO   9   7.964  17.274   0.357
   86    HD3  PRO   9           1HD      PRO   9   8.643  17.323  -1.283
   87    H    LYS  10           H        LYS  10   8.403  15.197   2.121
   88    HA   LYS  10           HA       LYS  10   9.514  13.890   4.370
   89    HB2  LYS  10           2HB      LYS  10   6.654  13.870   3.378
   90    HB3  LYS  10           1HB      LYS  10   7.182  13.359   4.976
   91    HG2  LYS  10           2HG      LYS  10   8.156  15.994   4.487
   92    HG3  LYS  10           1HG      LYS  10   6.432  15.938   4.118
   93    HD2  LYS  10           2HD      LYS  10   6.287  16.353   6.349
   94    HD3  LYS  10           1HD      LYS  10   6.391  14.594   6.418
   95    HE2  LYS  10           2HE      LYS  10   8.489  14.616   7.281
   96    HE3  LYS  10           1HE      LYS  10   8.955  16.067   6.393
   97    HZ1  LYS  10           3HZ      LYS  10   7.210  16.007   8.797
   98    HZ2  LYS  10           1HZ      LYS  10   7.691  17.395   7.956
   99    HZ3  LYS  10           2HZ      LYS  10   8.838  16.463   8.779
  100    H    GLY  11           H        GLY  11   7.226  12.463   2.015
  101    HA2  GLY  11           2HA      GLY  11   8.346  10.420   0.863
  102    HA3  GLY  11           1HA      GLY  11   8.460   9.842   2.519
  103    H    LEU  12           H        LEU  12   7.004   8.253   2.745
  104    HA   LEU  12           HA       LEU  12   4.436   8.402   1.391
  105    HG   LEU  12           HG       LEU  12   6.633   6.631   0.816
  106    HB2  LEU  12           2HB      LEU  12   5.618   6.275   3.179
  107    HB3  LEU  12           1HB      LEU  12   4.091   6.138   2.331
  108   HD11  LEU  12          1HD1      LEU  12   7.277   4.455   0.839
  109   HD12  LEU  12          2HD1      LEU  12   5.643   3.855   1.124
  110   HD13  LEU  12          3HD1      LEU  12   6.574   4.545   2.452
  111   HD21  LEU  12          3HD2      LEU  12   4.794   6.894  -0.580
  112   HD22  LEU  12          1HD2      LEU  12   3.891   5.596   0.200
  113   HD23  LEU  12          2HD2      LEU  12   5.258   5.213  -0.846
  114    H    GLY  13           H        GLY  13   5.618   8.035   4.739
  115    HA2  GLY  13           2HA      GLY  13   4.797   9.012   6.669
  116    HA3  GLY  13           1HA      GLY  13   3.530   9.767   5.723
  117    H    PHE  14           H        PHE  14   4.207   6.293   5.849
  118    HA   PHE  14           HA       PHE  14   2.137   5.767   7.752
  119    HD1  PHE  14           2HD      PHE  14   2.118   2.939   4.818
  120    HD2  PHE  14           1HD      PHE  14   1.146   6.931   3.701
  121    HE1  PHE  14           2HE      PHE  14   2.623   2.402   2.473
  122    HE2  PHE  14           1HE      PHE  14   1.644   6.398   1.353
  123    HZ   PHE  14           HZ       PHE  14   2.384   4.132   0.736
  124    HB2  PHE  14           2HB      PHE  14   0.657   4.493   6.234
  125    HB3  PHE  14           1HB      PHE  14   0.694   6.209   5.860
  126    H    SER  15           H        SER  15   1.588   3.146   7.374
  127    HA   SER  15           HA       SER  15   4.186   1.830   7.053
  128    HG   SER  15           HG       SER  15   2.247   2.823   9.768
  129    HB2  SER  15           2HB      SER  15   3.183   0.291   8.970
  130    HB3  SER  15           1HB      SER  15   4.114   1.733   9.355
  131    H    ILE  16           H        ILE  16   3.809  -0.659   6.985
  132    HA   ILE  16           HA       ILE  16   1.235  -1.463   5.909
  133    HB   ILE  16           HB       ILE  16   1.892  -2.097   3.768
  134   HG12  ILE  16          2HG1      ILE  16   4.147  -3.010   4.541
  135   HG13  ILE  16          1HG1      ILE  16   4.051  -2.369   2.907
  136   HG21  ILE  16          1HG2      ILE  16   1.527   0.283   3.871
  137   HG22  ILE  16          2HG2      ILE  16   2.766  -0.087   2.673
  138   HG23  ILE  16          3HG2      ILE  16   3.227   0.551   4.250
  139   HD11  ILE  16          3HD1      ILE  16   4.826  -0.382   4.871
  140   HD12  ILE  16          1HD1      ILE  16   5.556  -0.802   3.321
  141   HD13  ILE  16          2HD1      ILE  16   5.942  -1.746   4.764
  142    H    ALA  17           H        ALA  17   1.295  -3.774   5.230
  143    HA   ALA  17           HA       ALA  17   3.323  -5.414   6.564
  144    HB1  ALA  17           3HB      ALA  17   0.443  -5.270   7.192
  145    HB2  ALA  17           1HB      ALA  17   1.795  -5.795   8.196
  146    HB3  ALA  17           2HB      ALA  17   1.104  -6.897   7.006
  147    H    GLY  18           H        GLY  18   3.152  -7.771   5.605
  148    HA2  GLY  18           2HA      GLY  18   1.604  -8.407   3.456
  149    HA3  GLY  18           1HA      GLY  18   2.846  -7.408   2.747
  150    H    GLY  19           H        GLY  19   1.993 -10.476   2.736
  151    HA2  GLY  19           2HA      GLY  19   3.500 -12.049   1.765
  152    HA3  GLY  19           1HA      GLY  19   4.800 -11.339   2.705
  153    H    VAL  20           H        VAL  20   4.303 -14.082   2.564
  154    HA   VAL  20           HA       VAL  20   2.780 -15.054   4.732
  155    HB   VAL  20           HB       VAL  20   3.551 -16.461   2.819
  156   HG11  VAL  20          1HG1      VAL  20   5.906 -15.547   2.862
  157   HG12  VAL  20          2HG1      VAL  20   5.758 -17.292   2.663
  158   HG13  VAL  20          3HG1      VAL  20   6.203 -16.618   4.230
  159   HG21  VAL  20          3HG2      VAL  20   2.717 -17.437   4.937
  160   HG22  VAL  20          1HG2      VAL  20   4.382 -17.542   5.509
  161   HG23  VAL  20          2HG2      VAL  20   3.872 -18.476   4.103
  162    H    GLY  21           H        GLY  21   3.325 -15.523   6.858
  163    HA2  GLY  21           2HA      GLY  21   4.670 -15.668   8.767
  164    HA3  GLY  21           1HA      GLY  21   6.054 -15.186   7.800
  165    H    ASN  22           H        ASN  22   4.231 -12.889   6.826
  166    HA   ASN  22           HA       ASN  22   4.289 -11.164   9.185
  167    HB2  ASN  22           2HB      ASN  22   5.121  -9.374   7.371
  168    HB3  ASN  22           1HB      ASN  22   6.255 -10.327   8.313
  169   HD21  ASN  22          1HD2      ASN  22   7.876 -11.008   7.131
  170   HD22  ASN  22          2HD2      ASN  22   7.788 -11.544   5.491
  171    H    GLN  23           H        GLN  23   2.171 -12.515   7.406
  172    HA   GLN  23           HA       GLN  23   0.875 -10.704   5.772
  173    HB2  GLN  23           2HB      GLN  23  -0.337 -12.874   7.490
  174    HB3  GLN  23           1HB      GLN  23  -1.165 -12.052   6.178
  175    HG2  GLN  23           2HG      GLN  23  -0.471 -13.727   4.906
  176    HG3  GLN  23           1HG      GLN  23   1.114 -12.963   4.965
  177   HE21  GLN  23          1HE2      GLN  23   0.104 -15.834   4.864
  178   HE22  GLN  23          2HE2      GLN  23   0.992 -16.626   6.116
  179    H    HIS  24           H        HIS  24  -0.727  -9.220   5.998
  180    HA   HIS  24           HA       HIS  24  -1.085  -8.050   8.646
  181    HD1  HIS  24           1HD      HIS  24  -0.584  -5.154   8.831
  182    HD2  HIS  24           2HD      HIS  24  -4.235  -5.649   6.923
  183    HE1  HIS  24           1HE      HIS  24  -2.058  -3.354   9.742
  184    HE2  HIS  24           2HE      HIS  24  -4.311  -3.749   8.685
  185    HB2  HIS  24           2HB      HIS  24  -0.561  -6.630   6.636
  186    HB3  HIS  24           1HB      HIS  24  -2.126  -7.062   5.985
  187    H    ILE  25           H        ILE  25  -2.839  -9.809   6.212
  188    HA   ILE  25           HA       ILE  25  -5.149  -9.993   8.006
  189    HB   ILE  25           HB       ILE  25  -5.451  -9.534   5.033
  190   HG12  ILE  25          2HG1      ILE  25  -4.586  -7.520   6.269
  191   HG13  ILE  25          1HG1      ILE  25  -6.153  -7.288   5.502
  192   HG21  ILE  25          1HG2      ILE  25  -7.335 -10.030   7.282
  193   HG22  ILE  25          2HG2      ILE  25  -7.363 -10.643   5.628
  194   HG23  ILE  25          3HG2      ILE  25  -7.845  -8.978   5.961
  195   HD11  ILE  25          3HD1      ILE  25  -5.510  -6.684   8.102
  196   HD12  ILE  25          1HD1      ILE  25  -6.382  -8.209   8.245
  197   HD13  ILE  25          2HD1      ILE  25  -7.138  -6.835   7.441
  198    HA   PRO  26           HA       PRO  26  -4.414 -14.317   7.186
  199    HB2  PRO  26           2HB      PRO  26  -6.892 -15.196   8.050
  200    HB3  PRO  26           1HB      PRO  26  -5.500 -14.905   9.097
  201    HG2  PRO  26           2HG      PRO  26  -7.849 -13.148   8.531
  202    HG3  PRO  26           1HG      PRO  26  -7.002 -13.433  10.064
  203    HD2  PRO  26           2HD      PRO  26  -6.601 -11.200   8.637
  204    HD3  PRO  26           1HD      PRO  26  -5.274 -11.983   9.521
  205    H    GLY  27           H        GLY  27  -4.533 -15.280   5.268
  206    HA2  GLY  27           2HA      GLY  27  -5.867 -16.415   3.608
  207    HA3  GLY  27           1HA      GLY  27  -7.066 -15.141   3.766
  208    H    ASP  28           H        ASP  28  -5.431 -12.872   3.574
  209    HA   ASP  28           HA       ASP  28  -4.499 -13.120   0.793
  210    HB2  ASP  28           2HB      ASP  28  -6.358 -11.329   1.976
  211    HB3  ASP  28           1HB      ASP  28  -4.945 -10.387   1.510
  212    H    ASN  29           H        ASN  29  -2.397 -13.101   0.581
  213    HA   ASN  29           HA       ASN  29  -0.644 -12.004   2.609
  214    HB2  ASN  29           2HB      ASN  29   0.329 -13.000  -0.047
  215    HB3  ASN  29           1HB      ASN  29   1.104 -13.098   1.531
  216   HD21  ASN  29          1HD2      ASN  29   0.119 -14.559   3.109
  217   HD22  ASN  29          2HD2      ASN  29  -0.631 -16.007   2.543
  218    H    SER  30           H        SER  30  -2.379 -10.201   0.812
  219    HA   SER  30           HA       SER  30  -0.612  -8.751  -0.869
  220    HG   SER  30           HG       SER  30  -4.500  -8.460  -0.500
  221    HB2  SER  30           2HB      SER  30  -2.783  -7.092   0.018
  222    HB3  SER  30           1HB      SER  30  -2.527  -7.819  -1.567
  223    H    ILE  31           H        ILE  31  -0.640  -6.177  -0.411
  224    HA   ILE  31           HA       ILE  31   0.692  -5.926   2.198
  225    HB   ILE  31           HB       ILE  31   0.975  -4.019  -0.117
  226   HG12  ILE  31          2HG1      ILE  31   2.141  -5.695  -1.088
  227   HG13  ILE  31          1HG1      ILE  31   3.398  -5.195   0.024
  228   HG21  ILE  31          1HG2      ILE  31   2.832  -3.108   1.077
  229   HG22  ILE  31          2HG2      ILE  31   2.697  -4.349   2.322
  230   HG23  ILE  31          3HG2      ILE  31   1.432  -3.133   2.148
  231   HD11  ILE  31          3HD1      ILE  31   3.468  -7.280   0.759
  232   HD12  ILE  31          1HD1      ILE  31   2.048  -7.712  -0.192
  233   HD13  ILE  31          2HD1      ILE  31   1.854  -7.054   1.430
  234    H    TYR  32           H        TYR  32  -0.601  -5.189   3.701
  235    HA   TYR  32           HA       TYR  32  -2.615  -3.146   3.050
  236    HD1  TYR  32           2HD      TYR  32  -2.263  -6.595   3.173
  237    HD2  TYR  32           1HD      TYR  32  -5.681  -4.462   4.527
  238    HE1  TYR  32           2HE      TYR  32  -3.709  -8.167   1.965
  239    HE2  TYR  32           1HE      TYR  32  -7.146  -6.020   3.341
  240    HH   TYR  32           HH       TYR  32  -6.523  -8.832   2.477
  241    HB2  TYR  32           2HB      TYR  32  -2.395  -5.041   5.385
  242    HB3  TYR  32           1HB      TYR  32  -3.620  -3.790   5.253
  243    H    VAL  33           H        VAL  33  -2.815  -1.268   4.248
  244    HA   VAL  33           HA       VAL  33  -0.406  -0.294   5.494
  245    HB   VAL  33           HB       VAL  33  -3.081   1.000   4.952
  246   HG11  VAL  33          1HG1      VAL  33  -0.746   2.017   6.526
  247   HG12  VAL  33          2HG1      VAL  33  -2.470   2.144   6.873
  248   HG13  VAL  33          3HG1      VAL  33  -1.752   3.133   5.601
  249   HG21  VAL  33          3HG2      VAL  33  -2.075   1.120   2.938
  250   HG22  VAL  33          1HG2      VAL  33  -0.462   0.886   3.610
  251   HG23  VAL  33          2HG2      VAL  33  -1.219   2.478   3.669
  252    H    THR  34           H        THR  34   0.019  -0.270   7.613
  253    HA   THR  34           HA       THR  34  -2.064  -1.219   9.435
  254    HB   THR  34           HB       THR  34  -0.413  -2.115  10.779
  255    HG1  THR  34           1HG      THR  34   1.421  -0.275   9.646
  256   HG21  THR  34          3HG2      THR  34   0.570  -3.565   9.421
  257   HG22  THR  34          1HG2      THR  34   1.499  -2.304   8.613
  258   HG23  THR  34          2HG2      THR  34  -0.148  -2.658   8.092
  259    H    LYS  35           H        LYS  35  -0.066   1.628   8.916
  260    HA   LYS  35           HA       LYS  35  -1.647   3.101  10.828
  261    HB2  LYS  35           2HB      LYS  35   1.285   2.600  11.361
  262    HB3  LYS  35           1HB      LYS  35   0.386   3.915  12.101
  263    HG2  LYS  35           2HG      LYS  35  -1.186   2.163  13.011
  264    HG3  LYS  35           1HG      LYS  35  -0.011   0.962  12.472
  265    HD2  LYS  35           2HD      LYS  35   1.542   1.576  14.041
  266    HD3  LYS  35           1HD      LYS  35   0.953   3.236  14.134
  267    HE2  LYS  35           2HE      LYS  35   0.373   2.209  16.186
  268    HE3  LYS  35           1HE      LYS  35  -1.115   2.317  15.247
  269    HZ1  LYS  35           3HZ      LYS  35   0.577  -0.120  15.397
  270    HZ2  LYS  35           1HZ      LYS  35  -0.957   0.015  14.693
  271    HZ3  LYS  35           2HZ      LYS  35  -0.780   0.151  16.370
  272    H    ILE  36           H        ILE  36  -2.003   5.042   9.943
  273    HA   ILE  36           HA       ILE  36  -0.084   6.053   7.974
  274    HB   ILE  36           HB       ILE  36  -2.942   6.858   8.525
  275   HG12  ILE  36          2HG1      ILE  36  -1.561   5.315   6.332
  276   HG13  ILE  36          1HG1      ILE  36  -2.911   4.805   7.338
  277   HG21  ILE  36          1HG2      ILE  36  -0.982   7.982   6.523
  278   HG22  ILE  36          2HG2      ILE  36  -1.701   8.832   7.892
  279   HG23  ILE  36          3HG2      ILE  36  -2.714   8.322   6.542
  280   HD11  ILE  36          3HD1      ILE  36  -2.910   6.711   5.031
  281   HD12  ILE  36          1HD1      ILE  36  -4.228   6.671   6.201
  282   HD13  ILE  36          2HD1      ILE  36  -3.848   5.234   5.251
  283    H    ILE  37           H        ILE  37   1.313   7.596   8.541
  284    HA   ILE  37           HA       ILE  37   1.154   8.929  11.078
  285    HB   ILE  37           HB       ILE  37   3.100   9.138   8.776
  286   HG12  ILE  37          2HG1      ILE  37   4.591   8.319  10.807
  287   HG13  ILE  37          1HG1      ILE  37   3.042   7.754  11.423
  288   HG21  ILE  37          1HG2      ILE  37   4.514  10.450  10.435
  289   HG22  ILE  37          2HG2      ILE  37   3.019  10.710  11.335
  290   HG23  ILE  37          3HG2      ILE  37   3.169  11.303   9.681
  291   HD11  ILE  37          3HD1      ILE  37   4.554   6.186  10.009
  292   HD12  ILE  37          1HD1      ILE  37   3.858   7.060   8.646
  293   HD13  ILE  37          2HD1      ILE  37   2.808   6.189   9.763
  294    H    GLU  38           H        GLU  38   0.925  11.154  11.460
  295    HA   GLU  38           HA       GLU  38  -0.980  12.510   9.891
  296    HB2  GLU  38           2HB      GLU  38  -0.346  12.825  12.394
  297    HB3  GLU  38           1HB      GLU  38   0.865  13.944  11.784
  298    HG2  GLU  38           2HG      GLU  38  -0.722  15.443  11.016
  299    HG3  GLU  38           1HG      GLU  38  -1.997  14.226  10.975
  300    H    GLY  39           H        GLY  39  -0.828  14.246   8.479
  301    HA2  GLY  39           2HA      GLY  39   0.076  15.581   6.856
  302    HA3  GLY  39           1HA      GLY  39   1.521  15.646   7.846
  303    H    GLY  40           H        GLY  40   0.499  12.499   6.830
  304    HA2  GLY  40           2HA      GLY  40   2.866  12.305   5.137
  305    HA3  GLY  40           1HA      GLY  40   1.883  10.967   5.709
  306    H    ALA  41           H        ALA  41   2.721  11.010   3.119
  307    HA   ALA  41           HA       ALA  41   1.257  12.220   1.155
  308    HB1  ALA  41           3HB      ALA  41   3.171  10.693   0.791
  309    HB2  ALA  41           1HB      ALA  41   1.811  10.371  -0.284
  310    HB3  ALA  41           2HB      ALA  41   2.102   9.326   1.107
  311    H    ALA  42           H        ALA  42   0.401   9.075   2.656
  312    HA   ALA  42           HA       ALA  42  -2.094   8.858   1.327
  313    HB1  ALA  42           3HB      ALA  42  -2.573   7.100   3.037
  314    HB2  ALA  42           1HB      ALA  42  -1.048   7.519   3.818
  315    HB3  ALA  42           2HB      ALA  42  -1.050   6.877   2.175
  316    H    HIS  43           H        HIS  43  -1.243   9.835   4.643
  317    HA   HIS  43           HA       HIS  43  -3.733  10.328   5.696
  318    HD1  HIS  43           1HD      HIS  43  -2.558  14.073   6.922
  319    HD2  HIS  43           2HD      HIS  43  -3.476  10.600   9.009
  320    HE1  HIS  43           1HE      HIS  43  -3.823  14.829   8.957
  321    HE2  HIS  43           2HE      HIS  43  -4.275  12.720  10.260
  322    HB2  HIS  43           2HB      HIS  43  -1.594  10.469   6.943
  323    HB3  HIS  43           1HB      HIS  43  -1.247  11.994   6.140
  324    H    LYS  44           H        LYS  44  -1.720  12.611   3.843
  325    HA   LYS  44           HA       LYS  44  -3.606  14.735   3.918
  326    HB2  LYS  44           2HB      LYS  44  -1.198  14.191   2.187
  327    HB3  LYS  44           1HB      LYS  44  -2.186  15.633   1.996
  328    HG2  LYS  44           2HG      LYS  44  -1.612  16.437   4.134
  329    HG3  LYS  44           1HG      LYS  44  -0.934  14.882   4.620
  330    HD2  LYS  44           2HD      LYS  44   0.975  15.169   3.318
  331    HD3  LYS  44           1HD      LYS  44   0.213  16.392   2.299
  332    HE2  LYS  44           2HE      LYS  44   0.174  17.921   4.250
  333    HE3  LYS  44           1HE      LYS  44   1.054  16.707   5.178
  334    HZ1  LYS  44           3HZ      LYS  44   2.854  16.861   3.534
  335    HZ2  LYS  44           1HZ      LYS  44   2.573  18.337   4.313
  336    HZ3  LYS  44           2HZ      LYS  44   2.018  18.094   2.734
  337    H    ASP  45           H        ASP  45  -2.971  12.120   1.629
  338    HA   ASP  45           HA       ASP  45  -4.584  13.034  -0.487
  339    HB2  ASP  45           2HB      ASP  45  -2.881  11.040  -0.352
  340    HB3  ASP  45           1HB      ASP  45  -4.300  10.107   0.111
  341    H    GLY  46           H        GLY  46  -5.328  10.650   2.070
  342    HA2  GLY  46           2HA      GLY  46  -7.367  10.555   3.267
  343    HA3  GLY  46           1HA      GLY  46  -8.122  11.528   2.017
  344    H    LYS  47           H        LYS  47  -6.867   9.663  -0.058
  345    HA   LYS  47           HA       LYS  47  -9.112   7.955  -0.343
  346    HB2  LYS  47           2HB      LYS  47  -7.395   8.935  -2.107
  347    HB3  LYS  47           1HB      LYS  47  -6.582   7.402  -1.824
  348    HG2  LYS  47           2HG      LYS  47  -7.983   6.381  -3.197
  349    HG3  LYS  47           1HG      LYS  47  -9.356   6.897  -2.216
  350    HD2  LYS  47           2HD      LYS  47  -8.856   9.192  -3.508
  351    HD3  LYS  47           1HD      LYS  47  -8.261   8.049  -4.714
  352    HE2  LYS  47           2HE      LYS  47 -10.467   8.224  -5.329
  353    HE3  LYS  47           1HE      LYS  47 -10.532   6.836  -4.245
  354    HZ1  LYS  47           3HZ      LYS  47 -12.308   8.390  -3.770
  355    HZ2  LYS  47           1HZ      LYS  47 -11.196   9.640  -3.518
  356    HZ3  LYS  47           2HZ      LYS  47 -11.240   8.320  -2.461
  357    H    LEU  48           H        LEU  48  -5.775   7.396   0.724
  358    HA   LEU  48           HA       LEU  48  -6.281   4.563   1.092
  359    HG   LEU  48           HG       LEU  48  -4.429   3.230   0.904
  360    HB2  LEU  48           2HB      LEU  48  -4.058   5.756   0.356
  361    HB3  LEU  48           1HB      LEU  48  -3.811   5.918   2.085
  362   HD11  LEU  48          1HD1      LEU  48  -1.620   4.226   1.240
  363   HD12  LEU  48          2HD1      LEU  48  -2.482   4.399  -0.289
  364   HD13  LEU  48          3HD1      LEU  48  -2.198   2.795   0.386
  365   HD21  LEU  48          3HD2      LEU  48  -2.576   3.752   3.170
  366   HD22  LEU  48          1HD2      LEU  48  -3.651   2.386   2.873
  367   HD23  LEU  48          2HD2      LEU  48  -4.311   3.920   3.435
  368    H    GLN  49           H        GLN  49  -6.893   3.617   2.903
  369    HA   GLN  49           HA       GLN  49  -6.526   4.957   5.477
  370    HB2  GLN  49           2HB      GLN  49  -8.789   4.481   6.152
  371    HB3  GLN  49           1HB      GLN  49  -8.830   5.417   4.670
  372    HG2  GLN  49           2HG      GLN  49  -9.030   2.428   4.633
  373    HG3  GLN  49           1HG      GLN  49 -10.441   3.443   4.921
  374   HE21  GLN  49          1HE2      GLN  49  -8.584   1.942   2.597
  375   HE22  GLN  49          2HE2      GLN  49  -9.163   2.788   1.206
  376    H    ILE  50           H        ILE  50  -6.292   3.542   7.244
  377    HA   ILE  50           HA       ILE  50  -4.957   1.177   6.863
  378    HB   ILE  50           HB       ILE  50  -5.678   0.558   9.222
  379   HG12  ILE  50          2HG1      ILE  50  -6.619   3.255   9.801
  380   HG13  ILE  50          1HG1      ILE  50  -7.713   2.398   8.720
  381   HG21  ILE  50          1HG2      ILE  50  -4.267   2.232  10.222
  382   HG22  ILE  50          2HG2      ILE  50  -4.503   3.307   8.843
  383   HG23  ILE  50          3HG2      ILE  50  -3.620   1.794   8.641
  384   HD11  ILE  50          3HD1      ILE  50  -6.821   1.554  11.461
  385   HD12  ILE  50          1HD1      ILE  50  -7.732   0.521  10.362
  386   HD13  ILE  50          2HD1      ILE  50  -8.440   2.027  10.947
  387    H    GLY  51           H        GLY  51  -5.471  -0.801   6.190
  388    HA2  GLY  51           2HA      GLY  51  -6.954  -2.743   6.579
  389    HA3  GLY  51           1HA      GLY  51  -8.302  -1.649   6.343
  390    H    ASP  52           H        ASP  52  -6.717  -0.313   4.064
  391    HA   ASP  52           HA       ASP  52  -7.814  -1.918   2.006
  392    HB2  ASP  52           2HB      ASP  52  -6.563  -0.281   0.488
  393    HB3  ASP  52           1HB      ASP  52  -7.793   0.392   1.543
  394    H    LYS  53           H        LYS  53  -6.604  -2.835   0.190
  395    HA   LYS  53           HA       LYS  53  -3.998  -3.879   1.082
  396    HB2  LYS  53           2HB      LYS  53  -4.459  -5.805  -0.457
  397    HB3  LYS  53           1HB      LYS  53  -5.529  -5.695   0.928
  398    HG2  LYS  53           2HG      LYS  53  -6.764  -4.259  -1.152
  399    HG3  LYS  53           1HG      LYS  53  -6.178  -5.772  -1.845
  400    HD2  LYS  53           2HD      LYS  53  -7.350  -6.292   0.715
  401    HD3  LYS  53           1HD      LYS  53  -8.479  -5.353  -0.264
  402    HE2  LYS  53           2HE      LYS  53  -8.874  -7.063  -1.660
  403    HE3  LYS  53           1HE      LYS  53  -7.169  -7.504  -1.746
  404    HZ1  LYS  53           3HZ      LYS  53  -7.782  -8.293   0.731
  405    HZ2  LYS  53           1HZ      LYS  53  -7.872  -9.300  -0.625
  406    HZ3  LYS  53           2HZ      LYS  53  -9.266  -8.547  -0.038
  407    H    LEU  54           H        LEU  54  -2.366  -4.032  -0.346
  408    HA   LEU  54           HA       LEU  54  -2.533  -2.157  -2.585
  409    HG   LEU  54           HG       LEU  54  -1.358  -0.538  -1.474
  410    HB2  LEU  54           2HB      LEU  54  -0.479  -2.872  -0.706
  411    HB3  LEU  54           1HB      LEU  54   0.128  -2.987  -2.346
  412   HD11  LEU  54          1HD1      LEU  54   0.932   0.429  -0.949
  413   HD12  LEU  54          2HD1      LEU  54   1.486  -1.240  -0.822
  414   HD13  LEU  54          3HD1      LEU  54   0.222  -0.647   0.254
  415   HD21  LEU  54          3HD2      LEU  54  -0.948  -0.190  -3.654
  416   HD22  LEU  54          1HD2      LEU  54   0.355  -1.378  -3.709
  417   HD23  LEU  54          2HD2      LEU  54   0.665   0.244  -3.090
  418    H    LEU  55           H        LEU  55  -3.244  -3.052  -4.364
  419    HA   LEU  55           HA       LEU  55  -2.816  -5.728  -5.156
  420    HG   LEU  55           HG       LEU  55  -3.181  -6.027  -7.661
  421    HB2  LEU  55           2HB      LEU  55  -4.716  -4.429  -5.956
  422    HB3  LEU  55           1HB      LEU  55  -3.639  -3.309  -6.766
  423   HD11  LEU  55          1HD1      LEU  55  -5.454  -6.498  -7.214
  424   HD12  LEU  55          2HD1      LEU  55  -5.349  -6.152  -8.940
  425   HD13  LEU  55          3HD1      LEU  55  -5.976  -4.931  -7.831
  426   HD21  LEU  55          3HD2      LEU  55  -2.450  -3.932  -8.775
  427   HD22  LEU  55          1HD2      LEU  55  -4.140  -3.582  -9.141
  428   HD23  LEU  55          2HD2      LEU  55  -3.365  -5.008  -9.830
  429    H    ALA  56           H        ALA  56  -1.312  -2.636  -6.198
  430    HA   ALA  56           HA       ALA  56   1.138  -4.089  -6.795
  431    HB1  ALA  56           3HB      ALA  56   1.201  -3.133  -9.166
  432    HB2  ALA  56           1HB      ALA  56  -0.526  -2.833  -8.976
  433    HB3  ALA  56           2HB      ALA  56   0.094  -4.481  -8.890
  434    H    VAL  57           H        VAL  57   2.954  -2.687  -7.327
  435    HA   VAL  57           HA       VAL  57   2.557   0.176  -6.813
  436    HB   VAL  57           HB       VAL  57   4.469  -1.579  -5.268
  437   HG11  VAL  57          1HG1      VAL  57   4.411   1.397  -5.635
  438   HG12  VAL  57          2HG1      VAL  57   5.783   0.291  -5.724
  439   HG13  VAL  57          3HG1      VAL  57   5.057   0.671  -4.163
  440   HG21  VAL  57          3HG2      VAL  57   3.316  -0.562  -3.318
  441   HG22  VAL  57          1HG2      VAL  57   2.260  -1.551  -4.327
  442   HG23  VAL  57          2HG2      VAL  57   2.190   0.208  -4.435
  443    H    ASN  58           H        ASN  58   3.321   1.096  -8.603
  444    HA   ASN  58           HA       ASN  58   4.718   1.739 -10.272
  445    HB2  ASN  58           2HB      ASN  58   6.761   0.389  -8.498
  446    HB3  ASN  58           1HB      ASN  58   7.185   1.253  -9.971
  447   HD21  ASN  58          1HD2      ASN  58   8.287   2.930  -9.121
  448   HD22  ASN  58          2HD2      ASN  58   7.607   4.098  -8.045
  449    H    ASN  59           H        ASN  59   3.195  -0.415 -10.845
  450    HA   ASN  59           HA       ASN  59   2.958  -1.855 -12.608
  451    HB2  ASN  59           2HB      ASN  59   5.196  -0.621 -13.386
  452    HB3  ASN  59           1HB      ASN  59   5.866  -2.222 -13.089
  453   HD21  ASN  59          1HD2      ASN  59   5.299  -3.918 -14.415
  454   HD22  ASN  59          2HD2      ASN  59   4.425  -3.701 -15.889
  455    H    VAL  60           H        VAL  60   4.888  -2.512  -9.845
  456    HA   VAL  60           HA       VAL  60   4.969  -5.384 -10.413
  457    HB   VAL  60           HB       VAL  60   6.354  -5.657  -8.505
  458   HG11  VAL  60          1HG1      VAL  60   7.918  -3.433  -8.964
  459   HG12  VAL  60          2HG1      VAL  60   7.007  -3.616 -10.464
  460   HG13  VAL  60          3HG1      VAL  60   7.980  -4.955  -9.855
  461   HG21  VAL  60          3HG2      VAL  60   6.778  -3.118  -7.405
  462   HG22  VAL  60          1HG2      VAL  60   5.979  -4.500  -6.655
  463   HG23  VAL  60          2HG2      VAL  60   5.030  -3.306  -7.537
  464    H    CYS  61           H        CYS  61   3.884  -6.936  -9.116
  465    HA   CYS  61           HA       CYS  61   1.465  -5.913  -7.902
  466    HG   CYS  61           HG       CYS  61   2.736  -9.688  -7.146
  467    HB2  CYS  61           2HB      CYS  61   0.759  -8.208  -7.706
  468    HB3  CYS  61           1HB      CYS  61   1.402  -7.933  -9.320
  469    H    LEU  62           H        LEU  62   1.007  -5.768  -5.788
  470    HA   LEU  62           HA       LEU  62   3.144  -6.461  -3.914
  471    HG   LEU  62           HG       LEU  62   3.581  -4.939  -2.159
  472    HB2  LEU  62           2HB      LEU  62   1.619  -4.127  -4.292
  473    HB3  LEU  62           1HB      LEU  62   1.095  -4.810  -2.770
  474   HD11  LEU  62          1HD1      LEU  62   4.693  -2.893  -3.475
  475   HD12  LEU  62          2HD1      LEU  62   3.678  -3.549  -4.760
  476   HD13  LEU  62          3HD1      LEU  62   4.876  -4.576  -3.969
  477   HD21  LEU  62          3HD2      LEU  62   2.597  -2.133  -2.532
  478   HD22  LEU  62          1HD2      LEU  62   3.531  -2.813  -1.201
  479   HD23  LEU  62          2HD2      LEU  62   1.830  -3.233  -1.391
  480    H    GLU  63           H        GLU  63   1.122  -8.367  -4.955
  481    HA   GLU  63           HA       GLU  63  -0.211  -9.040  -2.418
  482    HB2  GLU  63           2HB      GLU  63  -1.633  -8.466  -4.479
  483    HB3  GLU  63           1HB      GLU  63  -1.123 -10.028  -5.103
  484    HG2  GLU  63           2HG      GLU  63  -2.376 -11.195  -3.612
  485    HG3  GLU  63           1HG      GLU  63  -2.247  -9.957  -2.364
  486    H    GLU  64           H        GLU  64   2.055 -10.137  -4.779
  487    HA   GLU  64           HA       GLU  64   2.064 -12.790  -3.507
  488    HB2  GLU  64           2HB      GLU  64   2.070 -12.014  -6.307
  489    HB3  GLU  64           1HB      GLU  64   3.338 -13.160  -5.915
  490    HG2  GLU  64           2HG      GLU  64   1.621 -14.562  -6.482
  491    HG3  GLU  64           1HG      GLU  64   1.410 -14.456  -4.736
  492    H    VAL  65           H        VAL  65   3.483 -10.651  -2.411
  493    HA   VAL  65           HA       VAL  65   6.239 -11.598  -2.796
  494    HB   VAL  65           HB       VAL  65   7.066  -9.250  -2.492
  495   HG11  VAL  65          1HG1      VAL  65   6.904  -8.690  -4.813
  496   HG12  VAL  65          2HG1      VAL  65   5.438  -9.653  -4.997
  497   HG13  VAL  65          3HG1      VAL  65   6.980 -10.448  -4.679
  498   HG21  VAL  65          3HG2      VAL  65   5.520  -7.420  -3.117
  499   HG22  VAL  65          1HG2      VAL  65   5.084  -8.205  -1.599
  500   HG23  VAL  65          2HG2      VAL  65   4.183  -8.569  -3.071
  501    H    THR  66           H        THR  66   7.683 -11.164  -1.046
  502    HA   THR  66           HA       THR  66   6.494 -11.570   1.514
  503    HB   THR  66           HB       THR  66   9.339 -10.722   1.355
  504    HG1  THR  66           1HG      THR  66   8.425 -13.147   0.198
  505   HG21  THR  66          3HG2      THR  66   9.485 -13.046   2.550
  506   HG22  THR  66          1HG2      THR  66   7.762 -12.776   2.810
  507   HG23  THR  66          2HG2      THR  66   8.939 -11.610   3.414
  508    H    HIS  67           H        HIS  67   7.380 -10.155   3.425
  509    HA   HIS  67           HA       HIS  67   6.197  -7.629   3.154
  510    HD1  HIS  67           1HD      HIS  67   4.942  -7.079   6.296
  511    HD2  HIS  67           2HD      HIS  67   8.610  -5.433   5.273
  512    HE1  HIS  67           1HE      HIS  67   4.828  -4.679   7.004
  513    HE2  HIS  67           2HE      HIS  67   6.993  -3.672   6.237
  514    HB2  HIS  67           2HB      HIS  67   6.470  -8.761   5.349
  515    HB3  HIS  67           1HB      HIS  67   8.183  -8.367   5.320
  516    H    GLU  68           H        GLU  68   9.617  -8.554   2.962
  517    HA   GLU  68           HA       GLU  68  10.822  -6.089   2.904
  518    HB2  GLU  68           2HB      GLU  68  11.481  -8.496   1.191
  519    HB3  GLU  68           1HB      GLU  68  12.534  -7.104   1.400
  520    HG2  GLU  68           2HG      GLU  68  11.577  -8.645   3.775
  521    HG3  GLU  68           1HG      GLU  68  12.935  -9.225   2.812
  522    H    GLU  69           H        GLU  69   9.462  -7.823   0.104
  523    HA   GLU  69           HA       GLU  69   9.939  -5.844  -1.821
  524    HB2  GLU  69           2HB      GLU  69   7.816  -7.979  -1.663
  525    HB3  GLU  69           1HB      GLU  69   8.032  -6.947  -3.069
  526    HG2  GLU  69           2HG      GLU  69   9.377  -8.568  -3.800
  527    HG3  GLU  69           1HG      GLU  69  10.559  -7.873  -2.693
  528    H    ALA  70           H        ALA  70   7.303  -6.218   0.488
  529    HA   ALA  70           HA       ALA  70   5.492  -4.339  -0.582
  530    HB1  ALA  70           3HB      ALA  70   5.042  -6.015   1.248
  531    HB2  ALA  70           1HB      ALA  70   4.418  -4.391   1.537
  532    HB3  ALA  70           2HB      ALA  70   5.886  -4.927   2.348
  533    H    VAL  71           H        VAL  71   8.159  -4.014   1.721
  534    HA   VAL  71           HA       VAL  71   7.755  -1.183   2.094
  535    HB   VAL  71           HB       VAL  71   9.907  -3.086   3.012
  536   HG11  VAL  71          1HG1      VAL  71  11.227  -1.224   2.905
  537   HG12  VAL  71          2HG1      VAL  71  10.491  -0.975   4.488
  538   HG13  VAL  71          3HG1      VAL  71   9.870  -0.113   3.081
  539   HG21  VAL  71          3HG2      VAL  71   8.881  -3.066   5.054
  540   HG22  VAL  71          1HG2      VAL  71   7.476  -2.832   4.012
  541   HG23  VAL  71          2HG2      VAL  71   8.211  -1.451   4.826
  542    H    THR  72           H        THR  72   9.982  -3.244   0.275
  543    HA   THR  72           HA       THR  72  11.733  -1.225  -0.591
  544    HB   THR  72           HB       THR  72  11.054  -3.856  -1.916
  545    HG1  THR  72           1HG      THR  72  12.179  -4.685  -0.373
  546   HG21  THR  72          3HG2      THR  72  12.252  -2.393  -3.459
  547   HG22  THR  72          1HG2      THR  72  13.262  -3.740  -2.930
  548   HG23  THR  72          2HG2      THR  72  13.503  -2.134  -2.243
  549    H    ALA  73           H        ALA  73   8.658  -2.382  -1.887
  550    HA   ALA  73           HA       ALA  73   8.889  -0.950  -4.356
  551    HB1  ALA  73           3HB      ALA  73   6.593  -1.659  -4.742
  552    HB2  ALA  73           1HB      ALA  73   6.466  -2.209  -3.071
  553    HB3  ALA  73           2HB      ALA  73   7.576  -3.012  -4.183
  554    H    LEU  74           H        LEU  74   7.347  -0.410  -1.211
  555    HA   LEU  74           HA       LEU  74   5.923   1.941  -1.977
  556    HG   LEU  74           HG       LEU  74   4.298   0.961   1.144
  557    HB2  LEU  74           2HB      LEU  74   6.591   0.505   0.522
  558    HB3  LEU  74           1HB      LEU  74   6.298   2.221   0.693
  559   HD11  LEU  74          1HD1      LEU  74   4.166   3.192   0.034
  560   HD12  LEU  74          2HD1      LEU  74   2.766   2.156  -0.242
  561   HD13  LEU  74          3HD1      LEU  74   3.982   2.351  -1.505
  562   HD21  LEU  74          3HD2      LEU  74   4.979  -0.352  -1.410
  563   HD22  LEU  74          1HD2      LEU  74   3.268  -0.071  -1.095
  564   HD23  LEU  74          2HD2      LEU  74   4.231  -1.011   0.044
  565    H    LYS  75           H        LYS  75   9.077   1.211  -0.675
  566    HA   LYS  75           HA       LYS  75   9.782   3.995  -0.274
  567    HB2  LYS  75           2HB      LYS  75  11.824   3.236   0.628
  568    HB3  LYS  75           1HB      LYS  75  10.612   2.082   1.159
  569    HG2  LYS  75           2HG      LYS  75  11.717   0.404   0.231
  570    HG3  LYS  75           1HG      LYS  75  11.773   1.227  -1.327
  571    HD2  LYS  75           2HD      LYS  75  14.021   0.924  -0.753
  572    HD3  LYS  75           1HD      LYS  75  13.687   2.600  -0.316
  573    HE2  LYS  75           2HE      LYS  75  13.057   0.925   1.906
  574    HE3  LYS  75           1HE      LYS  75  14.670   0.515   1.328
  575    HZ1  LYS  75           3HZ      LYS  75  13.742   3.250   2.025
  576    HZ2  LYS  75           1HZ      LYS  75  15.299   2.831   1.510
  577    HZ3  LYS  75           2HZ      LYS  75  14.719   2.270   2.997
  578    H    ASN  76           H        ASN  76  10.042   1.715  -2.868
  579    HA   ASN  76           HA       ASN  76  12.230   3.009  -4.203
  580    HB2  ASN  76           2HB      ASN  76  11.817   0.637  -4.579
  581    HB3  ASN  76           1HB      ASN  76  10.212   0.989  -5.210
  582   HD21  ASN  76          1HD2      ASN  76  13.452   2.345  -5.790
  583   HD22  ASN  76          2HD2      ASN  76  13.398   2.160  -7.506
  584    H    THR  77           H        THR  77  11.090   5.166  -3.873
  585    HA   THR  77           HA       THR  77   9.508   5.779  -6.281
  586    HB   THR  77           HB       THR  77   8.310   7.497  -4.904
  587    HG1  THR  77           1HG      THR  77   8.457   7.277  -2.643
  588   HG21  THR  77          3HG2      THR  77   6.942   5.881  -3.571
  589   HG22  THR  77          1HG2      THR  77   8.067   4.619  -4.072
  590   HG23  THR  77          2HG2      THR  77   7.116   5.483  -5.279
  591    H    SER  78           H        SER  78   9.943   7.705  -7.330
  592    HA   SER  78           HA       SER  78  12.271   9.217  -6.333
  593    HG   SER  78           HG       SER  78  12.751  10.242  -9.591
  594    HB2  SER  78           2HB      SER  78  12.937   7.870  -8.244
  595    HB3  SER  78           1HB      SER  78  11.608   8.518  -9.203
  596    H    ASP  79           H        ASP  79  10.163   9.836  -9.138
  597    HA   ASP  79           HA       ASP  79   9.720  12.540  -8.119
  598    HB2  ASP  79           2HB      ASP  79   9.217  11.300 -10.831
  599    HB3  ASP  79           1HB      ASP  79   8.816  12.965 -10.422
  600    H    PHE  80           H        PHE  80   7.804   9.870  -9.504
  601    HA   PHE  80           HA       PHE  80   5.495  10.869  -7.974
  602    HD1  PHE  80           2HD      PHE  80   2.548   9.869  -9.068
  603    HD2  PHE  80           1HD      PHE  80   5.118  12.865 -10.657
  604    HE1  PHE  80           2HE      PHE  80   0.739  11.520  -8.868
  605    HE2  PHE  80           1HE      PHE  80   3.313  14.523 -10.454
  606    HZ   PHE  80           HZ       PHE  80   1.127  13.848  -9.551
  607    HB2  PHE  80           2HB      PHE  80   5.709  10.546 -10.784
  608    HB3  PHE  80           1HB      PHE  80   4.619   9.291 -10.197
  609    H    VAL  81           H        VAL  81   3.764   9.052  -7.715
  610    HA   VAL  81           HA       VAL  81   4.993   6.429  -7.355
  611    HB   VAL  81           HB       VAL  81   3.493   7.951  -5.207
  612   HG11  VAL  81          1HG1      VAL  81   2.804   5.773  -4.879
  613   HG12  VAL  81          2HG1      VAL  81   4.227   5.876  -3.842
  614   HG13  VAL  81          3HG1      VAL  81   4.339   5.092  -5.418
  615   HG21  VAL  81          3HG2      VAL  81   6.376   7.318  -5.624
  616   HG22  VAL  81          1HG2      VAL  81   5.740   7.399  -3.981
  617   HG23  VAL  81          2HG2      VAL  81   5.619   8.801  -5.043
  618    H    TYR  82           H        TYR  82   3.651   5.000  -8.354
  619    HA   TYR  82           HA       TYR  82   0.823   5.745  -8.613
  620    HD1  TYR  82           1HD      TYR  82  -0.078   2.414 -10.138
  621    HD2  TYR  82           2HD      TYR  82   0.498   6.338 -11.673
  622    HE1  TYR  82           1HE      TYR  82  -2.223   2.262 -11.312
  623    HE2  TYR  82           2HE      TYR  82  -1.653   6.198 -12.852
  624    HH   TYR  82           HH       TYR  82  -3.143   3.761 -13.685
  625    HB2  TYR  82           2HB      TYR  82   2.315   5.146 -10.638
  626    HB3  TYR  82           1HB      TYR  82   2.119   3.482 -10.103
  627    H    LEU  83           H        LEU  83  -0.124   5.089  -6.801
  628    HA   LEU  83           HA       LEU  83   0.410   2.495  -5.651
  629    HG   LEU  83           HG       LEU  83  -1.352   1.989  -3.827
  630    HB2  LEU  83           2HB      LEU  83  -0.026   4.558  -4.307
  631    HB3  LEU  83           1HB      LEU  83  -1.686   4.516  -4.867
  632   HD11  LEU  83          1HD1      LEU  83   0.062   3.936  -2.009
  633   HD12  LEU  83          2HD1      LEU  83   0.836   2.632  -2.910
  634   HD13  LEU  83          3HD1      LEU  83  -0.334   2.255  -1.645
  635   HD21  LEU  83          3HD2      LEU  83  -2.720   2.841  -1.960
  636   HD22  LEU  83          1HD2      LEU  83  -3.300   3.389  -3.534
  637   HD23  LEU  83          2HD2      LEU  83  -2.391   4.488  -2.498
  638    H    LYS  84           H        LYS  84  -0.614   0.677  -6.113
  639    HA   LYS  84           HA       LYS  84  -3.242   0.811  -7.426
  640    HB2  LYS  84           2HB      LYS  84  -1.083  -1.277  -7.702
  641    HB3  LYS  84           1HB      LYS  84  -2.700  -1.442  -8.359
  642    HG2  LYS  84           2HG      LYS  84  -1.522   1.051  -9.185
  643    HG3  LYS  84           1HG      LYS  84  -0.476  -0.309  -9.596
  644    HD2  LYS  84           2HD      LYS  84  -1.996   0.123 -11.424
  645    HD3  LYS  84           1HD      LYS  84  -2.403  -1.421 -10.674
  646    HE2  LYS  84           2HE      LYS  84  -4.382  -0.657  -9.849
  647    HE3  LYS  84           1HE      LYS  84  -3.787   0.989  -9.646
  648    HZ1  LYS  84           3HZ      LYS  84  -4.379  -0.222 -12.290
  649    HZ2  LYS  84           1HZ      LYS  84  -4.048   1.404 -11.955
  650    HZ3  LYS  84           2HZ      LYS  84  -5.491   0.705 -11.417
  651    H    VAL  85           H        VAL  85  -4.772   0.425  -5.974
  652    HA   VAL  85           HA       VAL  85  -4.224  -1.525  -3.847
  653    HB   VAL  85           HB       VAL  85  -6.314   0.662  -3.974
  654   HG11  VAL  85          1HG1      VAL  85  -6.680  -1.588  -2.596
  655   HG12  VAL  85          2HG1      VAL  85  -7.196  -0.013  -1.993
  656   HG13  VAL  85          3HG1      VAL  85  -5.681  -0.719  -1.430
  657   HG21  VAL  85          3HG2      VAL  85  -4.136   0.602  -1.953
  658   HG22  VAL  85          1HG2      VAL  85  -4.977   1.976  -2.671
  659   HG23  VAL  85          2HG2      VAL  85  -3.742   1.119  -3.594
  660    H    ALA  86           H        ALA  86  -5.419  -3.326  -3.612
  661    HA   ALA  86           HA       ALA  86  -7.252  -4.043  -5.741
  662    HB1  ALA  86           3HB      ALA  86  -6.327  -6.030  -5.361
  663    HB2  ALA  86           1HB      ALA  86  -7.220  -6.101  -3.842
  664    HB3  ALA  86           2HB      ALA  86  -5.579  -5.456  -3.872
  665    H    LYS  87           H        LYS  87  -9.431  -4.511  -5.519
  666    HA   LYS  87           HA       LYS  87 -10.679  -3.466  -3.072
  667    HB2  LYS  87           2HB      LYS  87 -11.130  -2.758  -5.673
  668    HB3  LYS  87           1HB      LYS  87 -12.404  -3.941  -5.408
  669    HG2  LYS  87           2HG      LYS  87 -12.172  -2.044  -3.219
  670    HG3  LYS  87           1HG      LYS  87 -12.500  -1.267  -4.769
  671    HD2  LYS  87           2HD      LYS  87 -14.486  -2.501  -5.082
  672    HD3  LYS  87           1HD      LYS  87 -14.073  -3.639  -3.797
  673    HE2  LYS  87           2HE      LYS  87 -14.566  -2.107  -2.114
  674    HE3  LYS  87           1HE      LYS  87 -14.438  -0.726  -3.203
  675    HZ1  LYS  87           3HZ      LYS  87 -16.740  -1.239  -2.605
  676    HZ2  LYS  87           1HZ      LYS  87 -16.590  -2.774  -3.300
  677    HZ3  LYS  87           2HZ      LYS  87 -16.481  -1.392  -4.268
  678    HA   PRO  88           HA       PRO  88 -11.672  -7.809  -2.342
  679    HB2  PRO  88           2HB      PRO  88 -12.589  -7.462   0.181
  680    HB3  PRO  88           1HB      PRO  88 -10.867  -7.501  -0.210
  681    HG2  PRO  88           2HG      PRO  88 -12.649  -5.141   0.255
  682    HG3  PRO  88           1HG      PRO  88 -11.001  -5.431   0.843
  683    HD2  PRO  88           2HD      PRO  88 -11.544  -3.849  -1.293
  684    HD3  PRO  88           1HD      PRO  88 -10.044  -4.785  -1.149
  685    H    THR  89           H        THR  89 -13.571  -9.007  -2.294
  686    HA   THR  89           HA       THR  89 -16.098  -7.498  -2.261
  687    HB   THR  89           HB       THR  89 -15.475  -9.747  -4.184
  688    HG1  THR  89           1HG      THR  89 -15.485  -6.942  -4.610
  689   HG21  THR  89          3HG2      THR  89 -17.442  -8.663  -5.410
  690   HG22  THR  89          1HG2      THR  89 -17.825  -7.928  -3.853
  691   HG23  THR  89          2HG2      THR  89 -17.788  -9.684  -4.014
  692    H    GLY  90           H        GLY  90 -14.963 -10.896  -2.465
  693    HA2  GLY  90           2HA      GLY  90 -15.708 -11.759   0.033
  694    HA3  GLY  90           1HA      GLY  90 -17.179 -11.853  -0.922
  695    H    SER  91           H        SER  91 -14.175 -13.320  -0.175
  696    HA   SER  91           HA       SER  91 -14.067 -15.078  -2.443
  697    HG   SER  91           HG       SER  91 -11.432 -15.473  -2.381
  698    HB2  SER  91           2HB      SER  91 -12.171 -14.300  -0.748
  699    HB3  SER  91           1HB      SER  91 -12.668 -15.763   0.103
  700    H    HIS  92           H        HIS  92 -15.232 -15.324   0.894
  701    HA   HIS  92           HA       HIS  92 -15.859 -18.108   0.733
  702    HD1  HIS  92           1HD      HIS  92 -15.344 -19.180   3.825
  703    HD2  HIS  92           2HD      HIS  92 -13.974 -15.337   3.039
  704    HE1  HIS  92           1HE      HIS  92 -13.073 -19.044   4.895
  705    HE2  HIS  92           2HE      HIS  92 -12.301 -16.683   4.481
  706    HB2  HIS  92           2HB      HIS  92 -16.740 -15.962   2.674
  707    HB3  HIS  92           1HB      HIS  92 -17.130 -17.670   2.852
  708    HA   ARG 301           HA       ARG 301   1.877 -10.969   9.974
  709    HE   ARG 301           HE       ARG 301  -0.488 -12.947  15.412
  710    H1   ARG 301           1HT      ARG 301   1.688 -13.147  11.042
  711    H2   ARG 301           2HT      ARG 301   2.904 -12.658  12.150
  712    H3   ARG 301           3HT      ARG 301   3.256 -12.753  10.474
  713    HB2  ARG 301           2HB      ARG 301   0.656  -9.806  11.867
  714    HB3  ARG 301           1HB      ARG 301   0.015 -11.370  11.388
  715    HG2  ARG 301           2HG      ARG 301   1.990 -11.412  13.576
  716    HG3  ARG 301           1HG      ARG 301   0.447 -10.636  13.937
  717    HD2  ARG 301           2HD      ARG 301  -0.123 -13.028  12.540
  718    HD3  ARG 301           1HD      ARG 301   1.070 -13.419  13.777
  719   HH11  ARG 301          1HH1      ARG 301  -1.759 -12.010  12.283
  720   HH12  ARG 301          2HH1      ARG 301  -3.372 -11.787  12.871
  721   HH21  ARG 301          1HH2      ARG 301  -2.615 -12.649  16.175
  722   HH22  ARG 301          2HH2      ARG 301  -3.858 -12.149  15.078
  723    H    ARG 302           H        ARG 302   2.944  -9.096   9.753
  724    HA   ARG 302           HA       ARG 302   4.535  -7.986  11.898
  725    HE   ARG 302           HE       ARG 302   8.459 -10.331  11.386
  726    HB2  ARG 302           2HB      ARG 302   6.089  -9.613  10.927
  727    HB3  ARG 302           1HB      ARG 302   5.845  -8.911   9.336
  728    HG2  ARG 302           2HG      ARG 302   6.973  -6.932   9.916
  729    HG3  ARG 302           1HG      ARG 302   6.921  -7.315  11.638
  730    HD2  ARG 302           2HD      ARG 302   8.427  -8.925   9.580
  731    HD3  ARG 302           1HD      ARG 302   9.151  -7.662  10.574
  732   HH11  ARG 302          1HH1      ARG 302   9.029  -7.062  12.510
  733   HH12  ARG 302          2HH1      ARG 302   9.435  -7.557  14.119
  734   HH21  ARG 302          1HH2      ARG 302   8.995 -10.974  13.506
  735   HH22  ARG 302          2HH2      ARG 302   9.418  -9.776  14.684
  736    H    GLU 303           H        GLU 303   4.749  -5.815  11.732
  737    HA   GLU 303           HA       GLU 303   3.876  -4.548   9.217
  738    HB2  GLU 303           2HB      GLU 303   3.391  -3.415  11.973
  739    HB3  GLU 303           1HB      GLU 303   2.727  -2.847  10.448
  740    HG2  GLU 303           2HG      GLU 303   0.920  -3.966  11.216
  741    HG3  GLU 303           1HG      GLU 303   1.729  -5.302  10.399
  742    H    THR 304           H        THR 304   4.890  -2.613   8.622
  743    HA   THR 304           HA       THR 304   7.037  -1.568  10.265
  744    HB   THR 304           HB       THR 304   7.495  -3.348   7.989
  745    HG1  THR 304           1HG      THR 304   8.605  -3.939   9.689
  746   HG21  THR 304          3HG2      THR 304   8.026  -1.364   6.757
  747   HG22  THR 304          1HG2      THR 304   9.515  -2.203   7.190
  748   HG23  THR 304          2HG2      THR 304   9.024  -0.763   8.083
  749    H    GLN 305           H        GLN 305   7.523   0.552   9.830
  750    HA   GLN 305           HA       GLN 305   5.656   1.976   8.168
  751    HB2  GLN 305           2HB      GLN 305   7.768   2.735  10.124
  752    HB3  GLN 305           1HB      GLN 305   7.279   3.934   8.933
  753    HG2  GLN 305           2HG      GLN 305   5.056   3.948   9.710
  754    HG3  GLN 305           1HG      GLN 305   5.301   2.490  10.667
  755   HE21  GLN 305          1HE2      GLN 305   4.202   4.769  11.759
  756   HE22  GLN 305          2HE2      GLN 305   5.307   5.446  12.903
  757    H    VAL 306           H        VAL 306   6.159   3.384   6.464
  758    HA   VAL 306           HA       VAL 306   8.765   3.013   5.171
  759    HB   VAL 306           HB       VAL 306   7.576   2.756   2.960
  760   HG11  VAL 306          1HG1      VAL 306   7.308   0.379   3.184
  761   HG12  VAL 306          2HG1      VAL 306   7.087   0.523   4.929
  762   HG13  VAL 306          3HG1      VAL 306   8.652   0.891   4.204
  763   HG21  VAL 306          3HG2      VAL 306   5.325   3.398   4.344
  764   HG22  VAL 306          1HG2      VAL 306   5.193   1.642   4.272
  765   HG23  VAL 306          2HG2      VAL 306   5.337   2.576   2.783
  Start of MODEL    7
    1    HA   MET   1           HA       MET   1  -9.830   4.488  -8.192
    2    H1   MET   1           1HT      MET   1  -9.806   1.695  -9.129
    3    H2   MET   1           2HT      MET   1  -9.837   3.089 -10.131
    4    H3   MET   1           3HT      MET   1 -11.154   2.752  -9.085
    5    HB2  MET   1           2HB      MET   1  -9.795   1.793  -6.851
    6    HB3  MET   1           1HB      MET   1  -9.153   3.212  -6.038
    7    HG2  MET   1           2HG      MET   1 -11.179   3.922  -5.491
    8    HG3  MET   1           1HG      MET   1 -11.774   3.724  -7.137
    9    HE1  MET   1           3HE      MET   1 -11.099   2.235  -3.744
   10    HE2  MET   1           1HE      MET   1 -10.457   0.805  -4.553
   11    HE3  MET   1           2HE      MET   1 -11.995   0.717  -3.695
   12    H    GLU   2           H        GLU   2  -7.957   5.425  -8.747
   13    HA   GLU   2           HA       GLU   2  -5.494   3.835  -8.486
   14    HB2  GLU   2           2HB      GLU   2  -4.531   5.160 -10.363
   15    HB3  GLU   2           1HB      GLU   2  -5.851   4.102 -10.838
   16    HG2  GLU   2           2HG      GLU   2  -6.723   6.784 -10.125
   17    HG3  GLU   2           1HG      GLU   2  -5.597   6.747 -11.481
   18    H    ILE   3           H        ILE   3  -4.154   4.580  -7.103
   19    HA   ILE   3           HA       ILE   3  -4.438   7.309  -6.066
   20    HB   ILE   3           HB       ILE   3  -2.793   5.026  -4.963
   21   HG12  ILE   3          2HG1      ILE   3  -4.760   5.458  -3.141
   22   HG13  ILE   3          1HG1      ILE   3  -5.622   5.823  -4.631
   23   HG21  ILE   3          1HG2      ILE   3  -2.840   6.471  -2.884
   24   HG22  ILE   3          2HG2      ILE   3  -3.396   7.780  -3.926
   25   HG23  ILE   3          3HG2      ILE   3  -1.823   7.036  -4.210
   26   HD11  ILE   3          3HD1      ILE   3  -4.070   3.373  -4.799
   27   HD12  ILE   3          1HD1      ILE   3  -5.762   3.677  -5.189
   28   HD13  ILE   3          2HD1      ILE   3  -5.288   3.341  -3.523
   29    H    LYS   4           H        LYS   4  -3.274   8.790  -7.166
   30    HA   LYS   4           HA       LYS   4  -0.551   8.062  -8.008
   31    HB2  LYS   4           2HB      LYS   4  -2.667   9.553  -9.266
   32    HB3  LYS   4           1HB      LYS   4  -1.260  10.588  -9.071
   33    HG2  LYS   4           2HG      LYS   4   0.018   9.363 -10.508
   34    HG3  LYS   4           1HG      LYS   4  -0.845   7.861 -10.170
   35    HD2  LYS   4           2HD      LYS   4  -2.703   8.545 -11.509
   36    HD3  LYS   4           1HD      LYS   4  -2.048  10.175 -11.682
   37    HE2  LYS   4           2HE      LYS   4  -0.217   8.076 -12.566
   38    HE3  LYS   4           1HE      LYS   4  -1.728   8.119 -13.473
   39    HZ1  LYS   4           3HZ      LYS   4   0.096  10.426 -13.053
   40    HZ2  LYS   4           1HZ      LYS   4  -1.347  10.457 -13.936
   41    HZ3  LYS   4           2HZ      LYS   4  -0.042   9.527 -14.479
   42    H    LEU   5           H        LEU   5   0.433   8.343  -6.083
   43    HA   LEU   5           HA       LEU   5   0.271  10.897  -4.697
   44    HG   LEU   5           HG       LEU   5  -0.839   9.037  -3.165
   45    HB2  LEU   5           2HB      LEU   5   1.367   8.220  -4.059
   46    HB3  LEU   5           1HB      LEU   5   2.124   9.593  -3.275
   47   HD11  LEU   5          1HD1      LEU   5  -0.191   8.437  -0.730
   48   HD12  LEU   5          2HD1      LEU   5   1.407   8.133  -1.412
   49   HD13  LEU   5          3HD1      LEU   5   0.011   7.230  -2.001
   50   HD21  LEU   5          3HD2      LEU   5   0.978  10.958  -1.728
   51   HD22  LEU   5          1HD2      LEU   5  -0.656  10.577  -1.183
   52   HD23  LEU   5          2HD2      LEU   5  -0.405  11.333  -2.756
   53    H    ILE   6           H        ILE   6   1.693  12.500  -4.759
   54    HA   ILE   6           HA       ILE   6   3.962  12.269  -6.565
   55    HB   ILE   6           HB       ILE   6   2.474  14.253  -6.693
   56   HG12  ILE   6          2HG1      ILE   6   5.318  14.912  -5.891
   57   HG13  ILE   6          1HG1      ILE   6   4.829  14.316  -7.474
   58   HG21  ILE   6          1HG2      ILE   6   3.717  15.235  -4.147
   59   HG22  ILE   6          2HG2      ILE   6   2.193  14.350  -4.149
   60   HG23  ILE   6          3HG2      ILE   6   2.326  15.877  -5.021
   61   HD11  ILE   6          3HD1      ILE   6   4.860  16.515  -7.956
   62   HD12  ILE   6          1HD1      ILE   6   4.560  16.999  -6.287
   63   HD13  ILE   6          2HD1      ILE   6   3.224  16.446  -7.299
   64    H    LYS   7           H        LYS   7   5.989  11.928  -5.891
   65    HA   LYS   7           HA       LYS   7   6.585  11.518  -3.156
   66    HB2  LYS   7           2HB      LYS   7   7.940  11.167  -5.698
   67    HB3  LYS   7           1HB      LYS   7   9.036  11.758  -4.458
   68    HG2  LYS   7           2HG      LYS   7   7.356   9.263  -4.363
   69    HG3  LYS   7           1HG      LYS   7   9.113   9.370  -4.484
   70    HD2  LYS   7           2HD      LYS   7   7.515  10.413  -2.146
   71    HD3  LYS   7           1HD      LYS   7   8.260   8.816  -2.197
   72    HE2  LYS   7           2HE      LYS   7  10.450   9.772  -2.358
   73    HE3  LYS   7           1HE      LYS   7   9.783  11.391  -2.561
   74    HZ1  LYS   7           3HZ      LYS   7   9.060  11.428  -0.336
   75    HZ2  LYS   7           1HZ      LYS   7  10.639  10.823  -0.283
   76    HZ3  LYS   7           2HZ      LYS   7   9.325   9.771  -0.122
   77    H    GLY   8           H        GLY   8   6.790  13.049  -1.697
   78    HA2  GLY   8           2HA      GLY   8   8.060  15.603  -2.470
   79    HA3  GLY   8           1HA      GLY   8   6.888  15.424  -1.173
   80    HA   PRO   9           HA       PRO   9  11.255  15.561   0.603
   81    HB2  PRO   9           2HB      PRO   9   9.743  17.111   2.638
   82    HB3  PRO   9           1HB      PRO   9  11.311  17.451   1.898
   83    HG2  PRO   9           2HG      PRO   9   9.148  18.842   1.205
   84    HG3  PRO   9           1HG      PRO   9  10.362  18.382  -0.002
   85    HD2  PRO   9           2HD      PRO   9   7.675  17.183   0.540
   86    HD3  PRO   9           1HD      PRO   9   8.488  17.474  -1.012
   87    H    LYS  10           H        LYS  10   8.129  15.227   2.291
   88    HA   LYS  10           HA       LYS  10   9.236  13.569   4.360
   89    HB2  LYS  10           2HB      LYS  10   7.016  15.108   4.234
   90    HB3  LYS  10           1HB      LYS  10   6.308  13.534   3.900
   91    HG2  LYS  10           2HG      LYS  10   8.081  13.264   6.105
   92    HG3  LYS  10           1HG      LYS  10   7.033  14.653   6.395
   93    HD2  LYS  10           2HD      LYS  10   5.542  12.421   5.319
   94    HD3  LYS  10           1HD      LYS  10   6.411  11.961   6.783
   95    HE2  LYS  10           2HE      LYS  10   4.793  14.483   6.665
   96    HE3  LYS  10           1HE      LYS  10   4.033  12.930   7.007
   97    HZ1  LYS  10           3HZ      LYS  10   4.586  14.009   9.055
   98    HZ2  LYS  10           1HZ      LYS  10   6.194  14.227   8.577
   99    HZ3  LYS  10           2HZ      LYS  10   5.603  12.670   8.873
  100    H    GLY  11           H        GLY  11   6.635  12.850   2.006
  101    HA2  GLY  11           2HA      GLY  11   6.872  10.992   0.454
  102    HA3  GLY  11           1HA      GLY  11   7.815  10.162   1.681
  103    H    LEU  12           H        LEU  12   6.369   8.382   1.301
  104    HA   LEU  12           HA       LEU  12   3.699   8.153   1.455
  105    HG   LEU  12           HG       LEU  12   5.127   6.657   0.072
  106    HB2  LEU  12           2HB      LEU  12   5.621   6.370   2.950
  107    HB3  LEU  12           1HB      LEU  12   3.990   5.944   2.471
  108   HD11  LEU  12          1HD1      LEU  12   7.195   4.852   1.155
  109   HD12  LEU  12          2HD1      LEU  12   7.308   6.546   1.635
  110   HD13  LEU  12          3HD1      LEU  12   7.312   6.112  -0.074
  111   HD21  LEU  12          3HD2      LEU  12   4.785   4.005   1.437
  112   HD22  LEU  12          1HD2      LEU  12   5.332   4.140  -0.234
  113   HD23  LEU  12          2HD2      LEU  12   3.751   4.766   0.228
  114    H    GLY  13           H        GLY  13   5.683   7.929   4.432
  115    HA2  GLY  13           2HA      GLY  13   5.251   8.640   6.572
  116    HA3  GLY  13           1HA      GLY  13   3.988   9.663   5.910
  117    H    PHE  14           H        PHE  14   4.402   6.115   6.043
  118    HA   PHE  14           HA       PHE  14   2.330   5.792   7.980
  119    HD1  PHE  14           2HD      PHE  14   2.387   2.890   5.199
  120    HD2  PHE  14           1HD      PHE  14   1.008   6.702   3.865
  121    HE1  PHE  14           2HE      PHE  14   2.771   2.216   2.870
  122    HE2  PHE  14           1HE      PHE  14   1.388   6.021   1.535
  123    HZ   PHE  14           HZ       PHE  14   2.268   3.779   1.035
  124    HB2  PHE  14           2HB      PHE  14   0.752   4.531   6.559
  125    HB3  PHE  14           1HB      PHE  14   0.874   6.217   6.087
  126    H    SER  15           H        SER  15   1.628   3.169   7.699
  127    HA   SER  15           HA       SER  15   4.155   1.751   7.375
  128    HG   SER  15           HG       SER  15   2.215   1.632  10.890
  129    HB2  SER  15           2HB      SER  15   3.094   0.258   9.307
  130    HB3  SER  15           1HB      SER  15   4.145   1.623   9.660
  131    H    ILE  16           H        ILE  16   3.710  -0.687   7.292
  132    HA   ILE  16           HA       ILE  16   1.116  -1.458   6.211
  133    HB   ILE  16           HB       ILE  16   2.329  -2.309   4.088
  134   HG12  ILE  16          2HG1      ILE  16   4.097  -0.029   4.007
  135   HG13  ILE  16          1HG1      ILE  16   4.482  -1.038   5.396
  136   HG21  ILE  16          1HG2      ILE  16   0.619  -0.457   4.250
  137   HG22  ILE  16          2HG2      ILE  16   1.715  -0.376   2.871
  138   HG23  ILE  16          3HG2      ILE  16   1.974   0.672   4.266
  139   HD11  ILE  16          3HD1      ILE  16   4.096  -2.681   3.098
  140   HD12  ILE  16          1HD1      ILE  16   5.529  -2.480   4.113
  141   HD13  ILE  16          2HD1      ILE  16   5.251  -1.397   2.743
  142    H    ALA  17           H        ALA  17   1.266  -3.740   5.350
  143    HA   ALA  17           HA       ALA  17   3.379  -5.385   6.530
  144    HB1  ALA  17           3HB      ALA  17   1.147  -6.949   6.893
  145    HB2  ALA  17           1HB      ALA  17   0.564  -5.345   7.345
  146    HB3  ALA  17           2HB      ALA  17   1.967  -6.039   8.159
  147    H    GLY  18           H        GLY  18   3.147  -7.730   5.459
  148    HA2  GLY  18           2HA      GLY  18   1.586  -8.209   3.267
  149    HA3  GLY  18           1HA      GLY  18   2.856  -7.200   2.626
  150    H    GLY  19           H        GLY  19   1.908 -10.285   2.581
  151    HA2  GLY  19           2HA      GLY  19   3.385 -11.835   1.490
  152    HA3  GLY  19           1HA      GLY  19   4.702 -11.202   2.462
  153    H    VAL  20           H        VAL  20   4.063 -13.941   2.177
  154    HA   VAL  20           HA       VAL  20   2.544 -14.928   4.349
  155    HB   VAL  20           HB       VAL  20   3.802 -17.080   3.976
  156   HG11  VAL  20          1HG1      VAL  20   2.928 -17.340   1.583
  157   HG12  VAL  20          2HG1      VAL  20   2.389 -15.668   1.738
  158   HG13  VAL  20          3HG1      VAL  20   1.771 -16.900   2.839
  159   HG21  VAL  20          3HG2      VAL  20   5.876 -15.852   3.125
  160   HG22  VAL  20          1HG2      VAL  20   5.024 -15.730   1.587
  161   HG23  VAL  20          2HG2      VAL  20   5.393 -17.314   2.267
  162    H    GLY  21           H        GLY  21   3.149 -15.603   6.411
  163    HA2  GLY  21           2HA      GLY  21   4.540 -15.912   8.262
  164    HA3  GLY  21           1HA      GLY  21   5.918 -15.455   7.272
  165    H    ASN  22           H        ASN  22   4.165 -13.010   6.514
  166    HA   ASN  22           HA       ASN  22   4.359 -11.435   8.960
  167    HB2  ASN  22           2HB      ASN  22   5.329  -9.595   7.271
  168    HB3  ASN  22           1HB      ASN  22   6.388 -10.669   8.165
  169   HD21  ASN  22          1HD2      ASN  22   4.564 -10.601   5.121
  170   HD22  ASN  22          2HD2      ASN  22   5.805 -11.336   4.173
  171    H    GLN  23           H        GLN  23   2.172 -12.553   7.251
  172    HA   GLN  23           HA       GLN  23   0.992 -10.574   5.662
  173    HB2  GLN  23           2HB      GLN  23  -0.444 -12.755   7.179
  174    HB3  GLN  23           1HB      GLN  23  -1.016 -11.914   5.747
  175    HG2  GLN  23           2HG      GLN  23   0.513 -13.004   4.354
  176    HG3  GLN  23           1HG      GLN  23   1.505 -13.534   5.711
  177   HE21  GLN  23          1HE2      GLN  23   0.657 -15.280   3.748
  178   HE22  GLN  23          2HE2      GLN  23  -0.468 -16.398   4.430
  179    H    HIS  24           H        HIS  24  -0.698  -9.173   5.990
  180    HA   HIS  24           HA       HIS  24  -0.900  -8.068   8.675
  181    HD1  HIS  24           1HD      HIS  24  -0.444  -5.244   8.937
  182    HD2  HIS  24           2HD      HIS  24  -4.183  -5.609   7.174
  183    HE1  HIS  24           1HE      HIS  24  -1.844  -3.458   9.974
  184    HE2  HIS  24           2HE      HIS  24  -4.077  -3.611   8.822
  185    HB2  HIS  24           2HB      HIS  24  -0.558  -6.618   6.650
  186    HB3  HIS  24           1HB      HIS  24  -2.169  -7.061   6.124
  187    H    ILE  25           H        ILE  25  -2.781  -9.989   6.498
  188    HA   ILE  25           HA       ILE  25  -4.890 -10.213   8.483
  189    HB   ILE  25           HB       ILE  25  -5.658  -9.570   5.636
  190   HG12  ILE  25          2HG1      ILE  25  -5.530  -7.708   8.019
  191   HG13  ILE  25          1HG1      ILE  25  -4.573  -7.590   6.547
  192   HG21  ILE  25          1HG2      ILE  25  -7.454 -10.660   6.568
  193   HG22  ILE  25          2HG2      ILE  25  -7.826  -8.985   6.976
  194   HG23  ILE  25          3HG2      ILE  25  -7.120 -10.051   8.189
  195   HD11  ILE  25          3HD1      ILE  25  -7.489  -7.046   6.935
  196   HD12  ILE  25          1HD1      ILE  25  -6.806  -7.340   5.336
  197   HD13  ILE  25          2HD1      ILE  25  -6.234  -5.981   6.304
  198    HA   PRO  26           HA       PRO  26  -4.328 -14.488   7.338
  199    HB2  PRO  26           2HB      PRO  26  -7.135 -14.673   8.330
  200    HB3  PRO  26           1HB      PRO  26  -5.722 -15.645   8.758
  201    HG2  PRO  26           2HG      PRO  26  -6.635 -13.779  10.419
  202    HG3  PRO  26           1HG      PRO  26  -4.893 -14.040  10.212
  203    HD2  PRO  26           2HD      PRO  26  -6.625 -11.856   9.146
  204    HD3  PRO  26           1HD      PRO  26  -4.941 -11.792   9.705
  205    H    GLY  27           H        GLY  27  -4.501 -15.271   5.342
  206    HA2  GLY  27           2HA      GLY  27  -5.835 -16.227   3.592
  207    HA3  GLY  27           1HA      GLY  27  -7.075 -15.031   3.932
  208    H    ASP  28           H        ASP  28  -6.009 -12.659   3.768
  209    HA   ASP  28           HA       ASP  28  -5.158 -12.476   0.999
  210    HB2  ASP  28           2HB      ASP  28  -6.878 -10.963   2.434
  211    HB3  ASP  28           1HB      ASP  28  -5.410 -10.007   2.617
  212    H    ASN  29           H        ASN  29  -3.072 -12.708   0.592
  213    HA   ASN  29           HA       ASN  29  -1.056 -11.909   2.527
  214    HB2  ASN  29           2HB      ASN  29  -0.452 -12.974  -0.211
  215    HB3  ASN  29           1HB      ASN  29   0.483 -13.136   1.272
  216   HD21  ASN  29          1HD2      ASN  29  -0.835 -15.026  -0.769
  217   HD22  ASN  29          2HD2      ASN  29  -1.626 -16.192   0.230
  218    H    SER  30           H        SER  30  -2.749  -9.986   0.677
  219    HA   SER  30           HA       SER  30  -0.657  -8.617  -0.787
  220    HG   SER  30           HG       SER  30  -2.534  -9.304  -2.333
  221    HB2  SER  30           2HB      SER  30  -3.462  -7.618  -0.245
  222    HB3  SER  30           1HB      SER  30  -2.370  -7.115  -1.535
  223    H    ILE  31           H        ILE  31  -0.069  -6.355  -0.340
  224    HA   ILE  31           HA       ILE  31   0.478  -6.011   2.416
  225    HB   ILE  31           HB       ILE  31   1.043  -4.396  -0.044
  226   HG12  ILE  31          2HG1      ILE  31   3.348  -4.797   0.540
  227   HG13  ILE  31          1HG1      ILE  31   2.883  -5.509   2.078
  228   HG21  ILE  31          1HG2      ILE  31   0.606  -2.622   1.418
  229   HG22  ILE  31          2HG2      ILE  31   2.355  -2.834   1.484
  230   HG23  ILE  31          3HG2      ILE  31   1.343  -3.453   2.788
  231   HD11  ILE  31          3HD1      ILE  31   3.441  -7.303   0.689
  232   HD12  ILE  31          1HD1      ILE  31   2.562  -6.629  -0.679
  233   HD13  ILE  31          2HD1      ILE  31   1.679  -7.277   0.702
  234    H    TYR  32           H        TYR  32  -0.557  -4.942   3.969
  235    HA   TYR  32           HA       TYR  32  -2.722  -3.077   3.242
  236    HD1  TYR  32           2HD      TYR  32  -2.601  -6.646   3.472
  237    HD2  TYR  32           1HD      TYR  32  -5.764  -4.039   4.567
  238    HE1  TYR  32           2HE      TYR  32  -4.166  -8.048   2.200
  239    HE2  TYR  32           1HE      TYR  32  -7.357  -5.421   3.315
  240    HH   TYR  32           HH       TYR  32  -7.218  -8.186   2.583
  241    HB2  TYR  32           2HB      TYR  32  -2.520  -5.058   5.504
  242    HB3  TYR  32           1HB      TYR  32  -3.678  -3.735   5.514
  243    H    VAL  33           H        VAL  33  -2.930  -1.194   4.481
  244    HA   VAL  33           HA       VAL  33  -0.508  -0.247   5.717
  245    HB   VAL  33           HB       VAL  33  -3.176   1.107   5.278
  246   HG11  VAL  33          1HG1      VAL  33  -2.132   3.177   5.967
  247   HG12  VAL  33          2HG1      VAL  33  -0.611   2.343   6.278
  248   HG13  VAL  33          3HG1      VAL  33  -2.024   1.999   7.275
  249   HG21  VAL  33          3HG2      VAL  33  -1.539   2.500   3.761
  250   HG22  VAL  33          1HG2      VAL  33  -2.244   0.991   3.186
  251   HG23  VAL  33          2HG2      VAL  33  -0.592   1.015   3.799
  252    H    THR  34           H        THR  34  -0.073  -0.153   7.820
  253    HA   THR  34           HA       THR  34  -2.123  -1.097   9.688
  254    HB   THR  34           HB       THR  34  -0.492  -2.089  10.915
  255    HG1  THR  34           1HG      THR  34   1.318  -0.050  10.147
  256   HG21  THR  34          3HG2      THR  34   1.291  -2.990   9.630
  257   HG22  THR  34          1HG2      THR  34   1.188  -1.680   8.459
  258   HG23  THR  34          2HG2      THR  34  -0.117  -2.860   8.578
  259    H    LYS  35           H        LYS  35  -0.156   1.750   9.081
  260    HA   LYS  35           HA       LYS  35  -1.740   3.300  10.906
  261    HB2  LYS  35           2HB      LYS  35   1.173   2.844  11.574
  262    HB3  LYS  35           1HB      LYS  35   0.191   4.117  12.273
  263    HG2  LYS  35           2HG      LYS  35  -1.346   2.288  13.109
  264    HG3  LYS  35           1HG      LYS  35  -0.075   1.153  12.650
  265    HD2  LYS  35           2HD      LYS  35   1.489   2.258  14.137
  266    HD3  LYS  35           1HD      LYS  35   0.277   3.473  14.546
  267    HE2  LYS  35           2HE      LYS  35  -0.588   2.162  16.118
  268    HE3  LYS  35           1HE      LYS  35  -0.788   0.840  14.969
  269    HZ1  LYS  35           3HZ      LYS  35   1.491   0.173  15.379
  270    HZ2  LYS  35           1HZ      LYS  35   0.628   0.218  16.835
  271    HZ3  LYS  35           2HZ      LYS  35   1.710   1.461  16.454
  272    H    ILE  36           H        ILE  36  -1.959   5.270  10.022
  273    HA   ILE  36           HA       ILE  36   0.053   6.125   8.072
  274    HB   ILE  36           HB       ILE  36  -2.837   6.841   8.448
  275   HG12  ILE  36          2HG1      ILE  36  -1.262   6.054   5.988
  276   HG13  ILE  36          1HG1      ILE  36  -2.094   4.902   7.026
  277   HG21  ILE  36          1HG2      ILE  36  -2.470   8.515   6.576
  278   HG22  ILE  36          2HG2      ILE  36  -0.753   8.426   6.966
  279   HG23  ILE  36          3HG2      ILE  36  -1.904   8.992   8.177
  280   HD11  ILE  36          3HD1      ILE  36  -3.757   7.115   6.068
  281   HD12  ILE  36          1HD1      ILE  36  -4.096   5.388   6.164
  282   HD13  ILE  36          2HD1      ILE  36  -3.155   6.026   4.817
  283    H    ILE  37           H        ILE  37   1.435   7.715   8.534
  284    HA   ILE  37           HA       ILE  37   1.325   9.070  11.066
  285    HB   ILE  37           HB       ILE  37   3.268   9.027   8.777
  286   HG12  ILE  37          2HG1      ILE  37   4.718   8.583  10.988
  287   HG13  ILE  37          1HG1      ILE  37   3.145   8.068  11.587
  288   HG21  ILE  37          1HG2      ILE  37   3.242  11.016  11.027
  289   HG22  ILE  37          2HG2      ILE  37   3.337  11.323   9.293
  290   HG23  ILE  37          3HG2      ILE  37   4.704  10.597  10.135
  291   HD11  ILE  37          3HD1      ILE  37   4.552   6.248  10.648
  292   HD12  ILE  37          1HD1      ILE  37   4.406   7.017   9.068
  293   HD13  ILE  37          2HD1      ILE  37   2.968   6.407   9.887
  294    H    GLU  38           H        GLU  38   1.128  11.303  11.418
  295    HA   GLU  38           HA       GLU  38  -0.786  12.650   9.873
  296    HB2  GLU  38           2HB      GLU  38   1.053  13.461  12.092
  297    HB3  GLU  38           1HB      GLU  38   0.139  14.695  11.235
  298    HG2  GLU  38           2HG      GLU  38  -1.909  13.850  11.952
  299    HG3  GLU  38           1HG      GLU  38  -1.216  12.289  12.389
  300    H    GLY  39           H        GLY  39  -0.676  14.345   8.433
  301    HA2  GLY  39           2HA      GLY  39   0.160  15.619   6.728
  302    HA3  GLY  39           1HA      GLY  39   1.624  15.753   7.684
  303    H    GLY  40           H        GLY  40   0.609  12.563   6.762
  304    HA2  GLY  40           2HA      GLY  40   2.958  12.354   5.037
  305    HA3  GLY  40           1HA      GLY  40   2.022  11.017   5.685
  306    H    ALA  41           H        ALA  41   2.750  10.894   3.103
  307    HA   ALA  41           HA       ALA  41   1.301  12.003   1.087
  308    HB1  ALA  41           3HB      ALA  41   3.118  10.347   0.809
  309    HB2  ALA  41           1HB      ALA  41   1.719  10.018  -0.211
  310    HB3  ALA  41           2HB      ALA  41   1.984   9.071   1.254
  311    H    ALA  42           H        ALA  42   0.326   8.949   2.692
  312    HA   ALA  42           HA       ALA  42  -2.209   8.818   1.464
  313    HB1  ALA  42           3HB      ALA  42  -2.727   7.191   3.329
  314    HB2  ALA  42           1HB      ALA  42  -1.107   7.520   3.944
  315    HB3  ALA  42           2HB      ALA  42  -1.316   6.814   2.342
  316    H    HIS  43           H        HIS  43  -1.256   9.926   4.711
  317    HA   HIS  43           HA       HIS  43  -3.725  10.545   5.766
  318    HD1  HIS  43           1HD      HIS  43  -2.454  14.249   6.946
  319    HD2  HIS  43           2HD      HIS  43  -3.416  10.803   9.058
  320    HE1  HIS  43           1HE      HIS  43  -3.690  15.037   8.986
  321    HE2  HIS  43           2HE      HIS  43  -4.197  12.940  10.290
  322    HB2  HIS  43           2HB      HIS  43  -1.547  10.633   6.977
  323    HB3  HIS  43           1HB      HIS  43  -1.191  12.147   6.157
  324    H    LYS  44           H        LYS  44  -1.606  12.729   3.903
  325    HA   LYS  44           HA       LYS  44  -3.411  14.915   3.912
  326    HB2  LYS  44           2HB      LYS  44  -1.106  14.294   2.058
  327    HB3  LYS  44           1HB      LYS  44  -1.949  15.835   2.126
  328    HG2  LYS  44           2HG      LYS  44  -1.182  15.276   4.760
  329    HG3  LYS  44           1HG      LYS  44   0.204  14.857   3.752
  330    HD2  LYS  44           2HD      LYS  44  -0.413  17.184   2.620
  331    HD3  LYS  44           1HD      LYS  44  -1.084  17.491   4.224
  332    HE2  LYS  44           2HE      LYS  44   1.007  17.199   5.267
  333    HE3  LYS  44           1HE      LYS  44   1.707  16.446   3.835
  334    HZ1  LYS  44           3HZ      LYS  44   0.895  19.294   4.077
  335    HZ2  LYS  44           1HZ      LYS  44   1.547  18.576   2.691
  336    HZ3  LYS  44           2HZ      LYS  44   2.483  18.712   4.094
  337    H    ASP  45           H        ASP  45  -2.818  12.298   1.598
  338    HA   ASP  45           HA       ASP  45  -4.410  13.264  -0.504
  339    HB2  ASP  45           2HB      ASP  45  -2.738  11.256  -0.408
  340    HB3  ASP  45           1HB      ASP  45  -4.156  10.326   0.060
  341    H    GLY  46           H        GLY  46  -5.208  10.922   2.062
  342    HA2  GLY  46           2HA      GLY  46  -7.270  10.809   3.210
  343    HA3  GLY  46           1HA      GLY  46  -7.999  11.796   1.954
  344    H    LYS  47           H        LYS  47  -6.796  10.014  -0.158
  345    HA   LYS  47           HA       LYS  47  -9.000   8.290  -0.509
  346    HB2  LYS  47           2HB      LYS  47  -7.468   9.253  -2.302
  347    HB3  LYS  47           1HB      LYS  47  -6.321   7.994  -1.866
  348    HG2  LYS  47           2HG      LYS  47  -7.685   6.296  -2.674
  349    HG3  LYS  47           1HG      LYS  47  -9.134   7.302  -2.621
  350    HD2  LYS  47           2HD      LYS  47  -8.591   8.420  -4.569
  351    HD3  LYS  47           1HD      LYS  47  -6.868   8.082  -4.405
  352    HE2  LYS  47           2HE      LYS  47  -7.479   6.678  -6.137
  353    HE3  LYS  47           1HE      LYS  47  -7.575   5.609  -4.738
  354    HZ1  LYS  47           3HZ      LYS  47  -9.860   5.607  -4.785
  355    HZ2  LYS  47           1HZ      LYS  47  -9.501   5.667  -6.437
  356    HZ3  LYS  47           2HZ      LYS  47  -9.972   7.072  -5.624
  357    H    LEU  48           H        LEU  48  -5.694   7.717   0.638
  358    HA   LEU  48           HA       LEU  48  -6.225   4.888   1.022
  359    HG   LEU  48           HG       LEU  48  -4.434   3.554   0.824
  360    HB2  LEU  48           2HB      LEU  48  -3.972   6.109   0.332
  361    HB3  LEU  48           1HB      LEU  48  -3.756   6.183   2.069
  362   HD11  LEU  48          1HD1      LEU  48  -1.791   4.965   0.645
  363   HD12  LEU  48          2HD1      LEU  48  -2.688   4.125  -0.621
  364   HD13  LEU  48          3HD1      LEU  48  -1.906   3.205   0.664
  365   HD21  LEU  48          3HD2      LEU  48  -3.369   2.656   2.691
  366   HD22  LEU  48          1HD2      LEU  48  -4.250   4.047   3.323
  367   HD23  LEU  48          2HD2      LEU  48  -2.510   4.157   3.045
  368    H    GLN  49           H        GLN  49  -6.876   3.979   2.840
  369    HA   GLN  49           HA       GLN  49  -6.582   5.400   5.387
  370    HB2  GLN  49           2HB      GLN  49  -8.861   4.746   6.021
  371    HB3  GLN  49           1HB      GLN  49  -8.862   5.804   4.620
  372    HG2  GLN  49           2HG      GLN  49  -8.936   2.843   4.249
  373    HG3  GLN  49           1HG      GLN  49 -10.402   3.716   4.685
  374   HE21  GLN  49          1HE2      GLN  49  -8.498   2.659   2.164
  375   HE22  GLN  49          2HE2      GLN  49  -9.152   3.643   0.903
  376    H    ILE  50           H        ILE  50  -6.339   4.069   7.202
  377    HA   ILE  50           HA       ILE  50  -4.947   1.714   6.954
  378    HB   ILE  50           HB       ILE  50  -6.787   2.237   9.291
  379   HG12  ILE  50          2HG1      ILE  50  -5.592   4.294   8.974
  380   HG13  ILE  50          1HG1      ILE  50  -4.822   3.439  10.306
  381   HG21  ILE  50          1HG2      ILE  50  -5.279   0.078   8.858
  382   HG22  ILE  50          2HG2      ILE  50  -5.564   0.738  10.469
  383   HG23  ILE  50          3HG2      ILE  50  -4.068   1.115   9.613
  384   HD11  ILE  50          3HD1      ILE  50  -3.794   3.339   7.487
  385   HD12  ILE  50          1HD1      ILE  50  -2.976   2.830   8.965
  386   HD13  ILE  50          2HD1      ILE  50  -3.280   4.542   8.669
  387    H    GLY  51           H        GLY  51  -5.456  -0.280   6.255
  388    HA2  GLY  51           2HA      GLY  51  -6.927  -2.223   6.709
  389    HA3  GLY  51           1HA      GLY  51  -8.277  -1.137   6.459
  390    H    ASP  52           H        ASP  52  -6.700   0.128   4.118
  391    HA   ASP  52           HA       ASP  52  -7.857  -1.501   2.124
  392    HB2  ASP  52           2HB      ASP  52  -6.540   0.033   0.544
  393    HB3  ASP  52           1HB      ASP  52  -7.764   0.766   1.569
  394    H    LYS  53           H        LYS  53  -6.742  -2.490   0.312
  395    HA   LYS  53           HA       LYS  53  -4.228  -3.750   1.170
  396    HB2  LYS  53           2HB      LYS  53  -4.921  -5.450  -0.690
  397    HB3  LYS  53           1HB      LYS  53  -5.658  -5.531   0.897
  398    HG2  LYS  53           2HG      LYS  53  -7.033  -3.879  -1.132
  399    HG3  LYS  53           1HG      LYS  53  -7.060  -5.628  -1.355
  400    HD2  LYS  53           2HD      LYS  53  -8.197  -5.990   0.650
  401    HD3  LYS  53           1HD      LYS  53  -7.762  -4.405   1.291
  402    HE2  LYS  53           2HE      LYS  53  -9.472  -4.637  -1.155
  403    HE3  LYS  53           1HE      LYS  53 -10.180  -4.824   0.448
  404    HZ1  LYS  53           3HZ      LYS  53  -8.754  -2.448  -0.613
  405    HZ2  LYS  53           1HZ      LYS  53  -9.206  -2.624   1.009
  406    HZ3  LYS  53           2HZ      LYS  53 -10.389  -2.560  -0.198
  407    H    LEU  54           H        LEU  54  -2.583  -4.053  -0.272
  408    HA   LEU  54           HA       LEU  54  -2.520  -2.083  -2.440
  409    HG   LEU  54           HG       LEU  54  -1.043  -0.526  -1.551
  410    HB2  LEU  54           2HB      LEU  54  -0.670  -2.795  -0.445
  411    HB3  LEU  54           1HB      LEU  54   0.034  -3.307  -1.969
  412   HD11  LEU  54          1HD1      LEU  54   1.844  -0.751  -1.544
  413   HD12  LEU  54          2HD1      LEU  54   1.109  -1.578  -0.172
  414   HD13  LEU  54          3HD1      LEU  54   0.774   0.130  -0.455
  415   HD21  LEU  54          3HD2      LEU  54   0.769  -0.192  -3.393
  416   HD22  LEU  54          1HD2      LEU  54  -0.816  -0.836  -3.820
  417   HD23  LEU  54          2HD2      LEU  54   0.561  -1.925  -3.645
  418    H    LEU  55           H        LEU  55  -2.829  -2.703  -4.426
  419    HA   LEU  55           HA       LEU  55  -2.542  -5.481  -5.211
  420    HG   LEU  55           HG       LEU  55  -3.534  -6.042  -7.394
  421    HB2  LEU  55           2HB      LEU  55  -4.484  -4.106  -5.937
  422    HB3  LEU  55           1HB      LEU  55  -3.394  -3.095  -6.858
  423   HD11  LEU  55          1HD1      LEU  55  -5.444  -5.935  -8.589
  424   HD12  LEU  55          2HD1      LEU  55  -5.182  -4.258  -9.067
  425   HD13  LEU  55          3HD1      LEU  55  -5.812  -4.630  -7.463
  426   HD21  LEU  55          3HD2      LEU  55  -3.131  -4.927  -9.757
  427   HD22  LEU  55          1HD2      LEU  55  -1.805  -5.219  -8.632
  428   HD23  LEU  55          2HD2      LEU  55  -2.515  -3.610  -8.761
  429    H    ALA  56           H        ALA  56  -1.352  -2.320  -6.444
  430    HA   ALA  56           HA       ALA  56   1.200  -3.651  -7.056
  431    HB1  ALA  56           3HB      ALA  56   1.212  -2.548  -9.336
  432    HB2  ALA  56           1HB      ALA  56  -0.499  -2.198  -9.090
  433    HB3  ALA  56           2HB      ALA  56   0.057  -3.871  -9.147
  434    H    VAL  57           H        VAL  57   3.006  -2.309  -7.081
  435    HA   VAL  57           HA       VAL  57   2.550   0.528  -6.388
  436    HB   VAL  57           HB       VAL  57   4.834  -1.093  -5.272
  437   HG11  VAL  57          1HG1      VAL  57   3.630   1.540  -4.428
  438   HG12  VAL  57          2HG1      VAL  57   5.117   1.340  -5.354
  439   HG13  VAL  57          3HG1      VAL  57   5.024   0.749  -3.695
  440   HG21  VAL  57          3HG2      VAL  57   2.277  -1.645  -4.596
  441   HG22  VAL  57          1HG2      VAL  57   2.646  -0.357  -3.449
  442   HG23  VAL  57          2HG2      VAL  57   3.649  -1.806  -3.502
  443    H    ASN  58           H        ASN  58   3.254   1.689  -8.080
  444    HA   ASN  58           HA       ASN  58   4.598   2.541  -9.700
  445    HB2  ASN  58           2HB      ASN  58   6.433   1.448  -7.712
  446    HB3  ASN  58           1HB      ASN  58   7.135   1.472  -9.326
  447   HD21  ASN  58          1HD2      ASN  58   7.472   3.443 -10.358
  448   HD22  ASN  58          2HD2      ASN  58   7.439   4.943  -9.502
  449    H    ASN  59           H        ASN  59   3.116   0.355 -10.425
  450    HA   ASN  59           HA       ASN  59   2.872  -0.847 -12.367
  451    HB2  ASN  59           2HB      ASN  59   5.035   0.490 -13.085
  452    HB3  ASN  59           1HB      ASN  59   5.806  -1.077 -12.866
  453   HD21  ASN  59          1HD2      ASN  59   3.512   0.763 -14.719
  454   HD22  ASN  59          2HD2      ASN  59   3.350  -0.367 -16.016
  455    H    VAL  60           H        VAL  60   4.999  -1.776  -9.787
  456    HA   VAL  60           HA       VAL  60   5.012  -4.572 -10.630
  457    HB   VAL  60           HB       VAL  60   6.407  -5.035  -8.723
  458   HG11  VAL  60          1HG1      VAL  60   7.607  -4.225 -10.615
  459   HG12  VAL  60          2HG1      VAL  60   8.322  -3.493  -9.179
  460   HG13  VAL  60          3HG1      VAL  60   7.240  -2.550 -10.203
  461   HG21  VAL  60          3HG2      VAL  60   6.449  -3.847  -6.848
  462   HG22  VAL  60          1HG2      VAL  60   5.150  -2.868  -7.527
  463   HG23  VAL  60          2HG2      VAL  60   6.828  -2.362  -7.719
  464    H    CYS  61           H        CYS  61   4.155  -6.276  -9.270
  465    HA   CYS  61           HA       CYS  61   1.689  -5.439  -7.969
  466    HG   CYS  61           HG       CYS  61   3.716  -8.578  -9.491
  467    HB2  CYS  61           2HB      CYS  61   1.165  -7.853  -7.884
  468    HB3  CYS  61           1HB      CYS  61   1.512  -7.288  -9.513
  469    H    LEU  62           H        LEU  62   1.369  -5.362  -5.835
  470    HA   LEU  62           HA       LEU  62   3.536  -6.288  -4.089
  471    HG   LEU  62           HG       LEU  62   3.382  -5.259  -1.703
  472    HB2  LEU  62           2HB      LEU  62   2.536  -3.832  -4.213
  473    HB3  LEU  62           1HB      LEU  62   1.366  -4.510  -3.100
  474   HD11  LEU  62          1HD1      LEU  62   4.689  -3.727  -3.852
  475   HD12  LEU  62          2HD1      LEU  62   5.312  -5.032  -2.842
  476   HD13  LEU  62          3HD1      LEU  62   5.243  -3.386  -2.214
  477   HD21  LEU  62          3HD2      LEU  62   3.404  -3.237  -0.504
  478   HD22  LEU  62          1HD2      LEU  62   1.817  -3.306  -1.268
  479   HD23  LEU  62          2HD2      LEU  62   3.080  -2.282  -1.947
  480    H    GLU  63           H        GLU  63   1.458  -8.069  -5.186
  481    HA   GLU  63           HA       GLU  63   0.029  -8.777  -2.709
  482    HB2  GLU  63           2HB      GLU  63  -0.660  -9.435  -5.574
  483    HB3  GLU  63           1HB      GLU  63  -1.572  -9.967  -4.168
  484    HG2  GLU  63           2HG      GLU  63  -1.858  -7.512  -3.604
  485    HG3  GLU  63           1HG      GLU  63  -1.243  -7.177  -5.221
  486    H    GLU  64           H        GLU  64   2.379  -9.921  -4.989
  487    HA   GLU  64           HA       GLU  64   2.348 -12.538  -3.638
  488    HB2  GLU  64           2HB      GLU  64   3.587 -13.108  -5.998
  489    HB3  GLU  64           1HB      GLU  64   1.883 -13.380  -5.673
  490    HG2  GLU  64           2HG      GLU  64   1.313 -11.273  -6.709
  491    HG3  GLU  64           1HG      GLU  64   3.020 -10.911  -6.961
  492    H    VAL  65           H        VAL  65   3.753 -10.642  -2.444
  493    HA   VAL  65           HA       VAL  65   6.516 -11.504  -2.875
  494    HB   VAL  65           HB       VAL  65   7.333  -9.143  -2.579
  495   HG11  VAL  65          1HG1      VAL  65   7.325 -10.336  -4.749
  496   HG12  VAL  65          2HG1      VAL  65   7.151  -8.589  -4.918
  497   HG13  VAL  65          3HG1      VAL  65   5.743  -9.635  -5.095
  498   HG21  VAL  65          3HG2      VAL  65   4.446  -8.504  -3.182
  499   HG22  VAL  65          1HG2      VAL  65   5.767  -7.339  -3.267
  500   HG23  VAL  65          2HG2      VAL  65   5.349  -8.087  -1.726
  501    H    THR  66           H        THR  66   7.901 -11.252  -1.099
  502    HA   THR  66           HA       THR  66   6.696 -11.569   1.447
  503    HB   THR  66           HB       THR  66   9.055 -11.395   2.309
  504    HG1  THR  66           1HG      THR  66  10.032 -10.047   0.882
  505   HG21  THR  66          3HG2      THR  66   9.926 -13.384   1.245
  506   HG22  THR  66          1HG2      THR  66   8.751 -13.224  -0.060
  507   HG23  THR  66          2HG2      THR  66   8.204 -13.565   1.581
  508    H    HIS  67           H        HIS  67   7.409 -10.159   3.378
  509    HA   HIS  67           HA       HIS  67   6.320  -7.619   3.024
  510    HD1  HIS  67           1HD      HIS  67   4.926  -6.831   5.939
  511    HD2  HIS  67           2HD      HIS  67   8.808  -5.524   5.307
  512    HE1  HIS  67           1HE      HIS  67   4.938  -4.405   6.578
  513    HE2  HIS  67           2HE      HIS  67   7.241  -3.605   6.005
  514    HB2  HIS  67           2HB      HIS  67   6.436  -8.679   5.240
  515    HB3  HIS  67           1HB      HIS  67   8.169  -8.385   5.298
  516    H    GLU  68           H        GLU  68   9.726  -8.600   2.938
  517    HA   GLU  68           HA       GLU  68  11.010  -6.188   2.941
  518    HB2  GLU  68           2HB      GLU  68  11.580  -8.484   1.052
  519    HB3  GLU  68           1HB      GLU  68  12.701  -7.192   1.458
  520    HG2  GLU  68           2HG      GLU  68  13.475  -8.675   2.946
  521    HG3  GLU  68           1HG      GLU  68  12.122  -8.109   3.923
  522    H    GLU  69           H        GLU  69   9.645  -7.777   0.057
  523    HA   GLU  69           HA       GLU  69  10.107  -5.683  -1.751
  524    HB2  GLU  69           2HB      GLU  69   9.119  -8.206  -1.979
  525    HB3  GLU  69           1HB      GLU  69   7.659  -7.259  -2.221
  526    HG2  GLU  69           2HG      GLU  69  10.212  -6.889  -3.768
  527    HG3  GLU  69           1HG      GLU  69   8.830  -7.834  -4.317
  528    H    ALA  70           H        ALA  70   7.499  -6.188   0.557
  529    HA   ALA  70           HA       ALA  70   5.601  -4.355  -0.402
  530    HB1  ALA  70           3HB      ALA  70   5.146  -5.938   1.410
  531    HB2  ALA  70           1HB      ALA  70   4.777  -4.284   1.901
  532    HB3  ALA  70           2HB      ALA  70   6.252  -5.059   2.461
  533    H    VAL  71           H        VAL  71   8.366  -3.930   1.758
  534    HA   VAL  71           HA       VAL  71   7.930  -1.083   2.034
  535    HB   VAL  71           HB       VAL  71  10.177  -2.874   2.978
  536   HG11  VAL  71          1HG1      VAL  71  11.343  -0.911   2.853
  537   HG12  VAL  71          2HG1      VAL  71  10.605  -0.720   4.442
  538   HG13  VAL  71          3HG1      VAL  71   9.903   0.089   3.041
  539   HG21  VAL  71          3HG2      VAL  71   9.034  -3.128   4.882
  540   HG22  VAL  71          1HG2      VAL  71   7.640  -2.543   3.975
  541   HG23  VAL  71          2HG2      VAL  71   8.591  -1.423   4.948
  542    H    THR  72           H        THR  72  10.023  -3.229   0.189
  543    HA   THR  72           HA       THR  72  11.834  -1.316  -0.779
  544    HB   THR  72           HB       THR  72  10.918  -3.913  -2.029
  545    HG1  THR  72           1HG      THR  72  13.107  -3.274  -0.343
  546   HG21  THR  72          3HG2      THR  72  13.314  -2.205  -2.654
  547   HG22  THR  72          1HG2      THR  72  12.013  -2.677  -3.749
  548   HG23  THR  72          2HG2      THR  72  13.144  -3.889  -3.145
  549    H    ALA  73           H        ALA  73   8.685  -2.395  -1.997
  550    HA   ALA  73           HA       ALA  73   8.844  -0.891  -4.423
  551    HB1  ALA  73           3HB      ALA  73   7.463  -3.004  -3.979
  552    HB2  ALA  73           1HB      ALA  73   6.711  -1.709  -4.910
  553    HB3  ALA  73           2HB      ALA  73   6.302  -1.923  -3.208
  554    H    LEU  74           H        LEU  74   7.428  -0.393  -1.208
  555    HA   LEU  74           HA       LEU  74   6.013   1.986  -1.902
  556    HG   LEU  74           HG       LEU  74   4.801   0.072   1.086
  557    HB2  LEU  74           2HB      LEU  74   6.912   0.778   0.706
  558    HB3  LEU  74           1HB      LEU  74   6.118   2.337   0.644
  559   HD11  LEU  74          1HD1      LEU  74   3.749   2.355  -0.572
  560   HD12  LEU  74          2HD1      LEU  74   3.851   2.303   1.188
  561   HD13  LEU  74          3HD1      LEU  74   2.770   1.202   0.335
  562   HD21  LEU  74          3HD2      LEU  74   3.778  -0.854  -0.832
  563   HD22  LEU  74          1HD2      LEU  74   5.510  -0.824  -1.156
  564   HD23  LEU  74          2HD2      LEU  74   4.458   0.389  -1.884
  565    H    LYS  75           H        LYS  75   9.276   1.210  -0.933
  566    HA   LYS  75           HA       LYS  75   9.959   4.011  -0.480
  567    HB2  LYS  75           2HB      LYS  75  12.005   3.273   0.385
  568    HB3  LYS  75           1HB      LYS  75  10.848   2.056   0.905
  569    HG2  LYS  75           2HG      LYS  75  11.657   0.469  -0.592
  570    HG3  LYS  75           1HG      LYS  75  12.453   1.680  -1.596
  571    HD2  LYS  75           2HD      LYS  75  14.223   0.695  -0.455
  572    HD3  LYS  75           1HD      LYS  75  13.890   2.143   0.495
  573    HE2  LYS  75           2HE      LYS  75  12.628   0.844   2.099
  574    HE3  LYS  75           1HE      LYS  75  12.826  -0.608   1.118
  575    HZ1  LYS  75           3HZ      LYS  75  15.178  -0.563   1.521
  576    HZ2  LYS  75           1HZ      LYS  75  14.373  -0.497   3.008
  577    HZ3  LYS  75           2HZ      LYS  75  15.062   0.904   2.356
  578    H    ASN  76           H        ASN  76  10.065   1.745  -3.088
  579    HA   ASN  76           HA       ASN  76  12.222   3.033  -4.499
  580    HB2  ASN  76           2HB      ASN  76  11.594   0.587  -4.729
  581    HB3  ASN  76           1HB      ASN  76  10.189   1.113  -5.649
  582   HD21  ASN  76          1HD2      ASN  76  10.422   1.302  -7.770
  583   HD22  ASN  76          2HD2      ASN  76  11.927   1.395  -8.614
  584    H    THR  77           H        THR  77  10.976   5.152  -4.066
  585    HA   THR  77           HA       THR  77   9.328   5.747  -6.434
  586    HB   THR  77           HB       THR  77   8.230   7.513  -4.972
  587    HG1  THR  77           1HG      THR  77   9.651   7.558  -3.249
  588   HG21  THR  77          3HG2      THR  77   7.777   4.702  -4.012
  589   HG22  THR  77          1HG2      THR  77   7.129   5.355  -5.517
  590   HG23  THR  77          2HG2      THR  77   6.641   6.051  -3.972
  591    H    SER  78           H        SER  78   9.848   7.532  -7.592
  592    HA   SER  78           HA       SER  78  12.180   9.078  -6.669
  593    HG   SER  78           HG       SER  78  12.871   6.935  -8.640
  594    HB2  SER  78           2HB      SER  78  11.292   8.210  -9.404
  595    HB3  SER  78           1HB      SER  78  12.325   9.627  -9.219
  596    H    ASP  79           H        ASP  79   9.818   9.811  -9.228
  597    HA   ASP  79           HA       ASP  79   9.384  12.417  -7.954
  598    HB2  ASP  79           2HB      ASP  79   8.510  13.148 -10.137
  599    HB3  ASP  79           1HB      ASP  79  10.142  12.508 -10.275
  600    H    PHE  80           H        PHE  80   7.566   9.727  -9.424
  601    HA   PHE  80           HA       PHE  80   5.283  10.478  -7.737
  602    HD1  PHE  80           1HD      PHE  80   4.943  12.855  -9.805
  603    HD2  PHE  80           2HD      PHE  80   2.173   9.697  -9.119
  604    HE1  PHE  80           1HE      PHE  80   3.193  14.506  -9.296
  605    HE2  PHE  80           2HE      PHE  80   0.419  11.346  -8.611
  606    HZ   PHE  80           HZ       PHE  80   0.933  13.750  -8.691
  607    HB2  PHE  80           2HB      PHE  80   5.358  10.546 -10.589
  608    HB3  PHE  80           1HB      PHE  80   4.276   9.245 -10.096
  609    H    VAL  81           H        VAL  81   3.630   8.608  -7.623
  610    HA   VAL  81           HA       VAL  81   4.862   5.988  -7.874
  611    HB   VAL  81           HB       VAL  81   5.453   6.485  -5.612
  612   HG11  VAL  81          1HG1      VAL  81   3.512   6.986  -3.964
  613   HG12  VAL  81          2HG1      VAL  81   2.681   7.570  -5.404
  614   HG13  VAL  81          3HG1      VAL  81   4.212   8.295  -4.915
  615   HG21  VAL  81          3HG2      VAL  81   2.939   4.868  -5.328
  616   HG22  VAL  81          1HG2      VAL  81   4.470   4.689  -4.472
  617   HG23  VAL  81          2HG2      VAL  81   4.357   4.250  -6.176
  618    H    TYR  82           H        TYR  82   3.435   4.685  -8.834
  619    HA   TYR  82           HA       TYR  82   0.603   5.454  -8.778
  620    HD1  TYR  82           1HD      TYR  82  -0.238   2.086 -10.531
  621    HD2  TYR  82           2HD      TYR  82  -0.228   6.191 -11.654
  622    HE1  TYR  82           1HE      TYR  82  -2.479   1.826 -11.485
  623    HE2  TYR  82           2HE      TYR  82  -2.475   5.939 -12.609
  624    HH   TYR  82           HH       TYR  82  -3.804   3.494 -13.573
  625    HB2  TYR  82           2HB      TYR  82   1.826   5.076 -10.977
  626    HB3  TYR  82           1HB      TYR  82   1.825   3.364 -10.568
  627    H    LEU  83           H        LEU  83  -0.251   4.652  -6.988
  628    HA   LEU  83           HA       LEU  83   0.254   1.891  -6.207
  629    HG   LEU  83           HG       LEU  83  -0.227   1.293  -4.031
  630    HB2  LEU  83           2HB      LEU  83   0.240   3.886  -4.607
  631    HB3  LEU  83           1HB      LEU  83  -1.505   3.858  -4.768
  632   HD11  LEU  83          1HD1      LEU  83   1.081   2.801  -2.672
  633   HD12  LEU  83          2HD1      LEU  83  -0.087   1.951  -1.660
  634   HD13  LEU  83          3HD1      LEU  83  -0.381   3.625  -2.127
  635   HD21  LEU  83          3HD2      LEU  83  -2.686   1.670  -4.287
  636   HD22  LEU  83          1HD2      LEU  83  -2.609   2.740  -2.888
  637   HD23  LEU  83          2HD2      LEU  83  -2.200   1.032  -2.717
  638    H    LYS  84           H        LYS  84  -1.076   0.271  -6.581
  639    HA   LYS  84           HA       LYS  84  -3.820   0.835  -7.482
  640    HB2  LYS  84           2HB      LYS  84  -1.745  -1.015  -8.456
  641    HB3  LYS  84           1HB      LYS  84  -3.351  -1.714  -8.317
  642    HG2  LYS  84           2HG      LYS  84  -2.956   0.891  -9.725
  643    HG3  LYS  84           1HG      LYS  84  -2.625  -0.635 -10.546
  644    HD2  LYS  84           2HD      LYS  84  -5.227  -0.169  -9.127
  645    HD3  LYS  84           1HD      LYS  84  -4.974   0.405 -10.776
  646    HE2  LYS  84           2HE      LYS  84  -4.299  -2.424 -10.137
  647    HE3  LYS  84           1HE      LYS  84  -5.999  -1.981 -10.277
  648    HZ1  LYS  84           3HZ      LYS  84  -5.576  -1.146 -12.493
  649    HZ2  LYS  84           1HZ      LYS  84  -5.076  -2.758 -12.381
  650    HZ3  LYS  84           2HZ      LYS  84  -3.931  -1.514 -12.359
  651    H    VAL  85           H        VAL  85  -5.514  -0.673  -6.746
  652    HA   VAL  85           HA       VAL  85  -4.702  -2.285  -4.434
  653    HB   VAL  85           HB       VAL  85  -7.038  -0.363  -4.514
  654   HG11  VAL  85          1HG1      VAL  85  -6.990  -1.209  -1.968
  655   HG12  VAL  85          2HG1      VAL  85  -6.442  -2.679  -2.776
  656   HG13  VAL  85          3HG1      VAL  85  -7.990  -1.953  -3.215
  657   HG21  VAL  85          3HG2      VAL  85  -4.398  -0.358  -3.102
  658   HG22  VAL  85          1HG2      VAL  85  -5.786   0.481  -2.409
  659   HG23  VAL  85          2HG2      VAL  85  -5.187   0.936  -4.003
  660    H    ALA  86           H        ALA  86  -5.741  -4.201  -4.209
  661    HA   ALA  86           HA       ALA  86  -7.643  -4.942  -6.324
  662    HB1  ALA  86           3HB      ALA  86  -6.667  -6.956  -6.415
  663    HB2  ALA  86           1HB      ALA  86  -6.570  -7.097  -4.660
  664    HB3  ALA  86           2HB      ALA  86  -5.345  -6.185  -5.541
  665    H    LYS  87           H        LYS  87  -9.473  -6.284  -5.800
  666    HA   LYS  87           HA       LYS  87 -10.431  -5.874  -3.043
  667    HB2  LYS  87           2HB      LYS  87 -11.898  -5.859  -5.672
  668    HB3  LYS  87           1HB      LYS  87 -12.741  -6.095  -4.147
  669    HG2  LYS  87           2HG      LYS  87 -11.917  -3.936  -3.355
  670    HG3  LYS  87           1HG      LYS  87 -11.071  -3.699  -4.885
  671    HD2  LYS  87           2HD      LYS  87 -14.019  -4.231  -4.835
  672    HD3  LYS  87           1HD      LYS  87 -13.395  -2.607  -4.543
  673    HE2  LYS  87           2HE      LYS  87 -12.847  -2.301  -6.700
  674    HE3  LYS  87           1HE      LYS  87 -12.230  -3.943  -6.876
  675    HZ1  LYS  87           3HZ      LYS  87 -15.091  -3.142  -6.941
  676    HZ2  LYS  87           1HZ      LYS  87 -14.517  -4.729  -7.075
  677    HZ3  LYS  87           2HZ      LYS  87 -14.153  -3.594  -8.275
  678    HA   PRO  88           HA       PRO  88 -10.077 -10.371  -2.995
  679    HB2  PRO  88           2HB      PRO  88 -10.994 -10.631  -0.417
  680    HB3  PRO  88           1HB      PRO  88  -9.319 -10.276  -0.848
  681    HG2  PRO  88           2HG      PRO  88 -11.490  -8.411   0.018
  682    HG3  PRO  88           1HG      PRO  88  -9.777  -8.428   0.477
  683    HD2  PRO  88           2HD      PRO  88 -10.740  -6.696  -1.338
  684    HD3  PRO  88           1HD      PRO  88  -9.112  -7.391  -1.483
  685    H    THR  89           H        THR  89 -11.592 -11.586  -3.984
  686    HA   THR  89           HA       THR  89 -14.328 -11.572  -2.937
  687    HB   THR  89           HB       THR  89 -15.170 -11.661  -5.328
  688    HG1  THR  89           1HG      THR  89 -13.527 -11.919  -6.651
  689   HG21  THR  89          3HG2      THR  89 -15.323  -9.347  -5.616
  690   HG22  THR  89          1HG2      THR  89 -13.800  -9.054  -4.777
  691   HG23  THR  89          2HG2      THR  89 -15.216  -9.587  -3.872
  692    H    GLY  90           H        GLY  90 -15.032 -13.581  -2.584
  693    HA2  GLY  90           2HA      GLY  90 -14.128 -15.761  -4.318
  694    HA3  GLY  90           1HA      GLY  90 -13.766 -15.888  -2.605
  695    H    SER  91           H        SER  91 -15.019 -17.682  -2.213
  696    HA   SER  91           HA       SER  91 -17.805 -17.741  -2.988
  697    HG   SER  91           HG       SER  91 -17.529 -20.320  -3.711
  698    HB2  SER  91           2HB      SER  91 -16.032 -19.642  -1.458
  699    HB3  SER  91           1HB      SER  91 -17.767 -19.910  -1.622
  700    H    HIS  92           H        HIS  92 -15.971 -17.499   0.052
  701    HA   HIS  92           HA       HIS  92 -18.319 -17.274   1.679
  702    HD1  HIS  92           1HD      HIS  92 -18.153 -19.252   2.896
  703    HD2  HIS  92           2HD      HIS  92 -14.013 -18.925   2.776
  704    HE1  HIS  92           1HE      HIS  92 -17.285 -21.588   3.221
  705    HE2  HIS  92           2HE      HIS  92 -14.777 -21.351   3.241
  706    HB2  HIS  92           2HB      HIS  92 -15.418 -16.669   2.295
  707    HB3  HIS  92           1HB      HIS  92 -16.713 -16.683   3.487
  708    HA   ARG 301           HA       ARG 301   2.026 -10.659  10.121
  709    HE   ARG 301           HE       ARG 301   0.892 -12.929  15.915
  710    H1   ARG 301           1HT      ARG 301   3.332 -12.518  10.203
  711    H2   ARG 301           2HT      ARG 301   1.958 -12.913  11.148
  712    H3   ARG 301           3HT      ARG 301   3.439 -12.499  11.912
  713    HB2  ARG 301           2HB      ARG 301   1.124  -9.641  12.250
  714    HB3  ARG 301           1HB      ARG 301   0.408 -11.177  11.790
  715    HG2  ARG 301           2HG      ARG 301   2.666 -11.595  13.529
  716    HG3  ARG 301           1HG      ARG 301   1.507 -10.482  14.257
  717    HD2  ARG 301           2HD      ARG 301  -0.248 -12.057  14.107
  718    HD3  ARG 301           1HD      ARG 301   0.678 -13.100  13.029
  719   HH11  ARG 301          1HH1      ARG 301   2.334 -14.100  12.944
  720   HH12  ARG 301          2HH1      ARG 301   3.294 -15.298  13.741
  721   HH21  ARG 301          1HH2      ARG 301   2.161 -14.512  16.955
  722   HH22  ARG 301          2HH2      ARG 301   3.196 -15.534  16.015
  723    H    ARG 302           H        ARG 302   3.587  -9.320   9.504
  724    HA   ARG 302           HA       ARG 302   5.338  -8.165  11.561
  725    HE   ARG 302           HE       ARG 302   8.513 -10.599  10.874
  726    HB2  ARG 302           2HB      ARG 302   6.476  -9.956  10.104
  727    HB3  ARG 302           1HB      ARG 302   6.351  -8.789   8.795
  728    HG2  ARG 302           2HG      ARG 302   7.688  -7.199  10.050
  729    HG3  ARG 302           1HG      ARG 302   7.774  -8.323  11.408
  730    HD2  ARG 302           2HD      ARG 302   8.808  -8.921   8.638
  731    HD3  ARG 302           1HD      ARG 302   9.804  -8.304   9.956
  732   HH11  ARG 302          1HH1      ARG 302  10.910  -9.735   8.470
  733   HH12  ARG 302          2HH1      ARG 302  11.712 -11.266   8.543
  734   HH21  ARG 302          1HH2      ARG 302   9.576 -12.613  10.965
  735   HH22  ARG 302          2HH2      ARG 302  10.955 -12.901   9.960
  736    H    GLU 303           H        GLU 303   4.755  -6.105  11.664
  737    HA   GLU 303           HA       GLU 303   4.004  -4.703   9.194
  738    HB2  GLU 303           2HB      GLU 303   3.479  -4.003  12.091
  739    HB3  GLU 303           1HB      GLU 303   2.993  -3.016  10.720
  740    HG2  GLU 303           2HG      GLU 303   1.054  -4.145  11.146
  741    HG3  GLU 303           1HG      GLU 303   1.790  -5.203   9.946
  742    H    THR 304           H        THR 304   5.013  -2.846   8.549
  743    HA   THR 304           HA       THR 304   7.131  -1.698  10.187
  744    HB   THR 304           HB       THR 304   7.555  -3.312   7.736
  745    HG1  THR 304           1HG      THR 304   8.547  -4.215   9.375
  746   HG21  THR 304          3HG2      THR 304   9.239  -0.888   8.305
  747   HG22  THR 304          1HG2      THR 304   8.232  -1.157   6.882
  748   HG23  THR 304          2HG2      THR 304   9.640  -2.180   7.174
  749    H    GLN 305           H        GLN 305   7.714   0.420   9.590
  750    HA   GLN 305           HA       GLN 305   5.693   1.824   8.098
  751    HB2  GLN 305           2HB      GLN 305   7.781   2.534   9.992
  752    HB3  GLN 305           1HB      GLN 305   7.698   3.654   8.636
  753    HG2  GLN 305           2HG      GLN 305   5.878   4.612   9.443
  754    HG3  GLN 305           1HG      GLN 305   5.062   3.062   9.607
  755   HE21  GLN 305          1HE2      GLN 305   5.347   1.869  11.561
  756   HE22  GLN 305          2HE2      GLN 305   5.752   2.683  13.030
  757    H    VAL 306           H        VAL 306   6.129   3.274   6.340
  758    HA   VAL 306           HA       VAL 306   8.564   2.743   4.805
  759    HB   VAL 306           HB       VAL 306   7.177   2.483   2.723
  760   HG11  VAL 306          1HG1      VAL 306   8.249   0.594   3.964
  761   HG12  VAL 306          2HG1      VAL 306   6.840   0.142   3.005
  762   HG13  VAL 306          3HG1      VAL 306   6.698   0.316   4.754
  763   HG21  VAL 306          3HG2      VAL 306   4.847   1.713   3.023
  764   HG22  VAL 306          1HG2      VAL 306   5.088   3.395   3.495
  765   HG23  VAL 306          2HG2      VAL 306   4.959   2.145   4.732
  Start of MODEL    8
    1    HA   MET   1           HA       MET   1  -9.779   4.898  -8.167
    2    H1   MET   1           1HT      MET   1  -9.768   3.037  -9.676
    3    H2   MET   1           2HT      MET   1 -11.149   3.048  -8.656
    4    H3   MET   1           3HT      MET   1  -9.859   1.958  -8.347
    5    HB2  MET   1           2HB      MET   1  -9.915   2.643  -6.174
    6    HB3  MET   1           1HB      MET   1  -9.249   4.208  -5.727
    7    HG2  MET   1           2HG      MET   1 -11.304   4.854  -5.241
    8    HG3  MET   1           1HG      MET   1 -11.669   4.794  -6.965
    9    HE1  MET   1           3HE      MET   1 -14.857   3.309  -5.974
   10    HE2  MET   1           1HE      MET   1 -13.924   4.806  -5.973
   11    HE3  MET   1           2HE      MET   1 -14.184   3.928  -4.466
   12    H    GLU   2           H        GLU   2  -7.809   5.778  -8.331
   13    HA   GLU   2           HA       GLU   2  -5.455   4.071  -7.884
   14    HB2  GLU   2           2HB      GLU   2  -4.327   5.285  -9.782
   15    HB3  GLU   2           1HB      GLU   2  -5.598   4.168 -10.252
   16    HG2  GLU   2           2HG      GLU   2  -6.508   6.916  -9.834
   17    HG3  GLU   2           1HG      GLU   2  -5.340   6.723 -11.140
   18    H    ILE   3           H        ILE   3  -3.968   4.900  -6.654
   19    HA   ILE   3           HA       ILE   3  -4.284   7.652  -5.689
   20    HB   ILE   3           HB       ILE   3  -2.629   5.382  -4.576
   21   HG12  ILE   3          2HG1      ILE   3  -4.490   6.117  -2.680
   22   HG13  ILE   3          1HG1      ILE   3  -5.393   6.283  -4.183
   23   HG21  ILE   3          1HG2      ILE   3  -1.449   7.217  -3.850
   24   HG22  ILE   3          2HG2      ILE   3  -2.623   7.029  -2.548
   25   HG23  ILE   3          3HG2      ILE   3  -2.876   8.250  -3.795
   26   HD11  ILE   3          3HD1      ILE   3  -4.111   3.855  -4.456
   27   HD12  ILE   3          1HD1      ILE   3  -5.798   4.110  -4.012
   28   HD13  ILE   3          2HD1      ILE   3  -4.578   3.903  -2.756
   29    H    LYS   4           H        LYS   4  -3.251   9.046  -7.031
   30    HA   LYS   4           HA       LYS   4  -0.537   8.375  -7.920
   31    HB2  LYS   4           2HB      LYS   4  -2.578   9.375  -9.369
   32    HB3  LYS   4           1HB      LYS   4  -1.827  10.878  -8.851
   33    HG2  LYS   4           2HG      LYS   4   0.360   9.871  -9.708
   34    HG3  LYS   4           1HG      LYS   4  -0.659   8.677 -10.517
   35    HD2  LYS   4           2HD      LYS   4  -1.691  10.312 -11.856
   36    HD3  LYS   4           1HD      LYS   4  -1.108  11.632 -10.841
   37    HE2  LYS   4           2HE      LYS   4   1.237  10.893 -11.525
   38    HE3  LYS   4           1HE      LYS   4   0.445   9.923 -12.767
   39    HZ1  LYS   4           3HZ      LYS   4   0.177  12.866 -12.455
   40    HZ2  LYS   4           1HZ      LYS   4  -0.547  11.927 -13.662
   41    HZ3  LYS   4           2HZ      LYS   4   1.136  12.086 -13.608
   42    H    LEU   5           H        LEU   5   0.589   8.740  -6.088
   43    HA   LEU   5           HA       LEU   5   0.512  11.392  -4.851
   44    HG   LEU   5           HG       LEU   5  -0.696   9.249  -3.521
   45    HB2  LEU   5           2HB      LEU   5   1.769   8.790  -4.022
   46    HB3  LEU   5           1HB      LEU   5   2.107  10.296  -3.191
   47   HD11  LEU   5          1HD1      LEU   5  -0.311   8.599  -1.035
   48   HD12  LEU   5          2HD1      LEU   5   1.387   8.532  -1.504
   49   HD13  LEU   5          3HD1      LEU   5   0.207   7.503  -2.316
   50   HD21  LEU   5          3HD2      LEU   5  -1.078  10.687  -1.534
   51   HD22  LEU   5          1HD2      LEU   5  -0.571  11.582  -2.967
   52   HD23  LEU   5          2HD2      LEU   5   0.584  11.258  -1.674
   53    H    ILE   6           H        ILE   6   2.057  12.898  -5.096
   54    HA   ILE   6           HA       ILE   6   4.231  12.328  -6.937
   55    HB   ILE   6           HB       ILE   6   2.899  14.411  -7.164
   56   HG12  ILE   6          2HG1      ILE   6   5.787  15.010  -6.502
   57   HG13  ILE   6          1HG1      ILE   6   5.283  14.172  -7.966
   58   HG21  ILE   6          1HG2      ILE   6   2.686  14.750  -4.662
   59   HG22  ILE   6          2HG2      ILE   6   3.012  16.190  -5.624
   60   HG23  ILE   6          3HG2      ILE   6   4.314  15.425  -4.714
   61   HD11  ILE   6          3HD1      ILE   6   5.513  16.344  -8.686
   62   HD12  ILE   6          1HD1      ILE   6   4.885  17.022  -7.184
   63   HD13  ILE   6          2HD1      ILE   6   3.786  16.257  -8.333
   64    H    LYS   7           H        LYS   7   6.326  12.068  -6.394
   65    HA   LYS   7           HA       LYS   7   7.018  11.734  -3.651
   66    HB2  LYS   7           2HB      LYS   7   7.954  10.522  -5.754
   67    HB3  LYS   7           1HB      LYS   7   9.059  11.886  -5.843
   68    HG2  LYS   7           2HG      LYS   7  10.144  10.111  -4.676
   69    HG3  LYS   7           1HG      LYS   7   9.773  11.387  -3.516
   70    HD2  LYS   7           2HD      LYS   7   7.535   9.858  -3.343
   71    HD3  LYS   7           1HD      LYS   7   8.754   8.634  -3.696
   72    HE2  LYS   7           2HE      LYS   7   9.301  10.675  -1.587
   73    HE3  LYS   7           1HE      LYS   7   8.224   9.328  -1.223
   74    HZ1  LYS   7           3HZ      LYS   7  10.853   8.794  -2.430
   75    HZ2  LYS   7           1HZ      LYS   7   9.910   7.807  -1.429
   76    HZ3  LYS   7           2HZ      LYS   7  10.749   9.120  -0.774
   77    H    GLY   8           H        GLY   8   7.153  13.456  -2.373
   78    HA2  GLY   8           2HA      GLY   8   8.584  15.844  -3.345
   79    HA3  GLY   8           1HA      GLY   8   7.432  15.821  -2.018
   80    HA   PRO   9           HA       PRO   9  11.713  15.969  -0.175
   81    HB2  PRO   9           2HB      PRO   9  10.180  17.427   1.898
   82    HB3  PRO   9           1HB      PRO   9  11.701  17.859   1.111
   83    HG2  PRO   9           2HG      PRO   9   9.434  19.136   0.517
   84    HG3  PRO   9           1HG      PRO   9  10.641  18.775  -0.733
   85    HD2  PRO   9           2HD      PRO   9   8.052  17.393  -0.139
   86    HD3  PRO   9           1HD      PRO   9   8.787  17.786  -1.708
   87    H    LYS  10           H        LYS  10   8.563  15.314   1.334
   88    HA   LYS  10           HA       LYS  10   9.734  13.789   3.481
   89    HB2  LYS  10           2HB      LYS  10   7.556  15.183   3.521
   90    HB3  LYS  10           1HB      LYS  10   6.812  13.787   2.758
   91    HG2  LYS  10           2HG      LYS  10   6.875  12.550   4.650
   92    HG3  LYS  10           1HG      LYS  10   8.404  13.250   5.185
   93    HD2  LYS  10           2HD      LYS  10   6.990  14.171   6.730
   94    HD3  LYS  10           1HD      LYS  10   6.916  15.411   5.477
   95    HE2  LYS  10           2HE      LYS  10   4.681  15.051   6.042
   96    HE3  LYS  10           1HE      LYS  10   4.903  14.103   4.572
   97    HZ1  LYS  10           3HZ      LYS  10   4.825  12.131   5.729
   98    HZ2  LYS  10           1HZ      LYS  10   3.714  13.063   6.600
   99    HZ3  LYS  10           2HZ      LYS  10   5.276  12.830   7.202
  100    H    GLY  11           H        GLY  11   7.048  12.001   2.682
  101    HA2  GLY  11           2HA      GLY  11   8.140  10.345   0.618
  102    HA3  GLY  11           1HA      GLY  11   8.347   9.636   2.210
  103    H    LEU  12           H        LEU  12   6.871   8.133   2.571
  104    HA   LEU  12           HA       LEU  12   4.297   8.211   1.241
  105    HG   LEU  12           HG       LEU  12   5.104   4.690   1.005
  106    HB2  LEU  12           2HB      LEU  12   5.671   6.204   3.006
  107    HB3  LEU  12           1HB      LEU  12   3.992   6.018   2.546
  108   HD11  LEU  12          1HD1      LEU  12   3.610   6.428  -0.044
  109   HD12  LEU  12          2HD1      LEU  12   4.800   5.689  -1.115
  110   HD13  LEU  12          3HD1      LEU  12   5.076   7.309  -0.473
  111   HD21  LEU  12          3HD2      LEU  12   7.354   5.932   1.740
  112   HD22  LEU  12          1HD2      LEU  12   7.133   6.663   0.151
  113   HD23  LEU  12          2HD2      LEU  12   7.245   4.911   0.308
  114    H    GLY  13           H        GLY  13   5.460   8.109   4.614
  115    HA2  GLY  13           2HA      GLY  13   4.568   9.131   6.485
  116    HA3  GLY  13           1HA      GLY  13   3.305   9.813   5.478
  117    H    PHE  14           H        PHE  14   4.067   6.375   5.751
  118    HA   PHE  14           HA       PHE  14   2.005   5.814   7.639
  119    HD1  PHE  14           2HD      PHE  14   2.027   2.948   4.749
  120    HD2  PHE  14           1HD      PHE  14   0.994   6.904   3.567
  121    HE1  PHE  14           2HE      PHE  14   2.544   2.380   2.415
  122    HE2  PHE  14           1HE      PHE  14   1.505   6.341   1.228
  123    HZ   PHE  14           HZ       PHE  14   2.283   4.079   0.649
  124    HB2  PHE  14           2HB      PHE  14   0.545   4.501   6.141
  125    HB3  PHE  14           1HB      PHE  14   0.552   6.210   5.738
  126    H    SER  15           H        SER  15   1.534   3.149   7.253
  127    HA   SER  15           HA       SER  15   4.168   1.919   6.926
  128    HG   SER  15           HG       SER  15   1.836   2.619   9.528
  129    HB2  SER  15           2HB      SER  15   3.455   0.419   8.874
  130    HB3  SER  15           1HB      SER  15   3.957   2.049   9.294
  131    H    ILE  16           H        ILE  16   3.848  -0.580   6.847
  132    HA   ILE  16           HA       ILE  16   1.258  -1.437   5.839
  133    HB   ILE  16           HB       ILE  16   1.844  -2.016   3.683
  134   HG12  ILE  16          2HG1      ILE  16   4.022  -3.075   4.249
  135   HG13  ILE  16          1HG1      ILE  16   4.027  -2.193   2.728
  136   HG21  ILE  16          1HG2      ILE  16   2.757  -0.020   2.579
  137   HG22  ILE  16          2HG2      ILE  16   3.257   0.591   4.156
  138   HG23  ILE  16          3HG2      ILE  16   1.544   0.366   3.800
  139   HD11  ILE  16          3HD1      ILE  16   5.677  -0.904   3.405
  140   HD12  ILE  16          1HD1      ILE  16   5.829  -1.957   4.815
  141   HD13  ILE  16          2HD1      ILE  16   4.833  -0.503   4.901
  142    H    ALA  17           H        ALA  17   1.351  -3.736   5.133
  143    HA   ALA  17           HA       ALA  17   3.433  -5.344   6.419
  144    HB1  ALA  17           3HB      ALA  17   1.263  -6.897   6.843
  145    HB2  ALA  17           1HB      ALA  17   0.550  -5.296   7.058
  146    HB3  ALA  17           2HB      ALA  17   1.923  -5.792   8.048
  147    H    GLY  18           H        GLY  18   3.323  -7.677   5.430
  148    HA2  GLY  18           2HA      GLY  18   1.806  -8.351   3.266
  149    HA3  GLY  18           1HA      GLY  18   3.026  -7.313   2.568
  150    H    GLY  19           H        GLY  19   2.254 -10.452   2.702
  151    HA2  GLY  19           2HA      GLY  19   3.847 -11.967   1.723
  152    HA3  GLY  19           1HA      GLY  19   5.099 -11.210   2.691
  153    H    VAL  20           H        VAL  20   4.580 -13.997   2.525
  154    HA   VAL  20           HA       VAL  20   3.072 -14.942   4.719
  155    HB   VAL  20           HB       VAL  20   4.322 -17.066   4.457
  156   HG11  VAL  20          1HG1      VAL  20   3.006 -17.621   2.740
  157   HG12  VAL  20          2HG1      VAL  20   3.799 -16.482   1.650
  158   HG13  VAL  20          3HG1      VAL  20   2.519 -15.926   2.727
  159   HG21  VAL  20          3HG2      VAL  20   5.941 -15.473   2.474
  160   HG22  VAL  20          1HG2      VAL  20   5.932 -17.235   2.545
  161   HG23  VAL  20          2HG2      VAL  20   6.520 -16.300   3.920
  162    H    GLY  21           H        GLY  21   3.694 -15.560   6.807
  163    HA2  GLY  21           2HA      GLY  21   5.060 -15.698   8.696
  164    HA3  GLY  21           1HA      GLY  21   6.425 -15.194   7.712
  165    H    ASN  22           H        ASN  22   4.584 -12.887   6.809
  166    HA   ASN  22           HA       ASN  22   4.617 -11.208   9.193
  167    HB2  ASN  22           2HB      ASN  22   5.490  -9.383   7.438
  168    HB3  ASN  22           1HB      ASN  22   6.607 -10.345   8.388
  169   HD21  ASN  22          1HD2      ASN  22   4.873 -10.393   5.299
  170   HD22  ASN  22          2HD2      ASN  22   6.150 -11.136   4.407
  171    H    GLN  23           H        GLN  23   2.541 -12.542   7.458
  172    HA   GLN  23           HA       GLN  23   1.265 -10.726   5.771
  173    HB2  GLN  23           2HB      GLN  23  -0.022 -12.914   7.410
  174    HB3  GLN  23           1HB      GLN  23  -0.693 -12.161   5.972
  175    HG2  GLN  23           2HG      GLN  23   0.782 -13.244   4.559
  176    HG3  GLN  23           1HG      GLN  23   1.942 -13.560   5.847
  177   HE21  GLN  23          1HE2      GLN  23  -1.493 -14.255   5.199
  178   HE22  GLN  23          2HE2      GLN  23  -1.406 -15.924   5.637
  179    H    HIS  24           H        HIS  24  -0.457  -9.351   6.003
  180    HA   HIS  24           HA       HIS  24  -0.775  -8.165   8.641
  181    HD1  HIS  24           1HD      HIS  24  -0.451  -5.258   8.775
  182    HD2  HIS  24           2HD      HIS  24  -4.130  -5.968   6.997
  183    HE1  HIS  24           1HE      HIS  24  -1.984  -3.521   9.710
  184    HE2  HIS  24           2HE      HIS  24  -4.242  -4.021   8.709
  185    HB2  HIS  24           2HB      HIS  24  -0.427  -6.758   6.597
  186    HB3  HIS  24           1HB      HIS  24  -1.991  -7.290   6.015
  187    H    ILE  25           H        ILE  25  -2.516 -10.269   6.517
  188    HA   ILE  25           HA       ILE  25  -4.665 -10.431   8.458
  189    HB   ILE  25           HB       ILE  25  -5.060  -8.774   6.338
  190   HG12  ILE  25          2HG1      ILE  25  -7.180 -10.442   7.702
  191   HG13  ILE  25          1HG1      ILE  25  -6.439  -8.986   8.364
  192   HG21  ILE  25          1HG2      ILE  25  -4.947 -10.638   4.735
  193   HG22  ILE  25          2HG2      ILE  25  -6.501  -9.805   4.718
  194   HG23  ILE  25          3HG2      ILE  25  -6.348 -11.369   5.520
  195   HD11  ILE  25          3HD1      ILE  25  -7.377  -7.669   6.551
  196   HD12  ILE  25          1HD1      ILE  25  -8.639  -8.536   7.426
  197   HD13  ILE  25          2HD1      ILE  25  -8.095  -9.122   5.854
  198    HA   PRO  26           HA       PRO  26  -3.997 -14.758   7.704
  199    HB2  PRO  26           2HB      PRO  26  -6.871 -14.959   8.463
  200    HB3  PRO  26           1HB      PRO  26  -5.473 -15.834   9.099
  201    HG2  PRO  26           2HG      PRO  26  -6.598 -13.867  10.496
  202    HG3  PRO  26           1HG      PRO  26  -4.838 -14.083  10.479
  203    HD2  PRO  26           2HD      PRO  26  -6.517 -12.060   9.067
  204    HD3  PRO  26           1HD      PRO  26  -4.897 -11.892   9.774
  205    H    GLY  27           H        GLY  27  -3.920 -15.578   5.717
  206    HA2  GLY  27           2HA      GLY  27  -5.015 -16.744   3.937
  207    HA3  GLY  27           1HA      GLY  27  -6.400 -15.683   4.137
  208    H    ASP  28           H        ASP  28  -5.476 -13.197   3.958
  209    HA   ASP  28           HA       ASP  28  -4.554 -13.064   1.199
  210    HB2  ASP  28           2HB      ASP  28  -6.298 -11.504   2.822
  211    HB3  ASP  28           1HB      ASP  28  -4.968 -10.465   2.325
  212    H    ASN  29           H        ASN  29  -2.432 -13.111   0.885
  213    HA   ASN  29           HA       ASN  29  -0.591 -12.037   2.859
  214    HB2  ASN  29           2HB      ASN  29   0.105 -13.255   0.189
  215    HB3  ASN  29           1HB      ASN  29   1.151 -13.063   1.592
  216   HD21  ASN  29          1HD2      ASN  29  -1.389 -14.926   0.140
  217   HD22  ASN  29          2HD2      ASN  29  -1.360 -16.226   1.276
  218    H    SER  30           H        SER  30  -2.382 -10.346   0.925
  219    HA   SER  30           HA       SER  30  -0.622  -8.925  -0.780
  220    HG   SER  30           HG       SER  30  -4.237  -9.222  -0.177
  221    HB2  SER  30           2HB      SER  30  -3.044  -7.602   0.386
  222    HB3  SER  30           1HB      SER  30  -2.417  -7.535  -1.259
  223    H    ILE  31           H        ILE  31  -0.638  -6.338  -0.378
  224    HA   ILE  31           HA       ILE  31   0.686  -6.056   2.221
  225    HB   ILE  31           HB       ILE  31   1.131  -4.673  -0.379
  226   HG12  ILE  31          2HG1      ILE  31   3.477  -5.012   0.179
  227   HG13  ILE  31          1HG1      ILE  31   3.036  -5.607   1.774
  228   HG21  ILE  31          1HG2      ILE  31   1.399  -3.409   2.303
  229   HG22  ILE  31          2HG2      ILE  31   0.884  -2.704   0.772
  230   HG23  ILE  31          3HG2      ILE  31   2.590  -3.039   1.057
  231   HD11  ILE  31          3HD1      ILE  31   1.705  -7.389   0.380
  232   HD12  ILE  31          1HD1      ILE  31   3.434  -7.562   0.670
  233   HD13  ILE  31          2HD1      ILE  31   2.857  -6.939  -0.874
  234    H    TYR  32           H        TYR  32  -0.554  -5.327   3.716
  235    HA   TYR  32           HA       TYR  32  -2.653  -3.359   3.122
  236    HD1  TYR  32           2HD      TYR  32  -2.307  -6.767   3.176
  237    HD2  TYR  32           1HD      TYR  32  -5.598  -4.635   4.816
  238    HE1  TYR  32           2HE      TYR  32  -3.851  -8.287   2.019
  239    HE2  TYR  32           1HE      TYR  32  -7.162  -6.140   3.676
  240    HH   TYR  32           HH       TYR  32  -6.446  -7.999   1.189
  241    HB2  TYR  32           2HB      TYR  32  -2.259  -5.268   5.416
  242    HB3  TYR  32           1HB      TYR  32  -3.488  -4.011   5.422
  243    H    VAL  33           H        VAL  33  -2.838  -1.447   4.240
  244    HA   VAL  33           HA       VAL  33  -0.440  -0.383   5.427
  245    HB   VAL  33           HB       VAL  33  -3.167   0.835   4.945
  246   HG11  VAL  33          1HG1      VAL  33  -1.771   3.002   5.449
  247   HG12  VAL  33          2HG1      VAL  33  -0.814   1.897   6.435
  248   HG13  VAL  33          3HG1      VAL  33  -2.536   2.098   6.754
  249   HG21  VAL  33          3HG2      VAL  33  -1.278   2.290   3.574
  250   HG22  VAL  33          1HG2      VAL  33  -2.316   1.039   2.888
  251   HG23  VAL  33          2HG2      VAL  33  -0.686   0.634   3.427
  252    H    THR  34           H        THR  34  -0.006  -0.273   7.563
  253    HA   THR  34           HA       THR  34  -2.067  -1.264   9.396
  254    HB   THR  34           HB       THR  34  -0.392  -2.130  10.742
  255    HG1  THR  34           1HG      THR  34   1.140  -0.801  11.236
  256   HG21  THR  34          3HG2      THR  34  -0.117  -2.644   8.008
  257   HG22  THR  34          1HG2      THR  34   0.456  -3.621   9.356
  258   HG23  THR  34          2HG2      THR  34   1.519  -2.419   8.628
  259    H    LYS  35           H        LYS  35  -0.091   1.581   8.833
  260    HA   LYS  35           HA       LYS  35  -1.613   3.043  10.815
  261    HB2  LYS  35           2HB      LYS  35   0.577   1.799  11.784
  262    HB3  LYS  35           1HB      LYS  35   1.312   3.294  11.227
  263    HG2  LYS  35           2HG      LYS  35   0.820   3.850  13.365
  264    HG3  LYS  35           1HG      LYS  35  -0.657   4.389  12.563
  265    HD2  LYS  35           2HD      LYS  35  -1.867   3.011  13.829
  266    HD3  LYS  35           1HD      LYS  35  -0.943   1.631  13.234
  267    HE2  LYS  35           2HE      LYS  35   0.046   3.404  15.455
  268    HE3  LYS  35           1HE      LYS  35  -0.976   1.999  15.752
  269    HZ1  LYS  35           3HZ      LYS  35   0.735   0.661  14.557
  270    HZ2  LYS  35           1HZ      LYS  35   1.271   1.331  16.015
  271    HZ3  LYS  35           2HZ      LYS  35   1.734   2.024  14.544
  272    H    ILE  36           H        ILE  36  -2.099   4.903   9.820
  273    HA   ILE  36           HA       ILE  36  -0.235   5.981   7.835
  274    HB   ILE  36           HB       ILE  36  -3.118   6.702   8.382
  275   HG12  ILE  36          2HG1      ILE  36  -1.737   5.003   6.313
  276   HG13  ILE  36          1HG1      ILE  36  -3.105   4.589   7.339
  277   HG21  ILE  36          1HG2      ILE  36  -1.270   7.692   6.210
  278   HG22  ILE  36          2HG2      ILE  36  -1.848   8.634   7.584
  279   HG23  ILE  36          3HG2      ILE  36  -2.986   8.070   6.363
  280   HD11  ILE  36          3HD1      ILE  36  -4.229   6.560   5.959
  281   HD12  ILE  36          1HD1      ILE  36  -4.202   4.891   5.388
  282   HD13  ILE  36          2HD1      ILE  36  -3.024   6.051   4.774
  283    H    ILE  37           H        ILE  37   1.066   7.624   8.348
  284    HA   ILE  37           HA       ILE  37   0.816   9.019  10.854
  285    HB   ILE  37           HB       ILE  37   2.790   9.218   8.578
  286   HG12  ILE  37          2HG1      ILE  37   4.318   8.544  10.580
  287   HG13  ILE  37          1HG1      ILE  37   2.812   8.054  11.346
  288   HG21  ILE  37          1HG2      ILE  37   2.571  10.928  11.035
  289   HG22  ILE  37          2HG2      ILE  37   2.746  11.427   9.352
  290   HG23  ILE  37          3HG2      ILE  37   4.103  10.685  10.196
  291   HD11  ILE  37          3HD1      ILE  37   4.125   6.267  10.135
  292   HD12  ILE  37          1HD1      ILE  37   3.630   7.060   8.638
  293   HD13  ILE  37          2HD1      ILE  37   2.414   6.399   9.732
  294    H    GLU  38           H        GLU  38   0.461  11.247  11.148
  295    HA   GLU  38           HA       GLU  38  -1.454  12.435   9.449
  296    HB2  GLU  38           2HB      GLU  38   0.125  13.384  11.811
  297    HB3  GLU  38           1HB      GLU  38  -0.815  14.538  10.877
  298    HG2  GLU  38           2HG      GLU  38  -2.835  13.225  11.286
  299    HG3  GLU  38           1HG      GLU  38  -1.891  12.070  12.224
  300    H    GLY  39           H        GLY  39  -1.326  14.187   8.044
  301    HA2  GLY  39           2HA      GLY  39  -0.414  15.552   6.451
  302    HA3  GLY  39           1HA      GLY  39   0.992  15.678   7.493
  303    H    GLY  40           H        GLY  40   0.180  12.471   6.509
  304    HA2  GLY  40           2HA      GLY  40   2.579  12.398   4.847
  305    HA3  GLY  40           1HA      GLY  40   1.689  11.010   5.454
  306    H    ALA  41           H        ALA  41   2.533  11.010   2.871
  307    HA   ALA  41           HA       ALA  41   1.043  12.057   0.848
  308    HB1  ALA  41           3HB      ALA  41   1.856   9.165   0.824
  309    HB2  ALA  41           1HB      ALA  41   3.029  10.477   0.714
  310    HB3  ALA  41           2HB      ALA  41   1.785  10.300  -0.523
  311    H    ALA  42           H        ALA  42   0.289   8.906   2.385
  312    HA   ALA  42           HA       ALA  42  -2.185   8.573   1.069
  313    HB1  ALA  42           3HB      ALA  42  -1.111   6.650   1.964
  314    HB2  ALA  42           1HB      ALA  42  -2.621   6.861   2.851
  315    HB3  ALA  42           2HB      ALA  42  -1.091   7.338   3.588
  316    H    HIS  43           H        HIS  43  -1.421   9.707   4.359
  317    HA   HIS  43           HA       HIS  43  -3.982  10.107   5.322
  318    HD1  HIS  43           1HD      HIS  43  -2.993  13.881   6.491
  319    HD2  HIS  43           2HD      HIS  43  -3.818  10.459   8.698
  320    HE1  HIS  43           1HE      HIS  43  -4.345  14.664   8.459
  321    HE2  HIS  43           2HE      HIS  43  -4.774  12.586   9.820
  322    HB2  HIS  43           2HB      HIS  43  -1.923  10.297   6.672
  323    HB3  HIS  43           1HB      HIS  43  -1.544  11.812   5.866
  324    H    LYS  44           H        LYS  44  -1.934  12.490   3.627
  325    HA   LYS  44           HA       LYS  44  -3.844  14.565   3.597
  326    HB2  LYS  44           2HB      LYS  44  -1.404  14.007   1.922
  327    HB3  LYS  44           1HB      LYS  44  -2.407  15.426   1.653
  328    HG2  LYS  44           2HG      LYS  44  -1.974  16.196   3.911
  329    HG3  LYS  44           1HG      LYS  44  -1.033  14.742   4.246
  330    HD2  LYS  44           2HD      LYS  44   0.722  15.407   2.892
  331    HD3  LYS  44           1HD      LYS  44  -0.291  16.495   1.941
  332    HE2  LYS  44           2HE      LYS  44  -0.422  17.483   4.544
  333    HE3  LYS  44           1HE      LYS  44   1.265  17.027   4.319
  334    HZ1  LYS  44           3HZ      LYS  44   1.320  18.374   2.309
  335    HZ2  LYS  44           1HZ      LYS  44   0.874  19.309   3.647
  336    HZ3  LYS  44           2HZ      LYS  44  -0.298  18.814   2.533
  337    H    ASP  45           H        ASP  45  -3.106  11.993   1.279
  338    HA   ASP  45           HA       ASP  45  -4.739  12.853  -0.832
  339    HB2  ASP  45           2HB      ASP  45  -3.025  11.061  -0.998
  340    HB3  ASP  45           1HB      ASP  45  -4.061  10.007  -0.047
  341    H    GLY  46           H        GLY  46  -5.440  10.640   1.866
  342    HA2  GLY  46           2HA      GLY  46  -7.479  10.419   2.996
  343    HA3  GLY  46           1HA      GLY  46  -8.249  11.393   1.755
  344    H    LYS  47           H        LYS  47  -6.996   9.546  -0.342
  345    HA   LYS  47           HA       LYS  47  -9.226   7.830  -0.638
  346    HB2  LYS  47           2HB      LYS  47  -6.954   8.595  -2.193
  347    HB3  LYS  47           1HB      LYS  47  -7.063   6.842  -2.199
  348    HG2  LYS  47           2HG      LYS  47  -8.421   7.223  -3.950
  349    HG3  LYS  47           1HG      LYS  47  -9.630   7.453  -2.685
  350    HD2  LYS  47           2HD      LYS  47  -9.280   9.854  -2.749
  351    HD3  LYS  47           1HD      LYS  47  -7.995   9.657  -3.942
  352    HE2  LYS  47           2HE      LYS  47  -9.770  10.202  -5.296
  353    HE3  LYS  47           1HE      LYS  47  -9.861   8.441  -5.314
  354    HZ1  LYS  47           3HZ      LYS  47 -11.464  10.225  -3.560
  355    HZ2  LYS  47           1HZ      LYS  47 -11.570   8.537  -3.619
  356    HZ3  LYS  47           2HZ      LYS  47 -12.030   9.462  -4.959
  357    H    LEU  48           H        LEU  48  -5.882   7.252   0.419
  358    HA   LEU  48           HA       LEU  48  -6.399   4.444   0.873
  359    HG   LEU  48           HG       LEU  48  -4.546   3.110   0.829
  360    HB2  LEU  48           2HB      LEU  48  -4.153   5.617   0.187
  361    HB3  LEU  48           1HB      LEU  48  -3.970   5.842   1.916
  362   HD11  LEU  48          1HD1      LEU  48  -2.628   4.112  -0.442
  363   HD12  LEU  48          2HD1      LEU  48  -2.246   2.656   0.478
  364   HD13  LEU  48          3HD1      LEU  48  -1.770   4.238   1.095
  365   HD21  LEU  48          3HD2      LEU  48  -2.664   3.536   3.038
  366   HD22  LEU  48          1HD2      LEU  48  -3.999   2.394   2.877
  367   HD23  LEU  48          2HD2      LEU  48  -4.318   4.061   3.356
  368    H    GLN  49           H        GLN  49  -6.968   3.499   2.707
  369    HA   GLN  49           HA       GLN  49  -6.824   4.984   5.232
  370    HB2  GLN  49           2HB      GLN  49  -9.068   4.144   5.837
  371    HB3  GLN  49           1HB      GLN  49  -9.107   5.235   4.464
  372    HG2  GLN  49           2HG      GLN  49  -8.957   2.303   3.971
  373    HG3  GLN  49           1HG      GLN  49 -10.489   3.011   4.475
  374   HE21  GLN  49          1HE2      GLN  49  -8.606   2.222   1.869
  375   HE22  GLN  49          2HE2      GLN  49  -9.347   3.226   0.675
  376    H    ILE  50           H        ILE  50  -6.525   3.704   7.079
  377    HA   ILE  50           HA       ILE  50  -4.982   1.429   6.862
  378    HB   ILE  50           HB       ILE  50  -5.658   0.938   9.259
  379   HG12  ILE  50          2HG1      ILE  50  -6.826   3.561   9.678
  380   HG13  ILE  50          1HG1      ILE  50  -7.826   2.588   8.605
  381   HG21  ILE  50          1HG2      ILE  50  -4.485   2.910  10.138
  382   HG22  ILE  50          2HG2      ILE  50  -4.667   3.701   8.571
  383   HG23  ILE  50          3HG2      ILE  50  -3.691   2.240   8.713
  384   HD11  ILE  50          3HD1      ILE  50  -7.923   0.825  10.268
  385   HD12  ILE  50          1HD1      ILE  50  -8.490   2.354  10.937
  386   HD13  ILE  50          2HD1      ILE  50  -6.878   1.760  11.338
  387    H    GLY  51           H        GLY  51  -5.376  -0.582   6.240
  388    HA2  GLY  51           2HA      GLY  51  -6.679  -2.624   6.759
  389    HA3  GLY  51           1HA      GLY  51  -8.120  -1.652   6.548
  390    H    ASP  52           H        ASP  52  -6.802  -0.303   4.130
  391    HA   ASP  52           HA       ASP  52  -7.908  -2.021   2.197
  392    HB2  ASP  52           2HB      ASP  52  -6.727  -0.460   0.549
  393    HB3  ASP  52           1HB      ASP  52  -7.919   0.257   1.619
  394    H    LYS  53           H        LYS  53  -6.767  -2.953   0.321
  395    HA   LYS  53           HA       LYS  53  -4.171  -4.062   1.156
  396    HB2  LYS  53           2HB      LYS  53  -4.802  -5.802  -0.712
  397    HB3  LYS  53           1HB      LYS  53  -5.460  -5.949   0.906
  398    HG2  LYS  53           2HG      LYS  53  -7.077  -4.351  -0.958
  399    HG3  LYS  53           1HG      LYS  53  -6.924  -6.063  -1.355
  400    HD2  LYS  53           2HD      LYS  53  -8.438  -6.559   0.192
  401    HD3  LYS  53           1HD      LYS  53  -7.398  -5.863   1.435
  402    HE2  LYS  53           2HE      LYS  53  -8.537  -3.661   0.189
  403    HE3  LYS  53           1HE      LYS  53  -9.849  -4.834   0.273
  404    HZ1  LYS  53           3HZ      LYS  53  -8.176  -4.126   2.614
  405    HZ2  LYS  53           1HZ      LYS  53  -9.638  -4.976   2.603
  406    HZ3  LYS  53           2HZ      LYS  53  -9.617  -3.324   2.239
  407    H    LEU  54           H        LEU  54  -2.523  -4.173  -0.269
  408    HA   LEU  54           HA       LEU  54  -2.642  -2.219  -2.433
  409    HG   LEU  54           HG       LEU  54  -0.580  -1.722   0.348
  410    HB2  LEU  54           2HB      LEU  54  -0.339  -3.505  -0.998
  411    HB3  LEU  54           1HB      LEU  54  -0.121  -2.515  -2.422
  412   HD11  LEU  54          1HD1      LEU  54   0.315   0.454  -0.669
  413   HD12  LEU  54          2HD1      LEU  54   0.557  -0.497  -2.134
  414   HD13  LEU  54          3HD1      LEU  54   1.376  -0.954  -0.641
  415   HD21  LEU  54          3HD2      LEU  54  -2.272  -0.497  -1.819
  416   HD22  LEU  54          1HD2      LEU  54  -1.887   0.327  -0.307
  417   HD23  LEU  54          2HD2      LEU  54  -2.800  -1.181  -0.282
  418    H    LEU  55           H        LEU  55  -3.332  -3.014  -4.276
  419    HA   LEU  55           HA       LEU  55  -2.877  -5.678  -5.168
  420    HG   LEU  55           HG       LEU  55  -5.104  -5.053  -8.009
  421    HB2  LEU  55           2HB      LEU  55  -4.786  -4.181  -5.876
  422    HB3  LEU  55           1HB      LEU  55  -3.641  -3.292  -6.858
  423   HD11  LEU  55          1HD1      LEU  55  -2.910  -3.944  -8.817
  424   HD12  LEU  55          2HD1      LEU  55  -3.515  -5.373  -9.656
  425   HD13  LEU  55          3HD1      LEU  55  -2.192  -5.522  -8.499
  426   HD21  LEU  55          3HD2      LEU  55  -3.035  -6.964  -6.956
  427   HD22  LEU  55          1HD2      LEU  55  -4.491  -7.323  -7.885
  428   HD23  LEU  55          2HD2      LEU  55  -4.623  -6.778  -6.213
  429    H    ALA  56           H        ALA  56  -1.559  -2.499  -6.200
  430    HA   ALA  56           HA       ALA  56   0.988  -3.809  -6.767
  431    HB1  ALA  56           3HB      ALA  56  -0.640  -2.470  -8.937
  432    HB2  ALA  56           1HB      ALA  56  -0.090  -4.146  -8.892
  433    HB3  ALA  56           2HB      ALA  56   1.078  -2.836  -9.092
  434    H    VAL  57           H        VAL  57   2.754  -2.338  -7.023
  435    HA   VAL  57           HA       VAL  57   2.183   0.495  -6.527
  436    HB   VAL  57           HB       VAL  57   4.058  -1.144  -4.808
  437   HG11  VAL  57          1HG1      VAL  57   3.905   1.723  -5.347
  438   HG12  VAL  57          2HG1      VAL  57   5.192   0.776  -4.602
  439   HG13  VAL  57          3HG1      VAL  57   3.826   1.325  -3.631
  440   HG21  VAL  57          3HG2      VAL  57   1.858  -1.528  -4.048
  441   HG22  VAL  57          1HG2      VAL  57   1.403   0.162  -4.265
  442   HG23  VAL  57          2HG2      VAL  57   2.520  -0.292  -2.979
  443    H    ASN  58           H        ASN  58   3.177   1.569  -8.077
  444    HA   ASN  58           HA       ASN  58   4.745   2.311  -9.551
  445    HB2  ASN  58           2HB      ASN  58   6.587   0.806  -7.686
  446    HB3  ASN  58           1HB      ASN  58   7.167   1.755  -9.049
  447   HD21  ASN  58          1HD2      ASN  58   6.784   4.031  -9.046
  448   HD22  ASN  58          2HD2      ASN  58   6.567   4.874  -7.555
  449    H    ASN  59           H        ASN  59   3.276   0.358 -10.518
  450    HA   ASN  59           HA       ASN  59   3.160  -0.999 -12.338
  451    HB2  ASN  59           2HB      ASN  59   5.909  -0.073 -12.460
  452    HB3  ASN  59           1HB      ASN  59   5.737  -1.704 -13.099
  453   HD21  ASN  59          1HD2      ASN  59   4.640   1.614 -13.387
  454   HD22  ASN  59          2HD2      ASN  59   4.078   1.484 -15.015
  455    H    VAL  60           H        VAL  60   5.010  -1.936  -9.542
  456    HA   VAL  60           HA       VAL  60   4.967  -4.745 -10.380
  457    HB   VAL  60           HB       VAL  60   6.199  -5.192  -8.265
  458   HG11  VAL  60          1HG1      VAL  60   7.591  -5.048 -10.114
  459   HG12  VAL  60          2HG1      VAL  60   8.299  -3.879  -8.998
  460   HG13  VAL  60          3HG1      VAL  60   7.288  -3.324 -10.333
  461   HG21  VAL  60          3HG2      VAL  60   6.934  -3.536  -6.821
  462   HG22  VAL  60          1HG2      VAL  60   5.283  -3.037  -7.184
  463   HG23  VAL  60          2HG2      VAL  60   6.639  -2.247  -7.988
  464    H    CYS  61           H        CYS  61   4.019  -6.397  -9.047
  465    HA   CYS  61           HA       CYS  61   1.542  -5.511  -7.824
  466    HG   CYS  61           HG       CYS  61   2.982  -9.265  -7.247
  467    HB2  CYS  61           2HB      CYS  61   0.940  -7.856  -7.736
  468    HB3  CYS  61           1HB      CYS  61   1.566  -7.472  -9.334
  469    H    LEU  62           H        LEU  62   1.075  -5.492  -5.682
  470    HA   LEU  62           HA       LEU  62   3.257  -6.212  -3.866
  471    HG   LEU  62           HG       LEU  62   3.154  -4.922  -1.556
  472    HB2  LEU  62           2HB      LEU  62   1.894  -3.862  -4.088
  473    HB3  LEU  62           1HB      LEU  62   1.028  -4.645  -2.784
  474   HD11  LEU  62          1HD1      LEU  62   4.329  -3.324  -3.825
  475   HD12  LEU  62          2HD1      LEU  62   4.674  -5.014  -3.452
  476   HD13  LEU  62          3HD1      LEU  62   5.154  -3.746  -2.325
  477   HD21  LEU  62          3HD2      LEU  62   3.264  -2.742  -0.757
  478   HD22  LEU  62          1HD2      LEU  62   1.640  -2.852  -1.431
  479   HD23  LEU  62          2HD2      LEU  62   2.917  -2.043  -2.336
  480    H    GLU  63           H        GLU  63   1.412  -8.183  -4.964
  481    HA   GLU  63           HA       GLU  63   0.031  -9.023  -2.499
  482    HB2  GLU  63           2HB      GLU  63  -1.149  -8.525  -4.879
  483    HB3  GLU  63           1HB      GLU  63  -0.790 -10.235  -5.066
  484    HG2  GLU  63           2HG      GLU  63  -2.208  -9.161  -2.653
  485    HG3  GLU  63           1HG      GLU  63  -3.065  -9.601  -4.127
  486    H    GLU  64           H        GLU  64   2.386  -9.936  -4.892
  487    HA   GLU  64           HA       GLU  64   2.526 -12.625  -3.697
  488    HB2  GLU  64           2HB      GLU  64   2.269 -11.886  -6.396
  489    HB3  GLU  64           1HB      GLU  64   3.915 -12.464  -6.199
  490    HG2  GLU  64           2HG      GLU  64   1.525 -14.007  -5.247
  491    HG3  GLU  64           1HG      GLU  64   2.199 -14.180  -6.866
  492    H    VAL  65           H        VAL  65   3.777 -10.745  -2.272
  493    HA   VAL  65           HA       VAL  65   6.582 -11.472  -2.621
  494    HB   VAL  65           HB       VAL  65   7.354  -9.136  -2.244
  495   HG11  VAL  65          1HG1      VAL  65   5.769  -9.417  -4.791
  496   HG12  VAL  65          2HG1      VAL  65   7.292 -10.252  -4.487
  497   HG13  VAL  65          3HG1      VAL  65   7.247  -8.489  -4.537
  498   HG21  VAL  65          3HG2      VAL  65   5.467  -8.045  -1.347
  499   HG22  VAL  65          1HG2      VAL  65   4.443  -8.529  -2.699
  500   HG23  VAL  65          2HG2      VAL  65   5.714  -7.331  -2.941
  501    H    THR  66           H        THR  66   7.911 -11.118  -0.811
  502    HA   THR  66           HA       THR  66   6.637 -11.568   1.701
  503    HB   THR  66           HB       THR  66   8.966 -11.415   2.618
  504    HG1  THR  66           1HG      THR  66  10.091 -10.066   1.398
  505   HG21  THR  66          3HG2      THR  66   9.845 -13.364   1.618
  506   HG22  THR  66          1HG2      THR  66   8.940 -13.093   0.129
  507   HG23  THR  66          2HG2      THR  66   8.090 -13.533   1.611
  508    H    HIS  67           H        HIS  67   7.971 -10.048   3.577
  509    HA   HIS  67           HA       HIS  67   6.583  -7.563   3.286
  510    HD1  HIS  67           1HD      HIS  67   5.149  -6.995   6.170
  511    HD2  HIS  67           2HD      HIS  67   8.889  -5.302   5.559
  512    HE1  HIS  67           1HE      HIS  67   4.923  -4.587   6.840
  513    HE2  HIS  67           2HE      HIS  67   7.148  -3.559   6.317
  514    HB2  HIS  67           2HB      HIS  67   6.864  -8.689   5.497
  515    HB3  HIS  67           1HB      HIS  67   8.551  -8.199   5.494
  516    H    GLU  68           H        GLU  68   9.995  -8.505   3.177
  517    HA   GLU  68           HA       GLU  68  11.224  -6.050   3.028
  518    HB2  GLU  68           2HB      GLU  68  12.554  -8.104   2.919
  519    HB3  GLU  68           1HB      GLU  68  11.887  -8.483   1.333
  520    HG2  GLU  68           2HG      GLU  68  12.958  -6.481   0.421
  521    HG3  GLU  68           1HG      GLU  68  13.646  -6.136   2.009
  522    H    GLU  69           H        GLU  69   9.861  -7.852   0.284
  523    HA   GLU  69           HA       GLU  69  10.242  -5.866  -1.670
  524    HB2  GLU  69           2HB      GLU  69   8.542  -8.293  -1.428
  525    HB3  GLU  69           1HB      GLU  69   8.144  -7.144  -2.700
  526    HG2  GLU  69           2HG      GLU  69   9.576  -8.858  -3.580
  527    HG3  GLU  69           1HG      GLU  69  10.447  -7.324  -3.549
  528    H    ALA  70           H        ALA  70   7.633  -6.384   0.641
  529    HA   ALA  70           HA       ALA  70   5.692  -4.637  -0.407
  530    HB1  ALA  70           3HB      ALA  70   6.290  -5.301   2.478
  531    HB2  ALA  70           1HB      ALA  70   5.233  -6.215   1.404
  532    HB3  ALA  70           2HB      ALA  70   4.807  -4.569   1.877
  533    H    VAL  71           H        VAL  71   8.394  -4.107   1.808
  534    HA   VAL  71           HA       VAL  71   7.865  -1.282   2.098
  535    HB   VAL  71           HB       VAL  71  10.131  -3.043   3.036
  536   HG11  VAL  71          1HG1      VAL  71  10.658  -0.882   4.423
  537   HG12  VAL  71          2HG1      VAL  71   9.897  -0.070   3.055
  538   HG13  VAL  71          3HG1      VAL  71  11.314  -1.088   2.799
  539   HG21  VAL  71          3HG2      VAL  71   9.139  -3.023   5.091
  540   HG22  VAL  71          1HG2      VAL  71   7.703  -2.885   4.077
  541   HG23  VAL  71          2HG2      VAL  71   8.387  -1.448   4.836
  542    H    THR  72           H        THR  72  10.084  -3.339   0.280
  543    HA   THR  72           HA       THR  72  11.778  -1.333  -0.703
  544    HB   THR  72           HB       THR  72  11.040  -4.020  -1.870
  545    HG1  THR  72           1HG      THR  72  12.373  -4.705  -0.426
  546   HG21  THR  72          3HG2      THR  72  11.950  -2.762  -3.682
  547   HG22  THR  72          1HG2      THR  72  13.204  -3.850  -3.089
  548   HG23  THR  72          2HG2      THR  72  13.249  -2.139  -2.665
  549    H    ALA  73           H        ALA  73   8.692  -2.594  -1.907
  550    HA   ALA  73           HA       ALA  73   8.772  -1.165  -4.371
  551    HB1  ALA  73           3HB      ALA  73   7.489  -3.194  -4.230
  552    HB2  ALA  73           1HB      ALA  73   6.395  -1.849  -4.551
  553    HB3  ALA  73           2HB      ALA  73   6.504  -2.528  -2.927
  554    H    LEU  74           H        LEU  74   7.348  -0.600  -1.168
  555    HA   LEU  74           HA       LEU  74   5.868   1.719  -1.902
  556    HG   LEU  74           HG       LEU  74   4.473   0.732   1.336
  557    HB2  LEU  74           2HB      LEU  74   6.716   0.379   0.599
  558    HB3  LEU  74           1HB      LEU  74   6.406   2.097   0.725
  559   HD11  LEU  74          1HD1      LEU  74   3.993   2.301  -1.188
  560   HD12  LEU  74          2HD1      LEU  74   4.210   3.010   0.413
  561   HD13  LEU  74          3HD1      LEU  74   2.826   1.965   0.091
  562   HD21  LEU  74          3HD2      LEU  74   3.272  -0.184  -0.862
  563   HD22  LEU  74          1HD2      LEU  74   4.342  -1.177   0.126
  564   HD23  LEU  74          2HD2      LEU  74   4.950  -0.419  -1.344
  565    H    LYS  75           H        LYS  75   9.111   1.054  -0.787
  566    HA   LYS  75           HA       LYS  75   9.810   3.862  -0.557
  567    HB2  LYS  75           2HB      LYS  75  11.899   3.167   0.270
  568    HB3  LYS  75           1HB      LYS  75  10.740   2.017   0.915
  569    HG2  LYS  75           2HG      LYS  75  11.653   0.288  -0.181
  570    HG3  LYS  75           1HG      LYS  75  11.967   1.232  -1.635
  571    HD2  LYS  75           2HD      LYS  75  14.108   0.814  -0.903
  572    HD3  LYS  75           1HD      LYS  75  13.788   2.373  -0.142
  573    HE2  LYS  75           2HE      LYS  75  12.845   0.320   1.589
  574    HE3  LYS  75           1HE      LYS  75  14.484  -0.091   1.086
  575    HZ1  LYS  75           3HZ      LYS  75  13.588   2.412   2.400
  576    HZ2  LYS  75           1HZ      LYS  75  15.135   2.199   1.751
  577    HZ3  LYS  75           2HZ      LYS  75  14.617   1.234   3.039
  578    H    ASN  76           H        ASN  76   9.799   1.535  -3.084
  579    HA   ASN  76           HA       ASN  76  11.922   2.771  -4.608
  580    HB2  ASN  76           2HB      ASN  76  11.349   0.310  -4.730
  581    HB3  ASN  76           1HB      ASN  76   9.886   0.762  -5.597
  582   HD21  ASN  76          1HD2      ASN  76  10.006   0.947  -7.736
  583   HD22  ASN  76          2HD2      ASN  76  11.467   1.020  -8.655
  584    H    THR  77           H        THR  77  10.544   4.855  -4.145
  585    HA   THR  77           HA       THR  77   8.818   5.325  -6.484
  586    HB   THR  77           HB       THR  77   7.898   7.236  -4.983
  587    HG1  THR  77           1HG      THR  77   9.557   6.830  -3.341
  588   HG21  THR  77          3HG2      THR  77   6.397   5.623  -3.729
  589   HG22  THR  77          1HG2      THR  77   7.293   4.336  -4.534
  590   HG23  THR  77          2HG2      THR  77   6.397   5.515  -5.490
  591    H    SER  78           H        SER  78  10.022   6.339  -7.950
  592    HA   SER  78           HA       SER  78  12.100   8.197  -7.133
  593    HG   SER  78           HG       SER  78  13.760   8.408  -9.349
  594    HB2  SER  78           2HB      SER  78  12.661   6.622  -8.886
  595    HB3  SER  78           1HB      SER  78  11.306   7.172  -9.869
  596    H    ASP  79           H        ASP  79  10.205   8.733 -10.059
  597    HA   ASP  79           HA       ASP  79   9.920  11.500  -9.403
  598    HB2  ASP  79           2HB      ASP  79   9.025   9.818 -11.735
  599    HB3  ASP  79           1HB      ASP  79   8.582  11.517 -11.592
  600    H    PHE  80           H        PHE  80   7.369   9.150 -10.352
  601    HA   PHE  80           HA       PHE  80   5.629  10.532  -8.434
  602    HD1  PHE  80           2HD      PHE  80   2.458  10.260  -8.892
  603    HD2  PHE  80           1HD      PHE  80   5.173  12.689 -11.094
  604    HE1  PHE  80           2HE      PHE  80   1.095  12.241  -8.376
  605    HE2  PHE  80           1HE      PHE  80   3.814  14.675 -10.579
  606    HZ   PHE  80           HZ       PHE  80   1.776  14.450  -9.217
  607    HB2  PHE  80           2HB      PHE  80   5.302  10.323 -11.226
  608    HB3  PHE  80           1HB      PHE  80   4.069   9.298 -10.497
  609    H    VAL  81           H        VAL  81   4.371   9.316  -7.076
  610    HA   VAL  81           HA       VAL  81   4.868   6.449  -6.981
  611    HB   VAL  81           HB       VAL  81   3.302   8.168  -5.047
  612   HG11  VAL  81          1HG1      VAL  81   2.675   6.112  -4.371
  613   HG12  VAL  81          2HG1      VAL  81   4.245   6.138  -3.569
  614   HG13  VAL  81          3HG1      VAL  81   4.060   5.318  -5.120
  615   HG21  VAL  81          3HG2      VAL  81   6.187   7.833  -5.433
  616   HG22  VAL  81          1HG2      VAL  81   5.636   7.591  -3.776
  617   HG23  VAL  81          2HG2      VAL  81   5.290   9.106  -4.608
  618    H    TYR  82           H        TYR  82   3.510   5.058  -7.910
  619    HA   TYR  82           HA       TYR  82   0.679   5.844  -8.194
  620    HD1  TYR  82           1HD      TYR  82  -0.094   2.565 -10.014
  621    HD2  TYR  82           2HD      TYR  82   0.111   6.667 -11.129
  622    HE1  TYR  82           1HE      TYR  82  -2.284   2.376 -11.095
  623    HE2  TYR  82           2HE      TYR  82  -2.086   6.486 -12.213
  624    HH   TYR  82           HH       TYR  82  -3.440   4.064 -13.245
  625    HB2  TYR  82           2HB      TYR  82   2.075   5.503 -10.325
  626    HB3  TYR  82           1HB      TYR  82   2.014   3.787  -9.940
  627    H    LEU  83           H        LEU  83  -0.234   4.982  -6.455
  628    HA   LEU  83           HA       LEU  83   0.364   2.237  -5.686
  629    HG   LEU  83           HG       LEU  83   0.300   1.812  -3.433
  630    HB2  LEU  83           2HB      LEU  83   0.091   4.318  -4.119
  631    HB3  LEU  83           1HB      LEU  83  -1.618   3.960  -4.263
  632   HD11  LEU  83          1HD1      LEU  83  -0.379   2.474  -1.059
  633   HD12  LEU  83          2HD1      LEU  83  -0.792   4.043  -1.751
  634   HD13  LEU  83          3HD1      LEU  83   0.862   3.441  -1.855
  635   HD21  LEU  83          3HD2      LEU  83  -2.154   1.716  -2.070
  636   HD22  LEU  83          1HD2      LEU  83  -1.589   0.652  -3.358
  637   HD23  LEU  83          2HD2      LEU  83  -2.534   2.088  -3.751
  638    H    LYS  84           H        LYS  84  -0.819   0.585  -6.245
  639    HA   LYS  84           HA       LYS  84  -3.540   0.996  -7.263
  640    HB2  LYS  84           2HB      LYS  84  -1.471  -1.106  -7.858
  641    HB3  LYS  84           1HB      LYS  84  -3.165  -1.329  -8.270
  642    HG2  LYS  84           2HG      LYS  84  -2.167   1.220  -9.208
  643    HG3  LYS  84           1HG      LYS  84  -1.213  -0.129  -9.827
  644    HD2  LYS  84           2HD      LYS  84  -2.893   0.097 -11.416
  645    HD3  LYS  84           1HD      LYS  84  -3.500  -1.195 -10.381
  646    HE2  LYS  84           2HE      LYS  84  -4.389   1.222  -9.245
  647    HE3  LYS  84           1HE      LYS  84  -4.666   1.356 -10.981
  648    HZ1  LYS  84           3HZ      LYS  84  -6.571   0.385  -9.890
  649    HZ2  LYS  84           1HZ      LYS  84  -5.618  -0.846  -9.228
  650    HZ3  LYS  84           2HZ      LYS  84  -5.851  -0.765 -10.901
  651    H    VAL  85           H        VAL  85  -5.133   0.386  -5.939
  652    HA   VAL  85           HA       VAL  85  -4.475  -1.493  -3.784
  653    HB   VAL  85           HB       VAL  85  -6.877   0.339  -3.980
  654   HG11  VAL  85          1HG1      VAL  85  -5.854  -0.756  -1.410
  655   HG12  VAL  85          2HG1      VAL  85  -6.775  -1.826  -2.465
  656   HG13  VAL  85          3HG1      VAL  85  -7.499  -0.326  -1.885
  657   HG21  VAL  85          3HG2      VAL  85  -4.828   1.649  -3.871
  658   HG22  VAL  85          1HG2      VAL  85  -4.298   0.728  -2.464
  659   HG23  VAL  85          2HG2      VAL  85  -5.721   1.764  -2.355
  660    H    ALA  86           H        ALA  86  -5.478  -3.400  -3.543
  661    HA   ALA  86           HA       ALA  86  -7.096  -4.373  -5.737
  662    HB1  ALA  86           3HB      ALA  86  -6.594  -6.501  -5.011
  663    HB2  ALA  86           1HB      ALA  86  -6.471  -6.012  -3.321
  664    HB3  ALA  86           2HB      ALA  86  -5.185  -5.600  -4.454
  665    H    LYS  87           H        LYS  87  -9.183  -5.170  -5.613
  666    HA   LYS  87           HA       LYS  87 -10.702  -4.382  -3.214
  667    HB2  LYS  87           2HB      LYS  87 -11.299  -4.167  -6.125
  668    HB3  LYS  87           1HB      LYS  87 -12.642  -4.486  -5.036
  669    HG2  LYS  87           2HG      LYS  87 -10.742  -2.224  -4.534
  670    HG3  LYS  87           1HG      LYS  87 -12.109  -2.054  -5.638
  671    HD2  LYS  87           2HD      LYS  87 -13.574  -2.872  -3.742
  672    HD3  LYS  87           1HD      LYS  87 -12.170  -2.674  -2.691
  673    HE2  LYS  87           2HE      LYS  87 -12.071  -0.279  -3.613
  674    HE3  LYS  87           1HE      LYS  87 -13.710  -0.578  -4.190
  675    HZ1  LYS  87           3HZ      LYS  87 -14.345  -1.104  -1.891
  676    HZ2  LYS  87           1HZ      LYS  87 -13.776   0.481  -2.048
  677    HZ3  LYS  87           2HZ      LYS  87 -12.784  -0.710  -1.371
  678    HA   PRO  88           HA       PRO  88 -11.136  -8.920  -3.173
  679    HB2  PRO  88           2HB      PRO  88 -11.846  -9.074  -0.558
  680    HB3  PRO  88           1HB      PRO  88 -10.166  -8.922  -1.087
  681    HG2  PRO  88           2HG      PRO  88 -12.035  -6.806  -0.087
  682    HG3  PRO  88           1HG      PRO  88 -10.328  -7.073   0.317
  683    HD2  PRO  88           2HD      PRO  88 -11.122  -5.196  -1.461
  684    HD3  PRO  88           1HD      PRO  88  -9.582  -6.063  -1.619
  685    H    THR  89           H        THR  89 -12.930 -10.230  -3.289
  686    HA   THR  89           HA       THR  89 -15.544  -8.978  -2.762
  687    HB   THR  89           HB       THR  89 -14.947 -10.815  -5.087
  688    HG1  THR  89           1HG      THR  89 -15.170  -7.987  -5.022
  689   HG21  THR  89          3HG2      THR  89 -17.367  -9.254  -4.276
  690   HG22  THR  89          1HG2      THR  89 -17.237 -10.956  -4.720
  691   HG23  THR  89          2HG2      THR  89 -17.080  -9.708  -5.956
  692    H    GLY  90           H        GLY  90 -14.090 -12.160  -3.547
  693    HA2  GLY  90           2HA      GLY  90 -14.561 -13.508  -1.239
  694    HA3  GLY  90           1HA      GLY  90 -16.125 -13.542  -2.035
  695    H    SER  91           H        SER  91 -12.941 -14.841  -1.935
  696    HA   SER  91           HA       SER  91 -13.034 -16.189  -4.463
  697    HG   SER  91           HG       SER  91 -10.882 -15.813  -1.364
  698    HB2  SER  91           2HB      SER  91 -11.032 -17.404  -3.617
  699    HB3  SER  91           1HB      SER  91 -10.878 -15.653  -3.478
  700    H    HIS  92           H        HIS  92 -13.601 -17.150  -1.091
  701    HA   HIS  92           HA       HIS  92 -14.355 -19.840  -1.888
  702    HD1  HIS  92           1HD      HIS  92 -12.279 -17.501   1.166
  703    HD2  HIS  92           2HD      HIS  92 -16.338 -18.119   1.807
  704    HE1  HIS  92           1HE      HIS  92 -12.980 -15.723   2.800
  705    HE2  HIS  92           2HE      HIS  92 -15.464 -16.040   3.073
  706    HB2  HIS  92           2HB      HIS  92 -14.753 -20.165   0.566
  707    HB3  HIS  92           1HB      HIS  92 -13.115 -19.667   0.165
  708    HA   ARG 301           HA       ARG 301   3.212 -11.479  10.239
  709    HE   ARG 301           HE       ARG 301  -0.828  -9.299  11.735
  710    H1   ARG 301           1HT      ARG 301   2.435 -12.880  12.117
  711    H2   ARG 301           2HT      ARG 301   3.406 -11.896  13.136
  712    H3   ARG 301           3HT      ARG 301   4.126 -12.793  11.862
  713    HB2  ARG 301           2HB      ARG 301   1.530  -9.736  10.764
  714    HB3  ARG 301           1HB      ARG 301   0.962 -11.362  11.108
  715    HG2  ARG 301           2HG      ARG 301   2.010 -10.608  13.515
  716    HG3  ARG 301           1HG      ARG 301   1.362  -9.088  12.896
  717    HD2  ARG 301           2HD      ARG 301  -0.170 -11.680  13.074
  718    HD3  ARG 301           1HD      ARG 301  -0.268 -10.369  14.250
  719   HH11  ARG 301          1HH1      ARG 301  -2.246 -11.580  13.984
  720   HH12  ARG 301          2HH1      ARG 301  -3.866 -11.284  13.451
  721   HH21  ARG 301          1HH2      ARG 301  -2.964  -8.917  11.038
  722   HH22  ARG 301          2HH2      ARG 301  -4.273  -9.773  11.779
  723    H    ARG 302           H        ARG 302   3.742  -9.208   9.713
  724    HA   ARG 302           HA       ARG 302   5.351  -7.818  11.717
  725    HE   ARG 302           HE       ARG 302   9.914  -6.338   8.542
  726    HB2  ARG 302           2HB      ARG 302   6.871  -9.321  10.424
  727    HB3  ARG 302           1HB      ARG 302   6.411  -8.453   8.962
  728    HG2  ARG 302           2HG      ARG 302   7.368  -6.411   9.804
  729    HG3  ARG 302           1HG      ARG 302   7.703  -7.165  11.361
  730    HD2  ARG 302           2HD      ARG 302   9.489  -8.374  10.541
  731    HD3  ARG 302           1HD      ARG 302   8.882  -8.360   8.885
  732   HH11  ARG 302          1HH1      ARG 302   9.988  -7.088  11.964
  733   HH12  ARG 302          2HH1      ARG 302  11.075  -5.796  12.347
  734   HH21  ARG 302          1HH2      ARG 302  11.346  -4.645   9.052
  735   HH22  ARG 302          2HH2      ARG 302  11.846  -4.408  10.693
  736    H    GLU 303           H        GLU 303   5.078  -5.689  11.661
  737    HA   GLU 303           HA       GLU 303   3.945  -4.463   9.232
  738    HB2  GLU 303           2HB      GLU 303   3.212  -3.926  12.118
  739    HB3  GLU 303           1HB      GLU 303   2.705  -2.915  10.771
  740    HG2  GLU 303           2HG      GLU 303   0.884  -4.312  11.226
  741    HG3  GLU 303           1HG      GLU 303   1.644  -4.989   9.788
  742    H    THR 304           H        THR 304   5.473  -3.188   8.398
  743    HA   THR 304           HA       THR 304   7.118  -1.601  10.253
  744    HB   THR 304           HB       THR 304   7.848  -3.325   8.035
  745    HG1  THR 304           1HG      THR 304   8.916  -3.618   9.885
  746   HG21  THR 304          3HG2      THR 304   9.070  -0.580   8.027
  747   HG22  THR 304          1HG2      THR 304   8.075  -1.281   6.750
  748   HG23  THR 304          2HG2      THR 304   9.651  -1.979   7.125
  749    H    GLN 305           H        GLN 305   7.617   0.539   9.719
  750    HA   GLN 305           HA       GLN 305   5.599   1.868   8.133
  751    HB2  GLN 305           2HB      GLN 305   7.759   2.758   9.999
  752    HB3  GLN 305           1HB      GLN 305   7.097   3.918   8.856
  753    HG2  GLN 305           2HG      GLN 305   5.005   3.890   9.828
  754    HG3  GLN 305           1HG      GLN 305   5.263   2.317  10.581
  755   HE21  GLN 305          1HE2      GLN 305   6.482   2.189  12.487
  756   HE22  GLN 305          2HE2      GLN 305   6.772   3.580  13.471
  757    H    VAL 306           H        VAL 306   6.017   3.277   6.381
  758    HA   VAL 306           HA       VAL 306   8.633   3.018   5.085
  759    HB   VAL 306           HB       VAL 306   7.496   2.650   2.882
  760   HG11  VAL 306          1HG1      VAL 306   7.030   0.463   4.909
  761   HG12  VAL 306          2HG1      VAL 306   8.589   0.842   4.175
  762   HG13  VAL 306          3HG1      VAL 306   7.258   0.269   3.170
  763   HG21  VAL 306          3HG2      VAL 306   5.273   3.311   3.218
  764   HG22  VAL 306          1HG2      VAL 306   5.109   2.337   4.679
  765   HG23  VAL 306          2HG2      VAL 306   5.191   1.553   3.102
  Start of MODEL    9
    1    HA   MET   1           HA       MET   1  -8.877   1.969  -8.431
    2    H1   MET   1           1HT      MET   1  -9.426  -0.361  -8.454
    3    H2   MET   1           2HT      MET   1  -7.821  -0.742  -7.977
    4    H3   MET   1           3HT      MET   1  -8.114   0.016  -9.489
    5    HB2  MET   1           2HB      MET   1  -9.480   0.289  -6.356
    6    HB3  MET   1           1HB      MET   1  -8.051   1.106  -5.736
    7    HG2  MET   1           2HG      MET   1 -10.193   2.765  -6.944
    8    HG3  MET   1           1HG      MET   1 -10.484   2.052  -5.360
    9    HE1  MET   1           3HE      MET   1 -10.156   5.295  -6.364
   10    HE2  MET   1           1HE      MET   1  -8.827   4.779  -7.403
   11    HE3  MET   1           2HE      MET   1  -8.529   5.921  -6.093
   12    H    GLU   2           H        GLU   2  -7.335   3.439  -8.715
   13    HA   GLU   2           HA       GLU   2  -4.573   2.765  -7.932
   14    HB2  GLU   2           2HB      GLU   2  -3.841   4.218  -9.804
   15    HB3  GLU   2           1HB      GLU   2  -4.760   2.823 -10.343
   16    HG2  GLU   2           2HG      GLU   2  -6.246   5.343  -9.873
   17    HG3  GLU   2           1HG      GLU   2  -5.191   5.260 -11.283
   18    H    ILE   3           H        ILE   3  -3.246   4.474  -7.139
   19    HA   ILE   3           HA       ILE   3  -4.556   6.999  -6.517
   20    HB   ILE   3           HB       ILE   3  -3.262   5.207  -4.447
   21   HG12  ILE   3          2HG1      ILE   3  -5.840   6.331  -3.758
   22   HG13  ILE   3          1HG1      ILE   3  -5.937   5.435  -5.269
   23   HG21  ILE   3          1HG2      ILE   3  -2.500   7.408  -3.999
   24   HG22  ILE   3          2HG2      ILE   3  -3.805   7.072  -2.861
   25   HG23  ILE   3          3HG2      ILE   3  -4.103   8.089  -4.271
   26   HD11  ILE   3          3HD1      ILE   3  -4.996   3.476  -4.170
   27   HD12  ILE   3          1HD1      ILE   3  -6.464   4.028  -3.363
   28   HD13  ILE   3          2HD1      ILE   3  -4.884   4.377  -2.657
   29    H    LYS   4           H        LYS   4  -3.192   8.094  -7.887
   30    HA   LYS   4           HA       LYS   4  -0.297   7.799  -7.533
   31    HB2  LYS   4           2HB      LYS   4  -1.207   7.698  -9.830
   32    HB3  LYS   4           1HB      LYS   4  -1.882   9.307  -9.630
   33    HG2  LYS   4           2HG      LYS   4   0.635   9.917  -9.109
   34    HG3  LYS   4           1HG      LYS   4   0.930   8.465 -10.070
   35    HD2  LYS   4           2HD      LYS   4  -1.060  10.096 -11.346
   36    HD3  LYS   4           1HD      LYS   4   0.371  11.065 -10.993
   37    HE2  LYS   4           2HE      LYS   4   1.712   9.845 -12.388
   38    HE3  LYS   4           1HE      LYS   4   0.764   8.371 -12.189
   39    HZ1  LYS   4           3HZ      LYS   4  -0.114  10.753 -13.733
   40    HZ2  LYS   4           1HZ      LYS   4  -0.935   9.278 -13.608
   41    HZ3  LYS   4           2HZ      LYS   4   0.549   9.355 -14.413
   42    H    LEU   5           H        LEU   5   1.032   9.588  -6.888
   43    HA   LEU   5           HA       LEU   5  -0.240  12.126  -6.343
   44    HG   LEU   5           HG       LEU   5  -1.812  11.384  -4.577
   45    HB2  LEU   5           2HB      LEU   5   0.432  10.149  -4.273
   46    HB3  LEU   5           1HB      LEU   5   1.113  11.737  -3.986
   47   HD11  LEU   5          1HD1      LEU   5  -1.532  11.768  -1.832
   48   HD12  LEU   5          2HD1      LEU   5  -0.384  10.491  -2.235
   49   HD13  LEU   5          3HD1      LEU   5  -2.089  10.310  -2.654
   50   HD21  LEU   5          3HD2      LEU   5  -0.271  13.498  -3.074
   51   HD22  LEU   5          1HD2      LEU   5  -2.000  13.509  -3.421
   52   HD23  LEU   5          2HD2      LEU   5  -0.835  13.635  -4.739
   53    H    ILE   6           H        ILE   6   1.510  13.669  -5.396
   54    HA   ILE   6           HA       ILE   6   3.931  13.268  -6.983
   55    HB   ILE   6           HB       ILE   6   2.710  15.416  -7.187
   56   HG12  ILE   6          2HG1      ILE   6   5.424  15.864  -5.941
   57   HG13  ILE   6          1HG1      ILE   6   5.218  15.149  -7.535
   58   HG21  ILE   6          1HG2      ILE   6   2.533  16.979  -5.454
   59   HG22  ILE   6          2HG2      ILE   6   3.694  16.122  -4.440
   60   HG23  ILE   6          3HG2      ILE   6   2.088  15.444  -4.709
   61   HD11  ILE   6          3HD1      ILE   6   3.801  17.296  -7.985
   62   HD12  ILE   6          1HD1      ILE   6   5.562  17.345  -8.066
   63   HD13  ILE   6          2HD1      ILE   6   4.728  17.937  -6.629
   64    H    LYS   7           H        LYS   7   5.810  12.670  -6.111
   65    HA   LYS   7           HA       LYS   7   6.055  12.025  -3.373
   66    HB2  LYS   7           2HB      LYS   7   7.311  11.024  -5.380
   67    HB3  LYS   7           1HB      LYS   7   8.393  12.400  -5.231
   68    HG2  LYS   7           2HG      LYS   7   9.378  10.562  -4.089
   69    HG3  LYS   7           1HG      LYS   7   8.827  11.720  -2.875
   70    HD2  LYS   7           2HD      LYS   7   6.689  10.305  -2.778
   71    HD3  LYS   7           1HD      LYS   7   7.621   9.077  -3.636
   72    HE2  LYS   7           2HE      LYS   7   9.269   9.048  -1.854
   73    HE3  LYS   7           1HE      LYS   7   8.412  10.340  -1.017
   74    HZ1  LYS   7           3HZ      LYS   7   7.899   8.191  -0.057
   75    HZ2  LYS   7           1HZ      LYS   7   7.351   7.617  -1.550
   76    HZ3  LYS   7           2HZ      LYS   7   6.512   8.856  -0.762
   77    H    GLY   8           H        GLY   8   6.855  13.090  -1.668
   78    HA2  GLY   8           2HA      GLY   8   7.909  15.815  -2.136
   79    HA3  GLY   8           1HA      GLY   8   6.915  15.378  -0.755
   80    HA   PRO   9           HA       PRO   9  11.558  15.211   0.261
   81    HB2  PRO   9           2HB      PRO   9  10.666  16.973   2.463
   82    HB3  PRO   9           1HB      PRO   9  12.065  17.125   1.395
   83    HG2  PRO   9           2HG      PRO   9   9.945  18.731   1.134
   84    HG3  PRO   9           1HG      PRO   9  10.842  18.148  -0.282
   85    HD2  PRO   9           2HD      PRO   9   8.223  17.206   0.823
   86    HD3  PRO   9           1HD      PRO   9   8.716  17.434  -0.868
   87    H    LYS  10           H        LYS  10   8.678  15.210   2.346
   88    HA   LYS  10           HA       LYS  10   9.800  13.776   4.493
   89    HB2  LYS  10           2HB      LYS  10   6.956  14.122   3.556
   90    HB3  LYS  10           1HB      LYS  10   7.359  13.181   4.985
   91    HG2  LYS  10           2HG      LYS  10   8.467  15.921   4.819
   92    HG3  LYS  10           1HG      LYS  10   6.731  15.761   5.089
   93    HD2  LYS  10           2HD      LYS  10   7.408  15.693   7.258
   94    HD3  LYS  10           1HD      LYS  10   7.589  13.979   6.881
   95    HE2  LYS  10           2HE      LYS  10   9.995  15.003   6.081
   96    HE3  LYS  10           1HE      LYS  10   9.616  16.006   7.480
   97    HZ1  LYS  10           3HZ      LYS  10  10.872  14.036   8.103
   98    HZ2  LYS  10           1HZ      LYS  10   9.674  13.034   7.452
   99    HZ3  LYS  10           2HZ      LYS  10   9.331  14.002   8.797
  100    H    GLY  11           H        GLY  11   7.374  12.475   2.205
  101    HA2  GLY  11           2HA      GLY  11   8.424  10.424   0.977
  102    HA3  GLY  11           1HA      GLY  11   8.528   9.808   2.617
  103    H    LEU  12           H        LEU  12   7.052   8.222   2.715
  104    HA   LEU  12           HA       LEU  12   4.476   8.497   1.419
  105    HG   LEU  12           HG       LEU  12   6.449   6.741   0.667
  106    HB2  LEU  12           2HB      LEU  12   5.610   6.304   3.160
  107    HB3  LEU  12           1HB      LEU  12   4.053   6.232   2.357
  108   HD11  LEU  12          1HD1      LEU  12   6.516   4.646   2.465
  109   HD12  LEU  12          2HD1      LEU  12   7.463   4.792   0.986
  110   HD13  LEU  12          3HD1      LEU  12   5.937   3.909   0.974
  111   HD21  LEU  12          3HD2      LEU  12   5.200   5.667  -0.996
  112   HD22  LEU  12          1HD2      LEU  12   4.017   6.623  -0.104
  113   HD23  LEU  12          2HD2      LEU  12   4.141   4.886   0.178
  114    H    GLY  13           H        GLY  13   5.625   8.003   4.768
  115    HA2  GLY  13           2HA      GLY  13   4.858   9.060   6.687
  116    HA3  GLY  13           1HA      GLY  13   3.570   9.791   5.754
  117    H    PHE  14           H        PHE  14   4.165   6.317   5.765
  118    HA   PHE  14           HA       PHE  14   2.172   5.817   7.783
  119    HD1  PHE  14           2HD      PHE  14   2.215   3.021   4.895
  120    HD2  PHE  14           1HD      PHE  14   1.003   6.930   3.719
  121    HE1  PHE  14           2HE      PHE  14   2.706   2.463   2.553
  122    HE2  PHE  14           1HE      PHE  14   1.490   6.377   1.374
  123    HZ   PHE  14           HZ       PHE  14   2.341   4.143   0.787
  124    HB2  PHE  14           2HB      PHE  14   0.648   4.557   6.297
  125    HB3  PHE  14           1HB      PHE  14   0.700   6.270   5.910
  126    H    SER  15           H        SER  15   1.600   3.243   7.522
  127    HA   SER  15           HA       SER  15   4.175   1.887   7.141
  128    HG   SER  15           HG       SER  15   2.261   2.888   9.836
  129    HB2  SER  15           2HB      SER  15   3.108   0.327   9.021
  130    HB3  SER  15           1HB      SER  15   4.094   1.730   9.419
  131    H    ILE  16           H        ILE  16   3.853  -0.552   6.968
  132    HA   ILE  16           HA       ILE  16   1.304  -1.419   5.884
  133    HB   ILE  16           HB       ILE  16   1.898  -1.849   3.707
  134   HG12  ILE  16          2HG1      ILE  16   4.011  -3.046   4.242
  135   HG13  ILE  16          1HG1      ILE  16   4.093  -2.077   2.777
  136   HG21  ILE  16          1HG2      ILE  16   3.436   0.653   4.328
  137   HG22  ILE  16          2HG2      ILE  16   1.720   0.535   3.938
  138   HG23  ILE  16          3HG2      ILE  16   2.930   0.145   2.717
  139   HD11  ILE  16          3HD1      ILE  16   4.943  -0.647   5.156
  140   HD12  ILE  16          1HD1      ILE  16   5.718  -0.805   3.582
  141   HD13  ILE  16          2HD1      ILE  16   5.920  -2.074   4.794
  142    H    ALA  17           H        ALA  17   1.461  -3.720   5.170
  143    HA   ALA  17           HA       ALA  17   3.614  -5.269   6.401
  144    HB1  ALA  17           3HB      ALA  17   1.594  -6.865   7.074
  145    HB2  ALA  17           1HB      ALA  17   0.739  -5.326   7.164
  146    HB3  ALA  17           2HB      ALA  17   2.176  -5.596   8.151
  147    H    GLY  18           H        GLY  18   3.349  -7.688   5.538
  148    HA2  GLY  18           2HA      GLY  18   1.734  -8.325   3.426
  149    HA3  GLY  18           1HA      GLY  18   3.015  -7.395   2.693
  150    H    GLY  19           H        GLY  19   2.011 -10.459   2.945
  151    HA2  GLY  19           2HA      GLY  19   3.408 -12.144   1.975
  152    HA3  GLY  19           1HA      GLY  19   4.787 -11.413   2.770
  153    H    VAL  20           H        VAL  20   4.043 -14.158   2.748
  154    HA   VAL  20           HA       VAL  20   2.789 -14.978   5.140
  155    HB   VAL  20           HB       VAL  20   4.877 -16.489   3.549
  156   HG11  VAL  20          1HG1      VAL  20   4.632 -17.586   5.618
  157   HG12  VAL  20          2HG1      VAL  20   3.607 -18.479   4.494
  158   HG13  VAL  20          3HG1      VAL  20   2.885 -17.343   5.632
  159   HG21  VAL  20          3HG2      VAL  20   2.246 -15.691   2.817
  160   HG22  VAL  20          1HG2      VAL  20   2.249 -17.439   3.058
  161   HG23  VAL  20          2HG2      VAL  20   3.379 -16.702   1.922
  162    H    GLY  21           H        GLY  21   3.679 -15.697   7.114
  163    HA2  GLY  21           2HA      GLY  21   5.327 -15.938   8.766
  164    HA3  GLY  21           1HA      GLY  21   6.520 -15.319   7.633
  165    H    ASN  22           H        ASN  22   4.541 -13.036   7.105
  166    HA   ASN  22           HA       ASN  22   4.801 -11.507   9.580
  167    HB2  ASN  22           2HB      ASN  22   5.813  -9.627   8.489
  168    HB3  ASN  22           1HB      ASN  22   6.796 -11.016   8.049
  169   HD21  ASN  22          1HD2      ASN  22   4.637  -8.592   6.975
  170   HD22  ASN  22          2HD2      ASN  22   4.830  -8.886   5.288
  171    H    GLN  23           H        GLN  23   2.657 -12.766   7.665
  172    HA   GLN  23           HA       GLN  23   1.149 -11.039   6.276
  173    HB2  GLN  23           2HB      GLN  23   0.802 -13.527   6.831
  174    HB3  GLN  23           1HB      GLN  23  -0.150 -12.950   8.191
  175    HG2  GLN  23           2HG      GLN  23  -1.620 -11.753   6.635
  176    HG3  GLN  23           1HG      GLN  23  -0.676 -12.375   5.283
  177   HE21  GLN  23          1HE2      GLN  23  -1.676 -13.977   4.297
  178   HE22  GLN  23          2HE2      GLN  23  -2.621 -15.209   5.050
  179    H    HIS  24           H        HIS  24  -0.374  -9.500   6.558
  180    HA   HIS  24           HA       HIS  24  -0.504  -8.187   9.149
  181    HD1  HIS  24           1HD      HIS  24  -0.076  -5.439   9.304
  182    HD2  HIS  24           2HD      HIS  24  -3.704  -5.682   7.302
  183    HE1  HIS  24           1HE      HIS  24  -1.435  -3.520  10.149
  184    HE2  HIS  24           2HE      HIS  24  -3.580  -3.602   8.835
  185    HB2  HIS  24           2HB      HIS  24  -0.137  -6.905   7.033
  186    HB3  HIS  24           1HB      HIS  24  -1.749  -7.359   6.518
  187    H    ILE  25           H        ILE  25  -2.573 -10.047   7.027
  188    HA   ILE  25           HA       ILE  25  -4.651 -10.030   9.088
  189    HB   ILE  25           HB       ILE  25  -5.389  -9.695   6.184
  190   HG12  ILE  25          2HG1      ILE  25  -5.158  -7.552   8.312
  191   HG13  ILE  25          1HG1      ILE  25  -4.154  -7.696   6.873
  192   HG21  ILE  25          1HG2      ILE  25  -7.578  -9.260   6.986
  193   HG22  ILE  25          2HG2      ILE  25  -7.018  -9.145   8.653
  194   HG23  ILE  25          3HG2      ILE  25  -7.011 -10.703   7.826
  195   HD11  ILE  25          3HD1      ILE  25  -6.270  -7.420   5.527
  196   HD12  ILE  25          1HD1      ILE  25  -5.721  -6.004   6.426
  197   HD13  ILE  25          2HD1      ILE  25  -7.061  -6.973   7.040
  198    HA   PRO  26           HA       PRO  26  -4.307 -14.436   8.491
  199    HB2  PRO  26           2HB      PRO  26  -7.136 -14.296   9.437
  200    HB3  PRO  26           1HB      PRO  26  -5.813 -15.324   9.996
  201    HG2  PRO  26           2HG      PRO  26  -6.577 -13.216  11.422
  202    HG3  PRO  26           1HG      PRO  26  -4.859 -13.632  11.268
  203    HD2  PRO  26           2HD      PRO  26  -6.410 -11.452   9.952
  204    HD3  PRO  26           1HD      PRO  26  -4.721 -11.468  10.499
  205    H    GLY  27           H        GLY  27  -4.451 -15.358   6.545
  206    HA2  GLY  27           2HA      GLY  27  -5.752 -16.455   4.872
  207    HA3  GLY  27           1HA      GLY  27  -7.023 -15.270   5.125
  208    H    ASP  28           H        ASP  28  -5.693 -12.879   4.875
  209    HA   ASP  28           HA       ASP  28  -5.023 -12.928   2.030
  210    HB2  ASP  28           2HB      ASP  28  -6.725 -11.310   3.355
  211    HB3  ASP  28           1HB      ASP  28  -5.263 -10.332   3.435
  212    H    ASN  29           H        ASN  29  -2.970 -13.057   1.499
  213    HA   ASN  29           HA       ASN  29  -0.899 -12.078   3.306
  214    HB2  ASN  29           2HB      ASN  29   0.661 -13.278   1.884
  215    HB3  ASN  29           1HB      ASN  29  -0.676 -14.324   2.344
  216   HD21  ASN  29          1HD2      ASN  29   1.066 -12.920  -0.228
  217   HD22  ASN  29          2HD2      ASN  29   0.116 -13.557  -1.523
  218    H    SER  30           H        SER  30  -2.688 -10.369   1.376
  219    HA   SER  30           HA       SER  30  -0.727  -9.164  -0.369
  220    HG   SER  30           HG       SER  30  -2.677  -6.609  -0.949
  221    HB2  SER  30           2HB      SER  30  -3.190  -9.321  -0.921
  222    HB3  SER  30           1HB      SER  30  -3.473  -8.102   0.322
  223    H    ILE  31           H        ILE  31  -0.204  -6.850  -0.258
  224    HA   ILE  31           HA       ILE  31   0.669  -6.170   2.357
  225    HB   ILE  31           HB       ILE  31   0.758  -4.361  -0.058
  226   HG12  ILE  31          2HG1      ILE  31   2.042  -5.926  -1.027
  227   HG13  ILE  31          1HG1      ILE  31   3.268  -5.434   0.126
  228   HG21  ILE  31          1HG2      ILE  31   2.758  -4.443   2.155
  229   HG22  ILE  31          2HG2      ILE  31   1.270  -3.510   2.309
  230   HG23  ILE  31          3HG2      ILE  31   2.408  -3.148   1.011
  231   HD11  ILE  31          3HD1      ILE  31   3.359  -7.580   0.696
  232   HD12  ILE  31          1HD1      ILE  31   1.852  -7.949  -0.140
  233   HD13  ILE  31          2HD1      ILE  31   1.816  -7.325   1.507
  234    H    TYR  32           H        TYR  32  -0.371  -5.097   3.906
  235    HA   TYR  32           HA       TYR  32  -2.576  -3.284   3.164
  236    HD1  TYR  32           2HD      TYR  32  -2.403  -6.883   3.652
  237    HD2  TYR  32           1HD      TYR  32  -5.577  -4.179   4.424
  238    HE1  TYR  32           2HE      TYR  32  -3.925  -8.356   2.418
  239    HE2  TYR  32           1HE      TYR  32  -7.131  -5.635   3.211
  240    HH   TYR  32           HH       TYR  32  -6.280  -7.903   1.127
  241    HB2  TYR  32           2HB      TYR  32  -2.329  -5.161   5.512
  242    HB3  TYR  32           1HB      TYR  32  -3.506  -3.854   5.461
  243    H    VAL  33           H        VAL  33  -2.801  -1.366   4.308
  244    HA   VAL  33           HA       VAL  33  -0.399  -0.281   5.447
  245    HB   VAL  33           HB       VAL  33  -3.158   0.875   5.029
  246   HG11  VAL  33          1HG1      VAL  33  -0.829   2.011   6.526
  247   HG12  VAL  33          2HG1      VAL  33  -2.547   2.057   6.924
  248   HG13  VAL  33          3HG1      VAL  33  -1.913   3.077   5.632
  249   HG21  VAL  33          3HG2      VAL  33  -0.606   0.874   3.575
  250   HG22  VAL  33          1HG2      VAL  33  -1.386   2.451   3.700
  251   HG23  VAL  33          2HG2      VAL  33  -2.253   1.094   2.983
  252    H    THR  34           H        THR  34   0.179  -0.436   7.498
  253    HA   THR  34           HA       THR  34  -1.712  -1.445   9.456
  254    HB   THR  34           HB       THR  34   0.084  -2.185  10.683
  255    HG1  THR  34           1HG      THR  34   1.562  -0.826  11.218
  256   HG21  THR  34          3HG2      THR  34   1.805  -3.062   9.271
  257   HG22  THR  34          1HG2      THR  34   1.416  -1.902   8.006
  258   HG23  THR  34          2HG2      THR  34   0.263  -3.166   8.425
  259    H    LYS  35           H        LYS  35  -0.177   1.616   8.747
  260    HA   LYS  35           HA       LYS  35  -1.797   2.981  10.638
  261    HB2  LYS  35           2HB      LYS  35  -0.326   2.146  12.320
  262    HB3  LYS  35           1HB      LYS  35   1.097   2.522  11.358
  263    HG2  LYS  35           2HG      LYS  35   0.604   4.924  11.625
  264    HG3  LYS  35           1HG      LYS  35  -0.757   4.504  12.667
  265    HD2  LYS  35           2HD      LYS  35   0.585   3.911  14.407
  266    HD3  LYS  35           1HD      LYS  35   1.875   3.328  13.353
  267    HE2  LYS  35           2HE      LYS  35   2.046   5.907  12.762
  268    HE3  LYS  35           1HE      LYS  35   1.330   6.071  14.365
  269    HZ1  LYS  35           3HZ      LYS  35   3.722   6.127  14.506
  270    HZ2  LYS  35           1HZ      LYS  35   3.851   4.641  13.708
  271    HZ3  LYS  35           2HZ      LYS  35   3.154   4.718  15.247
  272    H    ILE  36           H        ILE  36  -2.014   5.079  10.037
  273    HA   ILE  36           HA       ILE  36  -0.109   6.082   8.038
  274    HB   ILE  36           HB       ILE  36  -2.964   6.899   8.582
  275   HG12  ILE  36          2HG1      ILE  36  -1.569   5.444   6.335
  276   HG13  ILE  36          1HG1      ILE  36  -2.910   4.879   7.325
  277   HG21  ILE  36          1HG2      ILE  36  -0.978   8.070   6.632
  278   HG22  ILE  36          2HG2      ILE  36  -1.674   8.879   8.037
  279   HG23  ILE  36          3HG2      ILE  36  -2.703   8.441   6.673
  280   HD11  ILE  36          3HD1      ILE  36  -3.688   5.429   5.120
  281   HD12  ILE  36          1HD1      ILE  36  -3.002   7.049   5.245
  282   HD13  ILE  36          2HD1      ILE  36  -4.349   6.583   6.282
  283    H    ILE  37           H        ILE  37   1.210   7.715   8.532
  284    HA   ILE  37           HA       ILE  37   1.088   8.949  11.142
  285    HB   ILE  37           HB       ILE  37   3.054   9.104   8.861
  286   HG12  ILE  37          2HG1      ILE  37   4.572   8.298  10.784
  287   HG13  ILE  37          1HG1      ILE  37   3.074   7.957  11.642
  288   HG21  ILE  37          1HG2      ILE  37   3.021  10.766  11.364
  289   HG22  ILE  37          2HG2      ILE  37   3.085  11.316   9.690
  290   HG23  ILE  37          3HG2      ILE  37   4.473  10.495  10.401
  291   HD11  ILE  37          3HD1      ILE  37   3.762   6.827   8.944
  292   HD12  ILE  37          1HD1      ILE  37   2.413   6.372   9.986
  293   HD13  ILE  37          2HD1      ILE  37   4.068   6.007  10.474
  294    H    GLU  38           H        GLU  38   1.012  11.217  11.516
  295    HA   GLU  38           HA       GLU  38  -0.951  12.605  10.051
  296    HB2  GLU  38           2HB      GLU  38  -0.086  12.942  12.506
  297    HB3  GLU  38           1HB      GLU  38   1.043  14.063  11.756
  298    HG2  GLU  38           2HG      GLU  38  -0.608  15.548  11.174
  299    HG3  GLU  38           1HG      GLU  38  -1.866  14.313  11.163
  300    H    GLY  39           H        GLY  39  -0.832  14.352   8.626
  301    HA2  GLY  39           2HA      GLY  39  -0.003  15.593   6.893
  302    HA3  GLY  39           1HA      GLY  39   1.495  15.663   7.802
  303    H    GLY  40           H        GLY  40   0.390  12.499   6.941
  304    HA2  GLY  40           2HA      GLY  40   2.679  12.190   5.177
  305    HA3  GLY  40           1HA      GLY  40   1.627  10.910   5.760
  306    H    ALA  41           H        ALA  41   2.453  10.958   3.139
  307    HA   ALA  41           HA       ALA  41   0.974  12.252   1.230
  308    HB1  ALA  41           3HB      ALA  41   1.417  10.368  -0.249
  309    HB2  ALA  41           1HB      ALA  41   1.832   9.360   1.139
  310    HB3  ALA  41           2HB      ALA  41   2.838  10.747   0.723
  311    H    ALA  42           H        ALA  42   0.113   9.112   2.716
  312    HA   ALA  42           HA       ALA  42  -2.412   8.916   1.453
  313    HB1  ALA  42           3HB      ALA  42  -1.314   7.582   3.922
  314    HB2  ALA  42           1HB      ALA  42  -1.379   6.929   2.284
  315    HB3  ALA  42           2HB      ALA  42  -2.870   7.178   3.194
  316    H    HIS  43           H        HIS  43  -1.496   9.868   4.761
  317    HA   HIS  43           HA       HIS  43  -3.968  10.412   5.837
  318    HD1  HIS  43           1HD      HIS  43  -2.542  14.117   7.126
  319    HD2  HIS  43           2HD      HIS  43  -3.798  10.682   9.099
  320    HE1  HIS  43           1HE      HIS  43  -3.799  14.927   9.146
  321    HE2  HIS  43           2HE      HIS  43  -4.625  12.832  10.279
  322    HB2  HIS  43           2HB      HIS  43  -1.839  10.469   7.086
  323    HB3  HIS  43           1HB      HIS  43  -1.418  11.976   6.286
  324    H    LYS  44           H        LYS  44  -1.941  12.592   3.896
  325    HA   LYS  44           HA       LYS  44  -3.732  14.809   4.065
  326    HB2  LYS  44           2HB      LYS  44  -1.394  14.202   2.257
  327    HB3  LYS  44           1HB      LYS  44  -2.314  15.697   2.156
  328    HG2  LYS  44           2HG      LYS  44  -1.654  16.351   4.342
  329    HG3  LYS  44           1HG      LYS  44  -0.957  14.763   4.672
  330    HD2  LYS  44           2HD      LYS  44   0.880  15.142   3.314
  331    HD3  LYS  44           1HD      LYS  44   0.056  16.389   2.375
  332    HE2  LYS  44           2HE      LYS  44   0.638  16.800   5.285
  333    HE3  LYS  44           1HE      LYS  44   1.885  17.086   4.071
  334    HZ1  LYS  44           3HZ      LYS  44   0.344  18.639   2.971
  335    HZ2  LYS  44           1HZ      LYS  44   0.740  19.124   4.542
  336    HZ3  LYS  44           2HZ      LYS  44  -0.765  18.419   4.230
  337    H    ASP  45           H        ASP  45  -3.203  12.235   1.694
  338    HA   ASP  45           HA       ASP  45  -4.870  13.286  -0.329
  339    HB2  ASP  45           2HB      ASP  45  -3.116  11.331  -0.383
  340    HB3  ASP  45           1HB      ASP  45  -4.509  10.331   0.017
  341    H    GLY  46           H        GLY  46  -5.519  10.697   2.069
  342    HA2  GLY  46           2HA      GLY  46  -7.554  10.558   3.293
  343    HA3  GLY  46           1HA      GLY  46  -8.344  11.500   2.039
  344    H    LYS  47           H        LYS  47  -7.095   9.777  -0.088
  345    HA   LYS  47           HA       LYS  47  -9.217   7.954  -0.393
  346    HB2  LYS  47           2HB      LYS  47  -6.762   8.640  -1.859
  347    HB3  LYS  47           1HB      LYS  47  -7.308   6.986  -2.089
  348    HG2  LYS  47           2HG      LYS  47  -9.450   7.745  -2.870
  349    HG3  LYS  47           1HG      LYS  47  -9.031   9.420  -2.502
  350    HD2  LYS  47           2HD      LYS  47  -7.034   8.208  -4.197
  351    HD3  LYS  47           1HD      LYS  47  -8.639   8.063  -4.916
  352    HE2  LYS  47           2HE      LYS  47  -8.700  10.231  -5.423
  353    HE3  LYS  47           1HE      LYS  47  -8.215  10.695  -3.792
  354    HZ1  LYS  47           3HZ      LYS  47  -6.331   9.791  -5.902
  355    HZ2  LYS  47           1HZ      LYS  47  -5.927  10.404  -4.377
  356    HZ3  LYS  47           2HZ      LYS  47  -6.643  11.412  -5.533
  357    H    LEU  48           H        LEU  48  -5.855   7.469   0.696
  358    HA   LEU  48           HA       LEU  48  -6.340   4.625   1.059
  359    HG   LEU  48           HG       LEU  48  -4.483   3.284   0.871
  360    HB2  LEU  48           2HB      LEU  48  -4.156   5.788   0.212
  361    HB3  LEU  48           1HB      LEU  48  -3.835   6.016   1.920
  362   HD11  LEU  48          1HD1      LEU  48  -2.691   4.165  -0.555
  363   HD12  LEU  48          2HD1      LEU  48  -2.123   2.868   0.496
  364   HD13  LEU  48          3HD1      LEU  48  -1.745   4.546   0.884
  365   HD21  LEU  48          3HD2      LEU  48  -4.217   4.100   3.372
  366   HD22  LEU  48          1HD2      LEU  48  -2.508   3.865   3.007
  367   HD23  LEU  48          2HD2      LEU  48  -3.641   2.523   2.838
  368    H    GLN  49           H        GLN  49  -6.995   3.743   2.884
  369    HA   GLN  49           HA       GLN  49  -6.459   5.066   5.439
  370    HB2  GLN  49           2HB      GLN  49  -8.696   4.701   6.206
  371    HB3  GLN  49           1HB      GLN  49  -8.790   5.563   4.682
  372    HG2  GLN  49           2HG      GLN  49  -9.082   2.580   4.866
  373    HG3  GLN  49           1HG      GLN  49 -10.444   3.681   5.059
  374   HE21  GLN  49          1HE2      GLN  49  -8.541   1.966   2.875
  375   HE22  GLN  49          2HE2      GLN  49  -9.132   2.676   1.415
  376    H    ILE  50           H        ILE  50  -6.122   3.659   7.184
  377    HA   ILE  50           HA       ILE  50  -4.901   1.245   6.768
  378    HB   ILE  50           HB       ILE  50  -5.561   0.650   9.151
  379   HG12  ILE  50          2HG1      ILE  50  -6.428   3.369   9.753
  380   HG13  ILE  50          1HG1      ILE  50  -7.568   2.528   8.707
  381   HG21  ILE  50          1HG2      ILE  50  -4.064   3.064   8.290
  382   HG22  ILE  50          2HG2      ILE  50  -3.494   1.598   9.089
  383   HG23  ILE  50          3HG2      ILE  50  -4.344   2.835  10.017
  384   HD11  ILE  50          3HD1      ILE  50  -7.668   0.690  10.334
  385   HD12  ILE  50          1HD1      ILE  50  -8.179   2.235  11.017
  386   HD13  ILE  50          2HD1      ILE  50  -6.579   1.592  11.389
  387    H    GLY  51           H        GLY  51  -5.524  -0.763   6.159
  388    HA2  GLY  51           2HA      GLY  51  -7.134  -2.593   6.624
  389    HA3  GLY  51           1HA      GLY  51  -8.398  -1.413   6.333
  390    H    ASP  52           H        ASP  52  -6.641  -0.276   4.065
  391    HA   ASP  52           HA       ASP  52  -7.810  -1.843   2.012
  392    HB2  ASP  52           2HB      ASP  52  -6.428  -0.283   0.510
  393    HB3  ASP  52           1HB      ASP  52  -7.678   0.440   1.506
  394    H    LYS  53           H        LYS  53  -6.711  -2.928   0.300
  395    HA   LYS  53           HA       LYS  53  -4.165  -4.120   1.166
  396    HB2  LYS  53           2HB      LYS  53  -4.748  -5.956  -0.450
  397    HB3  LYS  53           1HB      LYS  53  -5.837  -5.808   0.918
  398    HG2  LYS  53           2HG      LYS  53  -6.614  -4.325  -1.502
  399    HG3  LYS  53           1HG      LYS  53  -6.656  -6.085  -1.618
  400    HD2  LYS  53           2HD      LYS  53  -7.842  -4.942   0.829
  401    HD3  LYS  53           1HD      LYS  53  -8.694  -4.575  -0.672
  402    HE2  LYS  53           2HE      LYS  53  -9.456  -6.667  -0.876
  403    HE3  LYS  53           1HE      LYS  53  -7.888  -7.368  -0.478
  404    HZ1  LYS  53           3HZ      LYS  53  -9.896  -7.733   1.090
  405    HZ2  LYS  53           1HZ      LYS  53  -9.531  -6.181   1.656
  406    HZ3  LYS  53           2HZ      LYS  53  -8.375  -7.411   1.754
  407    H    LEU  54           H        LEU  54  -2.492  -4.329  -0.277
  408    HA   LEU  54           HA       LEU  54  -2.506  -2.319  -2.392
  409    HG   LEU  54           HG       LEU  54  -0.938  -0.863  -2.033
  410    HB2  LEU  54           2HB      LEU  54  -0.634  -2.998  -0.481
  411    HB3  LEU  54           1HB      LEU  54   0.032  -3.679  -1.954
  412   HD11  LEU  54          1HD1      LEU  54   1.332  -1.841  -0.401
  413   HD12  LEU  54          2HD1      LEU  54   0.293  -0.434  -0.177
  414   HD13  LEU  54          3HD1      LEU  54   1.592  -0.391  -1.369
  415   HD21  LEU  54          3HD2      LEU  54   1.102  -2.553  -3.410
  416   HD22  LEU  54          1HD2      LEU  54   1.277  -0.799  -3.405
  417   HD23  LEU  54          2HD2      LEU  54  -0.167  -1.538  -4.096
  418    H    LEU  55           H        LEU  55  -3.181  -2.971  -4.284
  419    HA   LEU  55           HA       LEU  55  -2.976  -5.637  -5.249
  420    HG   LEU  55           HG       LEU  55  -4.247  -6.070  -7.163
  421    HB2  LEU  55           2HB      LEU  55  -4.672  -3.809  -5.898
  422    HB3  LEU  55           1HB      LEU  55  -3.418  -3.203  -6.963
  423   HD11  LEU  55          1HD1      LEU  55  -6.317  -4.689  -7.150
  424   HD12  LEU  55          2HD1      LEU  55  -6.026  -5.532  -8.670
  425   HD13  LEU  55          3HD1      LEU  55  -5.682  -3.807  -8.539
  426   HD21  LEU  55          3HD2      LEU  55  -2.553  -5.803  -8.636
  427   HD22  LEU  55          1HD2      LEU  55  -2.807  -4.064  -8.785
  428   HD23  LEU  55          2HD2      LEU  55  -3.845  -5.186  -9.665
  429    H    ALA  56           H        ALA  56  -1.355  -2.579  -6.189
  430    HA   ALA  56           HA       ALA  56   1.145  -3.955  -6.595
  431    HB1  ALA  56           3HB      ALA  56  -0.331  -2.903  -9.022
  432    HB2  ALA  56           1HB      ALA  56   0.056  -4.590  -8.686
  433    HB3  ALA  56           2HB      ALA  56   1.350  -3.435  -9.017
  434    H    VAL  57           H        VAL  57   2.869  -2.424  -7.420
  435    HA   VAL  57           HA       VAL  57   2.258   0.396  -7.300
  436    HB   VAL  57           HB       VAL  57   2.422  -0.145  -4.910
  437   HG11  VAL  57          1HG1      VAL  57   4.163  -2.028  -5.443
  438   HG12  VAL  57          2HG1      VAL  57   4.198  -1.179  -3.897
  439   HG13  VAL  57          3HG1      VAL  57   5.328  -0.732  -5.176
  440   HG21  VAL  57          3HG2      VAL  57   3.702   1.902  -6.265
  441   HG22  VAL  57          1HG2      VAL  57   4.910   1.326  -5.115
  442   HG23  VAL  57          2HG2      VAL  57   3.328   1.855  -4.542
  443    H    ASN  58           H        ASN  58   3.448   1.316  -8.819
  444    HA   ASN  58           HA       ASN  58   5.091   1.714 -10.348
  445    HB2  ASN  58           2HB      ASN  58   6.894   0.521  -8.225
  446    HB3  ASN  58           1HB      ASN  58   7.418   1.504  -9.589
  447   HD21  ASN  58          1HD2      ASN  58   6.151   3.670  -9.707
  448   HD22  ASN  58          2HD2      ASN  58   6.046   4.532  -8.214
  449    H    ASN  59           H        ASN  59   3.844  -0.130 -11.367
  450    HA   ASN  59           HA       ASN  59   3.816  -1.873 -12.812
  451    HB2  ASN  59           2HB      ASN  59   6.810  -1.656 -12.517
  452    HB3  ASN  59           1HB      ASN  59   6.010  -2.699 -13.688
  453   HD21  ASN  59          1HD2      ASN  59   4.875  -1.766 -15.411
  454   HD22  ASN  59          2HD2      ASN  59   5.143  -0.128 -15.888
  455    H    VAL  60           H        VAL  60   5.401  -2.434  -9.729
  456    HA   VAL  60           HA       VAL  60   5.323  -5.321 -10.153
  457    HB   VAL  60           HB       VAL  60   6.364  -5.485  -7.903
  458   HG11  VAL  60          1HG1      VAL  60   7.966  -5.628  -9.534
  459   HG12  VAL  60          2HG1      VAL  60   8.528  -4.199  -8.665
  460   HG13  VAL  60          3HG1      VAL  60   7.622  -4.019 -10.168
  461   HG21  VAL  60          3HG2      VAL  60   5.430  -3.245  -7.134
  462   HG22  VAL  60          1HG2      VAL  60   6.774  -2.516  -8.013
  463   HG23  VAL  60          2HG2      VAL  60   7.090  -3.626  -6.680
  464    H    CYS  61           H        CYS  61   3.959  -6.723  -9.164
  465    HA   CYS  61           HA       CYS  61   1.604  -5.604  -7.910
  466    HG   CYS  61           HG       CYS  61   3.350  -9.043  -9.118
  467    HB2  CYS  61           2HB      CYS  61   0.723  -7.875  -7.943
  468    HB3  CYS  61           1HB      CYS  61   1.372  -7.448  -9.523
  469    H    LEU  62           H        LEU  62   1.071  -5.714  -5.770
  470    HA   LEU  62           HA       LEU  62   3.136  -6.752  -3.978
  471    HG   LEU  62           HG       LEU  62   3.594  -5.374  -1.960
  472    HB2  LEU  62           2HB      LEU  62   1.774  -4.284  -4.110
  473    HB3  LEU  62           1HB      LEU  62   1.211  -5.087  -2.663
  474   HD11  LEU  62          1HD1      LEU  62   5.314  -4.078  -3.090
  475   HD12  LEU  62          2HD1      LEU  62   4.148  -3.578  -4.315
  476   HD13  LEU  62          3HD1      LEU  62   4.610  -5.275  -4.177
  477   HD21  LEU  62          3HD2      LEU  62   2.062  -3.406  -1.350
  478   HD22  LEU  62          1HD2      LEU  62   3.045  -2.473  -2.477
  479   HD23  LEU  62          2HD2      LEU  62   3.793  -3.229  -1.070
  480    H    GLU  63           H        GLU  63   0.755  -8.189  -5.296
  481    HA   GLU  63           HA       GLU  63  -0.886  -8.874  -3.001
  482    HB2  GLU  63           2HB      GLU  63  -0.967  -9.692  -5.899
  483    HB3  GLU  63           1HB      GLU  63  -2.033 -10.388  -4.689
  484    HG2  GLU  63           2HG      GLU  63  -1.867  -7.427  -5.141
  485    HG3  GLU  63           1HG      GLU  63  -2.926  -8.461  -6.094
  486    H    GLU  64           H        GLU  64   1.802 -10.278  -4.760
  487    HA   GLU  64           HA       GLU  64   1.692 -12.574  -2.931
  488    HB2  GLU  64           2HB      GLU  64   1.140 -12.787  -5.613
  489    HB3  GLU  64           1HB      GLU  64   2.840 -13.208  -5.524
  490    HG2  GLU  64           2HG      GLU  64   0.766 -14.476  -3.772
  491    HG3  GLU  64           1HG      GLU  64   1.214 -15.118  -5.353
  492    H    VAL  65           H        VAL  65   3.195 -10.950  -1.869
  493    HA   VAL  65           HA       VAL  65   5.924 -11.755  -2.498
  494    HB   VAL  65           HB       VAL  65   6.769  -9.410  -2.332
  495   HG11  VAL  65          1HG1      VAL  65   4.940  -9.794  -4.691
  496   HG12  VAL  65          2HG1      VAL  65   6.459 -10.667  -4.484
  497   HG13  VAL  65          3HG1      VAL  65   6.466  -8.910  -4.632
  498   HG21  VAL  65          3HG2      VAL  65   5.169  -7.588  -2.885
  499   HG22  VAL  65          1HG2      VAL  65   4.900  -8.314  -1.300
  500   HG23  VAL  65          2HG2      VAL  65   3.849  -8.734  -2.653
  501    H    THR  66           H        THR  66   7.439 -11.385  -0.844
  502    HA   THR  66           HA       THR  66   6.442 -11.715   1.792
  503    HB   THR  66           HB       THR  66   9.014 -11.123   2.284
  504    HG1  THR  66           1HG      THR  66   9.846 -10.575   0.413
  505   HG21  THR  66          3HG2      THR  66   8.068 -13.320   2.658
  506   HG22  THR  66          1HG2      THR  66   9.631 -13.436   1.850
  507   HG23  THR  66          2HG2      THR  66   8.145 -13.659   0.928
  508    H    HIS  67           H        HIS  67   7.918 -10.123   3.494
  509    HA   HIS  67           HA       HIS  67   6.485  -7.642   3.221
  510    HD1  HIS  67           1HD      HIS  67   5.192  -6.835   6.040
  511    HD2  HIS  67           2HD      HIS  67   9.034  -5.413   5.403
  512    HE1  HIS  67           1HE      HIS  67   5.117  -4.415   6.644
  513    HE2  HIS  67           2HE      HIS  67   7.401  -3.540   6.079
  514    HB2  HIS  67           2HB      HIS  67   6.803  -8.671   5.449
  515    HB3  HIS  67           1HB      HIS  67   8.509  -8.292   5.382
  516    H    GLU  68           H        GLU  68   9.815  -8.702   2.821
  517    HA   GLU  68           HA       GLU  68  11.118  -6.272   2.629
  518    HB2  GLU  68           2HB      GLU  68  11.592  -8.721   0.915
  519    HB3  GLU  68           1HB      GLU  68  12.728  -7.401   1.153
  520    HG2  GLU  68           2HG      GLU  68  13.587  -8.595   2.810
  521    HG3  GLU  68           1HG      GLU  68  12.128  -8.217   3.723
  522    H    GLU  69           H        GLU  69   9.206  -7.972   0.174
  523    HA   GLU  69           HA       GLU  69   9.709  -6.087  -1.913
  524    HB2  GLU  69           2HB      GLU  69   7.775  -8.336  -1.521
  525    HB3  GLU  69           1HB      GLU  69   7.545  -7.219  -2.858
  526    HG2  GLU  69           2HG      GLU  69   8.831  -8.688  -3.959
  527    HG3  GLU  69           1HG      GLU  69  10.148  -7.809  -3.186
  528    H    ALA  70           H        ALA  70   7.147  -6.495   0.495
  529    HA   ALA  70           HA       ALA  70   5.341  -4.545  -0.467
  530    HB1  ALA  70           3HB      ALA  70   4.376  -4.608   1.742
  531    HB2  ALA  70           1HB      ALA  70   5.827  -5.359   2.401
  532    HB3  ALA  70           2HB      ALA  70   4.816  -6.244   1.259
  533    H    VAL  71           H        VAL  71   8.090  -4.372   1.750
  534    HA   VAL  71           HA       VAL  71   7.748  -1.566   2.282
  535    HB   VAL  71           HB       VAL  71   8.906  -3.540   3.698
  536   HG11  VAL  71          1HG1      VAL  71  10.800  -3.786   2.170
  537   HG12  VAL  71          2HG1      VAL  71  11.317  -3.263   3.771
  538   HG13  VAL  71          3HG1      VAL  71  11.241  -2.102   2.447
  539   HG21  VAL  71          3HG2      VAL  71   9.729  -1.868   5.190
  540   HG22  VAL  71          1HG2      VAL  71   8.243  -1.271   4.454
  541   HG23  VAL  71          2HG2      VAL  71   9.806  -0.674   3.893
  542    H    THR  72           H        THR  72   9.881  -3.525   0.236
  543    HA   THR  72           HA       THR  72  11.579  -1.415  -0.558
  544    HB   THR  72           HB       THR  72  10.996  -4.120  -1.745
  545    HG1  THR  72           1HG      THR  72  12.258  -4.345  -0.006
  546   HG21  THR  72          3HG2      THR  72  11.669  -2.870  -3.651
  547   HG22  THR  72          1HG2      THR  72  13.074  -3.782  -3.101
  548   HG23  THR  72          2HG2      THR  72  12.947  -2.060  -2.744
  549    H    ALA  73           H        ALA  73   8.515  -2.613  -1.813
  550    HA   ALA  73           HA       ALA  73   8.634  -1.141  -4.260
  551    HB1  ALA  73           3HB      ALA  73   7.242  -3.262  -3.642
  552    HB2  ALA  73           1HB      ALA  73   6.589  -2.066  -4.759
  553    HB3  ALA  73           2HB      ALA  73   6.061  -2.083  -3.076
  554    H    LEU  74           H        LEU  74   7.205  -0.628  -1.053
  555    HA   LEU  74           HA       LEU  74   5.783   1.753  -1.722
  556    HG   LEU  74           HG       LEU  74   4.418   0.373   1.419
  557    HB2  LEU  74           2HB      LEU  74   6.664   0.398   0.785
  558    HB3  LEU  74           1HB      LEU  74   6.169   2.075   0.884
  559   HD11  LEU  74          1HD1      LEU  74   4.008   2.761   0.710
  560   HD12  LEU  74          2HD1      LEU  74   2.664   1.643   0.477
  561   HD13  LEU  74          3HD1      LEU  74   3.659   2.127  -0.897
  562   HD21  LEU  74          3HD2      LEU  74   5.227  -0.896  -0.825
  563   HD22  LEU  74          1HD2      LEU  74   3.810  -0.034  -1.422
  564   HD23  LEU  74          2HD2      LEU  74   3.661  -1.139  -0.054
  565    H    LYS  75           H        LYS  75   9.022   0.986  -0.740
  566    HA   LYS  75           HA       LYS  75   9.766   3.762  -0.296
  567    HB2  LYS  75           2HB      LYS  75  11.824   2.997   0.488
  568    HB3  LYS  75           1HB      LYS  75  10.700   1.738   0.974
  569    HG2  LYS  75           2HG      LYS  75  11.460   0.270  -0.698
  570    HG3  LYS  75           1HG      LYS  75  12.317   1.554  -1.549
  571    HD2  LYS  75           2HD      LYS  75  14.101   0.660  -0.474
  572    HD3  LYS  75           1HD      LYS  75  13.545   1.713   0.827
  573    HE2  LYS  75           2HE      LYS  75  12.062  -0.434   1.377
  574    HE3  LYS  75           1HE      LYS  75  13.408  -1.239   0.571
  575    HZ1  LYS  75           3HZ      LYS  75  13.871  -1.150   2.888
  576    HZ2  LYS  75           1HZ      LYS  75  13.540   0.508   2.967
  577    HZ3  LYS  75           2HZ      LYS  75  14.905  -0.045   2.133
  578    H    ASN  76           H        ASN  76   9.704   1.614  -2.979
  579    HA   ASN  76           HA       ASN  76  11.842   2.793  -4.466
  580    HB2  ASN  76           2HB      ASN  76  10.773   0.454  -4.760
  581    HB3  ASN  76           1HB      ASN  76   9.549   1.289  -5.711
  582   HD21  ASN  76          1HD2      ASN  76  10.007   1.898  -7.760
  583   HD22  ASN  76          2HD2      ASN  76  11.519   1.605  -8.543
  584    H    THR  77           H        THR  77  11.019   5.050  -3.946
  585    HA   THR  77           HA       THR  77   9.292   5.968  -6.151
  586    HB   THR  77           HB       THR  77   8.557   7.807  -4.524
  587    HG1  THR  77           1HG      THR  77  10.000   7.488  -2.863
  588   HG21  THR  77          3HG2      THR  77   7.640   5.103  -3.630
  589   HG22  THR  77          1HG2      THR  77   7.183   5.769  -5.198
  590   HG23  THR  77          2HG2      THR  77   6.732   6.612  -3.716
  591    H    SER  78           H        SER  78   9.717   8.082  -6.965
  592    HA   SER  78           HA       SER  78  12.252   9.300  -6.118
  593    HG   SER  78           HG       SER  78  11.668   8.501 -10.052
  594    HB2  SER  78           2HB      SER  78  12.722   9.705  -8.613
  595    HB3  SER  78           1HB      SER  78  12.985   8.075  -7.998
  596    H    ASP  79           H        ASP  79  10.147  10.038  -8.891
  597    HA   ASP  79           HA       ASP  79   9.786  12.748  -7.821
  598    HB2  ASP  79           2HB      ASP  79   9.402  11.609 -10.597
  599    HB3  ASP  79           1HB      ASP  79   8.986  13.262 -10.156
  600    H    PHE  80           H        PHE  80   7.876  10.259  -9.511
  601    HA   PHE  80           HA       PHE  80   5.523  11.088  -7.941
  602    HD1  PHE  80           1HD      PHE  80   5.682  13.408  -9.947
  603    HD2  PHE  80           2HD      PHE  80   2.465  10.620  -9.858
  604    HE1  PHE  80           1HE      PHE  80   4.081  15.266  -9.759
  605    HE2  PHE  80           2HE      PHE  80   0.861  12.477  -9.669
  606    HZ   PHE  80           HZ       PHE  80   1.667  14.803  -9.621
  607    HB2  PHE  80           2HB      PHE  80   5.862  11.003 -10.811
  608    HB3  PHE  80           1HB      PHE  80   4.609   9.869 -10.318
  609    H    VAL  81           H        VAL  81   3.871   9.259  -7.739
  610    HA   VAL  81           HA       VAL  81   5.068   6.611  -7.987
  611    HB   VAL  81           HB       VAL  81   5.646   7.278  -5.717
  612   HG11  VAL  81          1HG1      VAL  81   2.721   7.543  -5.080
  613   HG12  VAL  81          2HG1      VAL  81   3.720   8.926  -5.525
  614   HG13  VAL  81          3HG1      VAL  81   4.108   7.985  -4.085
  615   HG21  VAL  81          3HG2      VAL  81   4.748   5.403  -4.537
  616   HG22  VAL  81          1HG2      VAL  81   4.963   4.931  -6.222
  617   HG23  VAL  81          2HG2      VAL  81   3.354   5.324  -5.615
  618    H    TYR  82           H        TYR  82   3.625   5.226  -8.842
  619    HA   TYR  82           HA       TYR  82   0.779   5.962  -8.706
  620    HD1  TYR  82           1HD      TYR  82   0.181   2.577 -10.637
  621    HD2  TYR  82           2HD      TYR  82  -0.240   6.714 -11.531
  622    HE1  TYR  82           1HE      TYR  82  -2.030   2.137 -11.598
  623    HE2  TYR  82           2HE      TYR  82  -2.460   6.285 -12.492
  624    HH   TYR  82           HH       TYR  82  -3.980   3.121 -12.303
  625    HB2  TYR  82           2HB      TYR  82   1.917   5.781 -10.956
  626    HB3  TYR  82           1HB      TYR  82   2.100   4.061 -10.637
  627    H    LEU  83           H        LEU  83   0.106   5.014  -6.888
  628    HA   LEU  83           HA       LEU  83   0.797   2.260  -6.283
  629    HG   LEU  83           HG       LEU  83   1.072   1.879  -4.018
  630    HB2  LEU  83           2HB      LEU  83   0.554   4.319  -4.652
  631    HB3  LEU  83           1HB      LEU  83  -1.130   3.830  -4.638
  632   HD11  LEU  83          1HD1      LEU  83   1.515   3.410  -2.354
  633   HD12  LEU  83          2HD1      LEU  83   0.299   2.390  -1.586
  634   HD13  LEU  83          3HD1      LEU  83  -0.160   3.954  -2.260
  635   HD21  LEU  83          3HD2      LEU  83  -0.706   0.529  -4.098
  636   HD22  LEU  83          1HD2      LEU  83  -1.844   1.875  -4.054
  637   HD23  LEU  83          2HD2      LEU  83  -1.156   1.253  -2.553
  638    H    LYS  84           H        LYS  84  -0.511   0.541  -6.357
  639    HA   LYS  84           HA       LYS  84  -3.233   0.918  -7.404
  640    HB2  LYS  84           2HB      LYS  84  -1.199  -1.224  -7.929
  641    HB3  LYS  84           1HB      LYS  84  -2.910  -1.520  -8.188
  642    HG2  LYS  84           2HG      LYS  84  -2.028   0.947  -9.431
  643    HG3  LYS  84           1HG      LYS  84  -1.130  -0.459 -10.006
  644    HD2  LYS  84           2HD      LYS  84  -2.871  -0.663 -11.427
  645    HD3  LYS  84           1HD      LYS  84  -3.646  -1.442 -10.045
  646    HE2  LYS  84           2HE      LYS  84  -4.271   1.073  -9.469
  647    HE3  LYS  84           1HE      LYS  84  -4.089   1.253 -11.214
  648    HZ1  LYS  84           3HZ      LYS  84  -5.897  -0.655  -9.830
  649    HZ2  LYS  84           1HZ      LYS  84  -5.697  -0.548 -11.508
  650    HZ3  LYS  84           2HZ      LYS  84  -6.364   0.749 -10.651
  651    H    VAL  85           H        VAL  85  -4.639   0.721  -5.777
  652    HA   VAL  85           HA       VAL  85  -4.132  -1.349  -3.750
  653    HB   VAL  85           HB       VAL  85  -5.905   1.102  -3.598
  654   HG11  VAL  85          1HG1      VAL  85  -6.563  -1.096  -2.327
  655   HG12  VAL  85          2HG1      VAL  85  -6.644   0.467  -1.516
  656   HG13  VAL  85          3HG1      VAL  85  -5.269  -0.604  -1.234
  657   HG21  VAL  85          3HG2      VAL  85  -4.243   1.581  -1.668
  658   HG22  VAL  85          1HG2      VAL  85  -3.752   1.907  -3.332
  659   HG23  VAL  85          2HG2      VAL  85  -3.196   0.443  -2.519
  660    H    ALA  86           H        ALA  86  -5.466  -3.050  -3.582
  661    HA   ALA  86           HA       ALA  86  -7.656  -3.295  -5.474
  662    HB1  ALA  86           3HB      ALA  86  -7.562  -5.576  -5.126
  663    HB2  ALA  86           1HB      ALA  86  -6.964  -5.408  -3.476
  664    HB3  ALA  86           2HB      ALA  86  -5.887  -5.102  -4.839
  665    H    LYS  87           H        LYS  87  -9.814  -3.741  -4.914
  666    HA   LYS  87           HA       LYS  87 -10.569  -2.749  -2.257
  667    HB2  LYS  87           2HB      LYS  87 -11.450  -1.784  -4.532
  668    HB3  LYS  87           1HB      LYS  87 -12.539  -3.163  -4.473
  669    HG2  LYS  87           2HG      LYS  87 -13.436  -2.417  -2.360
  670    HG3  LYS  87           1HG      LYS  87 -12.274  -1.090  -2.305
  671    HD2  LYS  87           2HD      LYS  87 -13.273  -0.195  -4.393
  672    HD3  LYS  87           1HD      LYS  87 -14.487  -1.473  -4.321
  673    HE2  LYS  87           2HE      LYS  87 -14.046   0.443  -2.048
  674    HE3  LYS  87           1HE      LYS  87 -15.130   0.816  -3.387
  675    HZ1  LYS  87           3HZ      LYS  87 -16.378  -0.135  -1.595
  676    HZ2  LYS  87           1HZ      LYS  87 -15.354  -1.479  -1.516
  677    HZ3  LYS  87           2HZ      LYS  87 -16.345  -1.248  -2.868
  678    HA   PRO  88           HA       PRO  88 -11.658  -6.889  -1.061
  679    HB2  PRO  88           2HB      PRO  88 -13.184  -6.250   1.111
  680    HB3  PRO  88           1HB      PRO  88 -11.419  -6.236   1.118
  681    HG2  PRO  88           2HG      PRO  88 -13.330  -3.956   0.811
  682    HG3  PRO  88           1HG      PRO  88 -11.831  -4.043   1.756
  683    HD2  PRO  88           2HD      PRO  88 -11.950  -2.825  -0.650
  684    HD3  PRO  88           1HD      PRO  88 -10.497  -3.677  -0.090
  685    H    THR  89           H        THR  89 -13.318  -8.292  -1.448
  686    HA   THR  89           HA       THR  89 -16.005  -7.193  -1.901
  687    HB   THR  89           HB       THR  89 -16.204  -8.802  -3.856
  688    HG1  THR  89           1HG      THR  89 -14.540 -10.098  -3.938
  689   HG21  THR  89          3HG2      THR  89 -15.330  -7.333  -5.460
  690   HG22  THR  89          1HG2      THR  89 -14.104  -6.721  -4.351
  691   HG23  THR  89          2HG2      THR  89 -15.803  -6.321  -4.096
  692    H    GLY  90           H        GLY  90 -17.732  -8.680  -1.608
  693    HA2  GLY  90           2HA      GLY  90 -17.036 -11.292  -0.468
  694    HA3  GLY  90           1HA      GLY  90 -17.949 -10.173   0.532
  695    H    SER  91           H        SER  91 -18.199 -12.733  -1.544
  696    HA   SER  91           HA       SER  91 -20.636 -12.054  -2.892
  697    HG   SER  91           HG       SER  91 -19.720 -15.636  -1.974
  698    HB2  SER  91           2HB      SER  91 -20.692 -14.481  -3.478
  699    HB3  SER  91           1HB      SER  91 -19.165 -13.700  -3.889
  700    H    HIS  92           H        HIS  92 -19.801 -13.745   0.089
  701    HA   HIS  92           HA       HIS  92 -22.362 -14.806   0.643
  702    HD1  HIS  92           1HD      HIS  92 -22.210 -13.846   4.433
  703    HD2  HIS  92           2HD      HIS  92 -21.771 -17.572   2.646
  704    HE1  HIS  92           1HE      HIS  92 -23.525 -15.438   5.868
  705    HE2  HIS  92           2HE      HIS  92 -23.134 -17.705   4.839
  706    HB2  HIS  92           2HB      HIS  92 -20.193 -15.511   1.719
  707    HB3  HIS  92           1HB      HIS  92 -20.253 -14.029   2.666
  708    HA   ARG 301           HA       ARG 301   2.912 -11.115  10.594
  709    HE   ARG 301           HE       ARG 301  -0.577 -11.107  14.208
  710    H1   ARG 301           1HT      ARG 301   4.702 -12.558  11.416
  711    H2   ARG 301           2HT      ARG 301   3.121 -13.211  11.539
  712    H3   ARG 301           3HT      ARG 301   3.907 -12.592  12.934
  713    HB2  ARG 301           2HB      ARG 301   2.260 -11.084  13.549
  714    HB3  ARG 301           1HB      ARG 301   1.601  -9.952  12.377
  715    HG2  ARG 301           2HG      ARG 301   1.044 -12.428  11.280
  716    HG3  ARG 301           1HG      ARG 301   0.786 -12.660  13.010
  717    HD2  ARG 301           2HD      ARG 301  -0.343 -10.241  11.674
  718    HD3  ARG 301           1HD      ARG 301  -1.149 -11.795  11.466
  719   HH11  ARG 301          1HH1      ARG 301  -2.903 -10.860  11.600
  720   HH12  ARG 301          2HH1      ARG 301  -4.248 -10.609  12.660
  721   HH21  ARG 301          1HH2      ARG 301  -2.353 -10.772  15.598
  722   HH22  ARG 301          2HH2      ARG 301  -3.936 -10.558  14.930
  723    H    ARG 302           H        ARG 302   4.013  -9.346  10.034
  724    HA   ARG 302           HA       ARG 302   5.514  -7.865  12.055
  725    HE   ARG 302           HE       ARG 302   9.428 -10.218  11.151
  726    HB2  ARG 302           2HB      ARG 302   7.059  -9.504  10.902
  727    HB3  ARG 302           1HB      ARG 302   6.780  -8.607   9.417
  728    HG2  ARG 302           2HG      ARG 302   7.841  -6.681  10.254
  729    HG3  ARG 302           1HG      ARG 302   7.820  -7.295  11.909
  730    HD2  ARG 302           2HD      ARG 302   9.379  -8.508   9.629
  731    HD3  ARG 302           1HD      ARG 302  10.052  -7.427  10.846
  732   HH11  ARG 302          1HH1      ARG 302   9.919  -7.195  12.851
  733   HH12  ARG 302          2HH1      ARG 302  10.330  -7.963  14.346
  734   HH21  ARG 302          1HH2      ARG 302   9.971 -11.221  13.123
  735   HH22  ARG 302          2HH2      ARG 302  10.362 -10.248  14.501
  736    H    GLU 303           H        GLU 303   5.239  -5.748  11.869
  737    HA   GLU 303           HA       GLU 303   4.266  -4.664   9.305
  738    HB2  GLU 303           2HB      GLU 303   3.494  -3.830  12.108
  739    HB3  GLU 303           1HB      GLU 303   2.983  -3.008  10.641
  740    HG2  GLU 303           2HG      GLU 303   1.472  -4.608  10.102
  741    HG3  GLU 303           1HG      GLU 303   2.425  -5.907  10.815
  742    H    THR 304           H        THR 304   5.461  -3.068   8.449
  743    HA   THR 304           HA       THR 304   7.300  -1.611  10.220
  744    HB   THR 304           HB       THR 304   7.886  -3.219   7.836
  745    HG1  THR 304           1HG      THR 304   9.067  -3.851   9.463
  746   HG21  THR 304          3HG2      THR 304   9.202  -0.533   8.139
  747   HG22  THR 304          1HG2      THR 304   8.253  -1.103   6.764
  748   HG23  THR 304          2HG2      THR 304   9.804  -1.855   7.138
  749    H    GLN 305           H        GLN 305   7.741   0.538   9.722
  750    HA   GLN 305           HA       GLN 305   5.667   1.870   8.203
  751    HB2  GLN 305           2HB      GLN 305   7.826   2.764  10.074
  752    HB3  GLN 305           1HB      GLN 305   7.077   3.937   8.997
  753    HG2  GLN 305           2HG      GLN 305   4.982   3.693   9.991
  754    HG3  GLN 305           1HG      GLN 305   5.423   2.168  10.759
  755   HE21  GLN 305          1HE2      GLN 305   6.836   2.218  12.574
  756   HE22  GLN 305          2HE2      GLN 305   6.979   3.644  13.540
  757    H    VAL 306           H        VAL 306   6.034   3.329   6.489
  758    HA   VAL 306           HA       VAL 306   8.643   3.114   5.151
  759    HB   VAL 306           HB       VAL 306   7.425   2.947   2.956
  760   HG11  VAL 306          1HG1      VAL 306   7.104   0.546   3.100
  761   HG12  VAL 306          2HG1      VAL 306   7.026   0.641   4.861
  762   HG13  VAL 306          3HG1      VAL 306   8.529   1.027   4.022
  763   HG21  VAL 306          3HG2      VAL 306   5.224   3.688   3.702
  764   HG22  VAL 306          1HG2      VAL 306   5.084   2.266   4.737
  765   HG23  VAL 306          2HG2      VAL 306   5.130   2.080   2.984
  Start of MODEL   10
    1    HA   MET   1           HA       MET   1  -8.719   0.394  -6.999
    2    H1   MET   1           1HT      MET   1 -10.518   1.863  -6.854
    3    H2   MET   1           2HT      MET   1  -9.608   3.148  -7.539
    4    H3   MET   1           3HT      MET   1  -9.203   2.537  -5.987
    5    HB2  MET   1           2HB      MET   1  -9.596   1.956  -9.375
    6    HB3  MET   1           1HB      MET   1  -8.245   0.855  -9.606
    7    HG2  MET   1           2HG      MET   1 -10.034  -0.469 -10.153
    8    HG3  MET   1           1HG      MET   1  -9.787  -0.882  -8.458
    9    HE1  MET   1           3HE      MET   1 -12.185   0.366 -11.126
   10    HE2  MET   1           1HE      MET   1 -11.652   1.947 -10.555
   11    HE3  MET   1           2HE      MET   1 -13.312   1.421 -10.273
   12    H    GLU   2           H        GLU   2  -7.650   3.265  -8.844
   13    HA   GLU   2           HA       GLU   2  -4.912   2.762  -7.887
   14    HB2  GLU   2           2HB      GLU   2  -4.226   4.186  -9.840
   15    HB3  GLU   2           1HB      GLU   2  -5.007   2.672 -10.272
   16    HG2  GLU   2           2HG      GLU   2  -6.915   4.835 -10.026
   17    HG3  GLU   2           1HG      GLU   2  -5.651   5.193 -11.199
   18    H    ILE   3           H        ILE   3  -3.606   4.528  -7.176
   19    HA   ILE   3           HA       ILE   3  -4.921   7.084  -6.721
   20    HB   ILE   3           HB       ILE   3  -3.759   5.399  -4.493
   21   HG12  ILE   3          2HG1      ILE   3  -6.215   6.231  -3.657
   22   HG13  ILE   3          1HG1      ILE   3  -6.496   6.052  -5.385
   23   HG21  ILE   3          1HG2      ILE   3  -3.038   7.647  -4.160
   24   HG22  ILE   3          2HG2      ILE   3  -4.364   7.329  -3.041
   25   HG23  ILE   3          3HG2      ILE   3  -4.650   8.272  -4.503
   26   HD11  ILE   3          3HD1      ILE   3  -7.087   4.011  -4.336
   27   HD12  ILE   3          1HD1      ILE   3  -5.562   3.951  -3.453
   28   HD13  ILE   3          2HD1      ILE   3  -5.577   3.735  -5.204
   29    H    LYS   4           H        LYS   4  -3.452   8.131  -8.044
   30    HA   LYS   4           HA       LYS   4  -0.592   7.834  -7.479
   31    HB2  LYS   4           2HB      LYS   4  -1.286   7.666  -9.823
   32    HB3  LYS   4           1HB      LYS   4  -2.053   9.243  -9.728
   33    HG2  LYS   4           2HG      LYS   4   0.212  10.205  -9.228
   34    HG3  LYS   4           1HG      LYS   4   0.885   8.618  -9.608
   35    HD2  LYS   4           2HD      LYS   4   1.064   9.846 -11.603
   36    HD3  LYS   4           1HD      LYS   4  -0.347   8.813 -11.833
   37    HE2  LYS   4           2HE      LYS   4  -1.836  10.578 -11.608
   38    HE3  LYS   4           1HE      LYS   4  -0.669  11.583 -10.751
   39    HZ1  LYS   4           3HZ      LYS   4  -0.966  12.419 -12.962
   40    HZ2  LYS   4           1HZ      LYS   4  -0.633  10.905 -13.643
   41    HZ3  LYS   4           2HZ      LYS   4   0.589  11.764 -12.847
   42    H    LEU   5           H        LEU   5   0.732   9.671  -6.898
   43    HA   LEU   5           HA       LEU   5  -0.575  12.214  -6.466
   44    HG   LEU   5           HG       LEU   5  -0.342  13.468  -4.287
   45    HB2  LEU   5           2HB      LEU   5  -0.629  10.478  -4.388
   46    HB3  LEU   5           1HB      LEU   5   0.932  11.229  -4.116
   47   HD11  LEU   5          1HD1      LEU   5  -2.426  12.745  -5.161
   48   HD12  LEU   5          2HD1      LEU   5  -2.712  13.242  -3.494
   49   HD13  LEU   5          3HD1      LEU   5  -2.609  11.528  -3.898
   50   HD21  LEU   5          3HD2      LEU   5  -0.827  13.430  -1.929
   51   HD22  LEU   5          1HD2      LEU   5   0.638  12.495  -2.229
   52   HD23  LEU   5          2HD2      LEU   5  -0.891  11.668  -1.931
   53    H    ILE   6           H        ILE   6   1.143  13.816  -5.545
   54    HA   ILE   6           HA       ILE   6   3.600  13.378  -7.072
   55    HB   ILE   6           HB       ILE   6   2.334  15.487  -7.425
   56   HG12  ILE   6          2HG1      ILE   6   5.032  16.037  -6.183
   57   HG13  ILE   6          1HG1      ILE   6   4.840  15.248  -7.744
   58   HG21  ILE   6          1HG2      ILE   6   2.115  17.153  -5.792
   59   HG22  ILE   6          2HG2      ILE   6   3.273  16.374  -4.715
   60   HG23  ILE   6          3HG2      ILE   6   1.680  15.658  -4.962
   61   HD11  ILE   6          3HD1      ILE   6   5.192  17.442  -8.333
   62   HD12  ILE   6          1HD1      ILE   6   4.270  18.069  -6.966
   63   HD13  ILE   6          2HD1      ILE   6   3.431  17.342  -8.337
   64    H    LYS   7           H        LYS   7   5.548  13.057  -6.161
   65    HA   LYS   7           HA       LYS   7   5.927  12.201  -3.593
   66    HB2  LYS   7           2HB      LYS   7   7.615  11.771  -5.203
   67    HB3  LYS   7           1HB      LYS   7   7.851  13.481  -5.523
   68    HG2  LYS   7           2HG      LYS   7   9.624  13.282  -4.183
   69    HG3  LYS   7           1HG      LYS   7   8.450  13.338  -2.868
   70    HD2  LYS   7           2HD      LYS   7   8.357  10.715  -3.467
   71    HD3  LYS   7           1HD      LYS   7  10.027  11.071  -3.913
   72    HE2  LYS   7           2HE      LYS   7   8.832  11.856  -1.263
   73    HE3  LYS   7           1HE      LYS   7   9.639  10.312  -1.531
   74    HZ1  LYS   7           3HZ      LYS   7  11.619  11.607  -2.254
   75    HZ2  LYS   7           1HZ      LYS   7  11.214  11.822  -0.625
   76    HZ3  LYS   7           2HZ      LYS   7  10.833  13.020  -1.756
   77    H    GLY   8           H        GLY   8   6.123  13.073  -1.627
   78    HA2  GLY   8           2HA      GLY   8   6.041  15.995  -1.389
   79    HA3  GLY   8           1HA      GLY   8   5.653  14.841  -0.122
   80    HA   PRO   9           HA       PRO   9   9.862  16.406   0.870
   81    HB2  PRO   9           2HB      PRO   9   9.034  16.196   3.657
   82    HB3  PRO   9           1HB      PRO   9   9.522  17.625   2.748
   83    HG2  PRO   9           2HG      PRO   9   6.973  17.203   3.589
   84    HG3  PRO   9           1HG      PRO   9   7.373  18.127   2.129
   85    HD2  PRO   9           2HD      PRO   9   6.451  15.287   2.386
   86    HD3  PRO   9           1HD      PRO   9   5.965  16.526   1.208
   87    H    LYS  10           H        LYS  10   8.698  14.440   3.603
   88    HA   LYS  10           HA       LYS  10  10.993  12.863   3.725
   89    HB2  LYS  10           2HB      LYS  10   8.215  12.274   4.768
   90    HB3  LYS  10           1HB      LYS  10   9.660  11.380   5.217
   91    HG2  LYS  10           2HG      LYS  10  10.318  12.940   6.675
   92    HG3  LYS  10           1HG      LYS  10   9.890  14.270   5.597
   93    HD2  LYS  10           2HD      LYS  10   7.698  14.343   6.345
   94    HD3  LYS  10           1HD      LYS  10   7.739  12.681   6.937
   95    HE2  LYS  10           2HE      LYS  10   9.500  13.568   8.609
   96    HE3  LYS  10           1HE      LYS  10   8.877  15.160   8.180
   97    HZ1  LYS  10           3HZ      LYS  10   7.303  14.820   9.686
   98    HZ2  LYS  10           1HZ      LYS  10   7.757  13.206   9.911
   99    HZ3  LYS  10           2HZ      LYS  10   6.655  13.614   8.694
  100    H    GLY  11           H        GLY  11   7.770  11.511   2.959
  101    HA2  GLY  11           2HA      GLY  11   8.484  10.364   0.493
  102    HA3  GLY  11           1HA      GLY  11   8.783   9.184   1.759
  103    H    LEU  12           H        LEU  12   7.123   7.941   2.428
  104    HA   LEU  12           HA       LEU  12   4.520   8.388   1.221
  105    HG   LEU  12           HG       LEU  12   6.341   6.312   0.394
  106    HB2  LEU  12           2HB      LEU  12   5.673   6.123   2.835
  107    HB3  LEU  12           1HB      LEU  12   4.009   6.160   2.294
  108   HD11  LEU  12          1HD1      LEU  12   6.698   4.224   1.294
  109   HD12  LEU  12          2HD1      LEU  12   5.585   3.857  -0.024
  110   HD13  LEU  12          3HD1      LEU  12   4.987   3.958   1.631
  111   HD21  LEU  12          3HD2      LEU  12   3.553   5.367  -0.181
  112   HD22  LEU  12          1HD2      LEU  12   4.790   5.927  -1.306
  113   HD23  LEU  12          2HD2      LEU  12   3.974   7.078  -0.248
  114    H    GLY  13           H        GLY  13   5.792   7.819   4.517
  115    HA2  GLY  13           2HA      GLY  13   5.142   8.885   6.479
  116    HA3  GLY  13           1HA      GLY  13   3.856   9.686   5.597
  117    H    PHE  14           H        PHE  14   4.416   6.183   5.716
  118    HA   PHE  14           HA       PHE  14   2.413   5.744   7.716
  119    HD1  PHE  14           2HD      PHE  14   2.257   2.907   4.840
  120    HD2  PHE  14           1HD      PHE  14   1.211   6.867   3.674
  121    HE1  PHE  14           2HE      PHE  14   2.652   2.314   2.489
  122    HE2  PHE  14           1HE      PHE  14   1.600   6.275   1.318
  123    HZ   PHE  14           HZ       PHE  14   2.322   3.996   0.723
  124    HB2  PHE  14           2HB      PHE  14   0.823   4.513   6.277
  125    HB3  PHE  14           1HB      PHE  14   0.911   6.220   5.874
  126    H    SER  15           H        SER  15   1.762   3.142   7.412
  127    HA   SER  15           HA       SER  15   4.300   1.733   7.035
  128    HG   SER  15           HG       SER  15   1.759   0.300   9.503
  129    HB2  SER  15           2HB      SER  15   3.781   0.386   8.991
  130    HB3  SER  15           1HB      SER  15   3.829   2.079   9.448
  131    H    ILE  16           H        ILE  16   3.804  -0.757   7.057
  132    HA   ILE  16           HA       ILE  16   1.221  -1.501   5.966
  133    HB   ILE  16           HB       ILE  16   1.842  -2.161   3.833
  134   HG12  ILE  16          2HG1      ILE  16   4.019  -3.235   4.610
  135   HG13  ILE  16          1HG1      ILE  16   3.984  -2.585   2.977
  136   HG21  ILE  16          1HG2      ILE  16   1.643   0.226   3.876
  137   HG22  ILE  16          2HG2      ILE  16   2.895  -0.234   2.723
  138   HG23  ILE  16          3HG2      ILE  16   3.345   0.394   4.308
  139   HD11  ILE  16          3HD1      ILE  16   5.604  -1.144   3.406
  140   HD12  ILE  16          1HD1      ILE  16   5.902  -2.108   4.854
  141   HD13  ILE  16          2HD1      ILE  16   4.891  -0.662   4.945
  142    H    ALA  17           H        ALA  17   1.246  -3.841   5.325
  143    HA   ALA  17           HA       ALA  17   3.227  -5.497   6.712
  144    HB1  ALA  17           3HB      ALA  17   1.684  -5.806   8.350
  145    HB2  ALA  17           1HB      ALA  17   0.972  -6.924   7.186
  146    HB3  ALA  17           2HB      ALA  17   0.344  -5.279   7.332
  147    H    GLY  18           H        GLY  18   2.981  -7.904   5.764
  148    HA2  GLY  18           2HA      GLY  18   1.407  -8.450   3.594
  149    HA3  GLY  18           1HA      GLY  18   2.700  -7.503   2.911
  150    H    GLY  19           H        GLY  19   1.680 -10.502   2.845
  151    HA2  GLY  19           2HA      GLY  19   3.066 -12.156   1.835
  152    HA3  GLY  19           1HA      GLY  19   4.428 -11.537   2.752
  153    H    VAL  20           H        VAL  20   3.756 -14.247   2.570
  154    HA   VAL  20           HA       VAL  20   2.242 -15.186   4.756
  155    HB   VAL  20           HB       VAL  20   2.902 -16.576   2.785
  156   HG11  VAL  20          1HG1      VAL  20   5.547 -16.971   4.156
  157   HG12  VAL  20          2HG1      VAL  20   5.319 -15.801   2.857
  158   HG13  VAL  20          3HG1      VAL  20   5.047 -17.516   2.556
  159   HG21  VAL  20          3HG2      VAL  20   3.075 -18.636   3.999
  160   HG22  VAL  20          1HG2      VAL  20   2.039 -17.539   4.912
  161   HG23  VAL  20          2HG2      VAL  20   3.709 -17.803   5.418
  162    H    GLY  21           H        GLY  21   2.785 -15.698   6.862
  163    HA2  GLY  21           2HA      GLY  21   4.155 -15.988   8.739
  164    HA3  GLY  21           1HA      GLY  21   5.552 -15.579   7.757
  165    H    ASN  22           H        ASN  22   3.885 -13.144   6.869
  166    HA   ASN  22           HA       ASN  22   4.034 -11.483   9.261
  167    HB2  ASN  22           2HB      ASN  22   5.069  -9.722   7.517
  168    HB3  ASN  22           1HB      ASN  22   6.085 -10.766   8.492
  169   HD21  ASN  22          1HD2      ASN  22   4.275 -11.021   5.441
  170   HD22  ASN  22          2HD2      ASN  22   5.574 -11.728   4.549
  171    H    GLN  23           H        GLN  23   1.903 -12.636   7.360
  172    HA   GLN  23           HA       GLN  23   0.783 -10.677   5.760
  173    HB2  GLN  23           2HB      GLN  23  -0.546 -12.915   7.289
  174    HB3  GLN  23           1HB      GLN  23  -1.353 -11.946   6.067
  175    HG2  GLN  23           2HG      GLN  23   0.237 -12.741   4.391
  176    HG3  GLN  23           1HG      GLN  23   1.038 -13.715   5.623
  177   HE21  GLN  23          1HE2      GLN  23   0.424 -15.753   5.764
  178   HE22  GLN  23          2HE2      GLN  23  -1.079 -16.400   5.212
  179    H    HIS  24           H        HIS  24  -0.862  -9.218   5.985
  180    HA   HIS  24           HA       HIS  24  -1.197  -8.068   8.642
  181    HD1  HIS  24           1HD      HIS  24  -0.807  -5.218   8.915
  182    HD2  HIS  24           2HD      HIS  24  -4.363  -5.649   6.821
  183    HE1  HIS  24           1HE      HIS  24  -2.316  -3.435   9.796
  184    HE2  HIS  24           2HE      HIS  24  -4.504  -3.758   8.589
  185    HB2  HIS  24           2HB      HIS  24  -0.690  -6.624   6.663
  186    HB3  HIS  24           1HB      HIS  24  -2.237  -7.081   5.977
  187    H    ILE  25           H        ILE  25  -3.030  -9.766   6.200
  188    HA   ILE  25           HA       ILE  25  -5.340  -9.851   8.022
  189    HB   ILE  25           HB       ILE  25  -5.558  -9.602   5.019
  190   HG12  ILE  25          2HG1      ILE  25  -4.711  -7.520   6.113
  191   HG13  ILE  25          1HG1      ILE  25  -6.276  -7.325   5.335
  192   HG21  ILE  25          1HG2      ILE  25  -7.452 -10.743   5.769
  193   HG22  ILE  25          2HG2      ILE  25  -7.967  -9.058   5.672
  194   HG23  ILE  25          3HG2      ILE  25  -7.567  -9.769   7.236
  195   HD11  ILE  25          3HD1      ILE  25  -6.980  -6.422   7.230
  196   HD12  ILE  25          1HD1      ILE  25  -5.520  -6.918   8.084
  197   HD13  ILE  25          2HD1      ILE  25  -6.882  -8.028   7.951
  198    HA   PRO  26           HA       PRO  26  -4.762 -14.266   7.675
  199    HB2  PRO  26           2HB      PRO  26  -7.696 -14.264   8.203
  200    HB3  PRO  26           1HB      PRO  26  -6.407 -15.163   9.011
  201    HG2  PRO  26           2HG      PRO  26  -7.515 -13.045  10.177
  202    HG3  PRO  26           1HG      PRO  26  -5.773 -13.347  10.308
  203    HD2  PRO  26           2HD      PRO  26  -7.233 -11.356   8.629
  204    HD3  PRO  26           1HD      PRO  26  -5.665 -11.212   9.448
  205    H    GLY  27           H        GLY  27  -4.600 -15.291   5.782
  206    HA2  GLY  27           2HA      GLY  27  -5.495 -16.462   3.938
  207    HA3  GLY  27           1HA      GLY  27  -6.943 -15.475   4.039
  208    H    ASP  28           H        ASP  28  -5.880 -12.921   3.982
  209    HA   ASP  28           HA       ASP  28  -5.042 -12.757   1.198
  210    HB2  ASP  28           2HB      ASP  28  -6.862 -11.314   2.568
  211    HB3  ASP  28           1HB      ASP  28  -5.451 -10.284   2.788
  212    H    ASN  29           H        ASN  29  -2.919 -12.947   0.871
  213    HA   ASN  29           HA       ASN  29  -1.011 -11.933   2.813
  214    HB2  ASN  29           2HB      ASN  29  -0.397 -13.240   0.164
  215    HB3  ASN  29           1HB      ASN  29   0.680 -13.055   1.545
  216   HD21  ASN  29          1HD2      ASN  29   1.042 -14.917   2.489
  217   HD22  ASN  29          2HD2      ASN  29  -0.113 -16.176   2.745
  218    H    SER  30           H        SER  30  -2.713 -10.143   0.916
  219    HA   SER  30           HA       SER  30  -0.673  -8.823  -0.662
  220    HG   SER  30           HG       SER  30  -2.488  -9.413  -2.281
  221    HB2  SER  30           2HB      SER  30  -3.507  -7.911  -0.098
  222    HB3  SER  30           1HB      SER  30  -2.436  -7.303  -1.358
  223    H    ILE  31           H        ILE  31  -0.044  -6.580  -0.322
  224    HA   ILE  31           HA       ILE  31   0.518  -6.091   2.413
  225    HB   ILE  31           HB       ILE  31   0.973  -4.092   0.216
  226   HG12  ILE  31          2HG1      ILE  31   2.031  -5.807  -0.844
  227   HG13  ILE  31          1HG1      ILE  31   3.327  -5.312   0.228
  228   HG21  ILE  31          1HG2      ILE  31   2.798  -4.650   2.501
  229   HG22  ILE  31          2HG2      ILE  31   1.378  -3.627   2.712
  230   HG23  ILE  31          3HG2      ILE  31   2.618  -3.184   1.539
  231   HD11  ILE  31          3HD1      ILE  31   1.683  -7.278   1.520
  232   HD12  ILE  31          1HD1      ILE  31   3.401  -7.333   1.131
  233   HD13  ILE  31          2HD1      ILE  31   2.210  -7.857  -0.059
  234    H    TYR  32           H        TYR  32  -0.536  -4.950   3.887
  235    HA   TYR  32           HA       TYR  32  -2.622  -3.047   3.046
  236    HD1  TYR  32           2HD      TYR  32  -2.551  -6.591   3.385
  237    HD2  TYR  32           1HD      TYR  32  -5.764  -4.001   4.343
  238    HE1  TYR  32           2HE      TYR  32  -4.081  -8.069   2.153
  239    HE2  TYR  32           1HE      TYR  32  -7.322  -5.452   3.140
  240    HH   TYR  32           HH       TYR  32  -7.081  -8.288   2.515
  241    HB2  TYR  32           2HB      TYR  32  -2.557  -4.927   5.402
  242    HB3  TYR  32           1HB      TYR  32  -3.696  -3.596   5.274
  243    H    VAL  33           H        VAL  33  -2.813  -1.132   4.244
  244    HA   VAL  33           HA       VAL  33  -0.403  -0.234   5.538
  245    HB   VAL  33           HB       VAL  33  -3.028   1.176   5.019
  246   HG11  VAL  33          1HG1      VAL  33  -1.978   2.092   7.029
  247   HG12  VAL  33          2HG1      VAL  33  -1.906   3.240   5.694
  248   HG13  VAL  33          3HG1      VAL  33  -0.470   2.321   6.143
  249   HG21  VAL  33          3HG2      VAL  33  -1.213   2.523   3.586
  250   HG22  VAL  33          1HG2      VAL  33  -2.097   1.136   2.953
  251   HG23  VAL  33          2HG2      VAL  33  -0.460   0.929   3.573
  252    H    THR  34           H        THR  34   0.001  -0.457   7.635
  253    HA   THR  34           HA       THR  34  -2.174  -1.202   9.432
  254    HB   THR  34           HB       THR  34  -0.601  -2.207  10.802
  255    HG1  THR  34           1HG      THR  34   0.849  -0.709  11.309
  256   HG21  THR  34          3HG2      THR  34   1.237  -2.449   8.527
  257   HG22  THR  34          1HG2      THR  34  -0.437  -2.900   8.209
  258   HG23  THR  34          2HG2      THR  34   0.459  -3.692   9.505
  259    H    LYS  35           H        LYS  35  -0.092   1.534   8.855
  260    HA   LYS  35           HA       LYS  35  -1.511   3.090  10.814
  261    HB2  LYS  35           2HB      LYS  35   0.343   1.759  12.045
  262    HB3  LYS  35           1HB      LYS  35   1.453   2.878  11.268
  263    HG2  LYS  35           2HG      LYS  35  -0.863   3.857  12.892
  264    HG3  LYS  35           1HG      LYS  35   0.667   3.396  13.638
  265    HD2  LYS  35           2HD      LYS  35   1.844   5.031  12.262
  266    HD3  LYS  35           1HD      LYS  35   0.327   5.477  11.479
  267    HE2  LYS  35           2HE      LYS  35  -0.486   6.543  13.358
  268    HE3  LYS  35           1HE      LYS  35   0.551   5.628  14.452
  269    HZ1  LYS  35           3HZ      LYS  35   1.257   7.939  14.235
  270    HZ2  LYS  35           1HZ      LYS  35   1.483   7.730  12.571
  271    HZ3  LYS  35           2HZ      LYS  35   2.448   6.880  13.669
  272    H    ILE  36           H        ILE  36  -1.754   5.052   9.938
  273    HA   ILE  36           HA       ILE  36   0.222   5.954   7.966
  274    HB   ILE  36           HB       ILE  36  -2.573   6.993   8.454
  275   HG12  ILE  36          2HG1      ILE  36  -1.424   5.126   6.374
  276   HG13  ILE  36          1HG1      ILE  36  -2.717   4.792   7.521
  277   HG21  ILE  36          1HG2      ILE  36  -0.685   7.612   6.184
  278   HG22  ILE  36          2HG2      ILE  36  -0.955   8.666   7.572
  279   HG23  ILE  36          3HG2      ILE  36  -2.280   8.310   6.465
  280   HD11  ILE  36          3HD1      ILE  36  -4.020   6.619   6.324
  281   HD12  ILE  36          1HD1      ILE  36  -3.781   5.095   5.469
  282   HD13  ILE  36          2HD1      ILE  36  -2.794   6.498   5.062
  283    H    ILE  37           H        ILE  37   1.582   7.565   8.433
  284    HA   ILE  37           HA       ILE  37   1.499   8.878  10.986
  285    HB   ILE  37           HB       ILE  37   3.372   9.047   8.631
  286   HG12  ILE  37          2HG1      ILE  37   4.905   8.369  10.713
  287   HG13  ILE  37          1HG1      ILE  37   3.367   7.752  11.307
  288   HG21  ILE  37          1HG2      ILE  37   3.459  11.253   9.404
  289   HG22  ILE  37          2HG2      ILE  37   4.817  10.452  10.192
  290   HG23  ILE  37          3HG2      ILE  37   3.332  10.761  11.092
  291   HD11  ILE  37          3HD1      ILE  37   3.214   6.171   9.635
  292   HD12  ILE  37          1HD1      ILE  37   4.942   6.201   9.979
  293   HD13  ILE  37          2HD1      ILE  37   4.313   7.045   8.566
  294    H    GLU  38           H        GLU  38   1.189  11.079  11.402
  295    HA   GLU  38           HA       GLU  38  -0.751  12.419   9.891
  296    HB2  GLU  38           2HB      GLU  38   1.092  13.244  12.105
  297    HB3  GLU  38           1HB      GLU  38   0.123  14.460  11.284
  298    HG2  GLU  38           2HG      GLU  38  -1.906  13.372  11.922
  299    HG3  GLU  38           1HG      GLU  38  -1.020  11.990  12.566
  300    H    GLY  39           H        GLY  39  -0.660  14.270   8.582
  301    HA2  GLY  39           2HA      GLY  39   0.146  15.556   6.867
  302    HA3  GLY  39           1HA      GLY  39   1.616  15.675   7.816
  303    H    GLY  40           H        GLY  40   0.620  12.504   6.812
  304    HA2  GLY  40           2HA      GLY  40   2.979  12.329   5.114
  305    HA3  GLY  40           1HA      GLY  40   1.987  10.988   5.661
  306    H    ALA  41           H        ALA  41   2.774  10.922   3.119
  307    HA   ALA  41           HA       ALA  41   1.374  12.203   1.131
  308    HB1  ALA  41           3HB      ALA  41   3.249  10.626   0.780
  309    HB2  ALA  41           1HB      ALA  41   1.884  10.330  -0.296
  310    HB3  ALA  41           2HB      ALA  41   2.146   9.288   1.103
  311    H    ALA  42           H        ALA  42   0.405   9.159   2.754
  312    HA   ALA  42           HA       ALA  42  -2.086   8.988   1.373
  313    HB1  ALA  42           3HB      ALA  42  -0.971   7.579   3.783
  314    HB2  ALA  42           1HB      ALA  42  -1.203   6.951   2.152
  315    HB3  ALA  42           2HB      ALA  42  -2.600   7.272   3.180
  316    H    HIS  43           H        HIS  43  -1.248   9.821   4.739
  317    HA   HIS  43           HA       HIS  43  -3.735  10.409   5.742
  318    HD1  HIS  43           1HD      HIS  43  -2.382  14.033   7.126
  319    HD2  HIS  43           2HD      HIS  43  -3.567  10.565   9.083
  320    HE1  HIS  43           1HE      HIS  43  -3.666  14.807   9.142
  321    HE2  HIS  43           2HE      HIS  43  -4.439  12.693  10.274
  322    HB2  HIS  43           2HB      HIS  43  -1.651  10.370   7.065
  323    HB3  HIS  43           1HB      HIS  43  -1.165  11.891   6.330
  324    H    LYS  44           H        LYS  44  -1.586  12.602   3.942
  325    HA   LYS  44           HA       LYS  44  -3.349  14.844   4.114
  326    HB2  LYS  44           2HB      LYS  44  -0.921  14.256   2.427
  327    HB3  LYS  44           1HB      LYS  44  -1.835  15.748   2.265
  328    HG2  LYS  44           2HG      LYS  44  -1.360  16.350   4.544
  329    HG3  LYS  44           1HG      LYS  44  -0.565  14.800   4.823
  330    HD2  LYS  44           2HD      LYS  44   1.311  15.395   3.661
  331    HD3  LYS  44           1HD      LYS  44   0.432  16.483   2.586
  332    HE2  LYS  44           2HE      LYS  44   0.621  17.189   5.471
  333    HE3  LYS  44           1HE      LYS  44   2.053  17.397   4.463
  334    HZ1  LYS  44           3HZ      LYS  44   0.791  18.816   2.991
  335    HZ2  LYS  44           1HZ      LYS  44   0.697  19.408   4.573
  336    HZ3  LYS  44           2HZ      LYS  44  -0.615  18.579   3.903
  337    H    ASP  45           H        ASP  45  -2.790  12.304   1.725
  338    HA   ASP  45           HA       ASP  45  -4.313  13.436  -0.366
  339    HB2  ASP  45           2HB      ASP  45  -2.679  11.579  -0.652
  340    HB3  ASP  45           1HB      ASP  45  -3.795  10.503   0.178
  341    H    GLY  46           H        GLY  46  -5.184  10.871   1.983
  342    HA2  GLY  46           2HA      GLY  46  -7.283  10.820   3.110
  343    HA3  GLY  46           1HA      GLY  46  -7.971  11.784   1.816
  344    H    LYS  47           H        LYS  47  -6.666  10.004  -0.233
  345    HA   LYS  47           HA       LYS  47  -8.839   8.249  -0.628
  346    HB2  LYS  47           2HB      LYS  47  -6.116   8.324  -1.932
  347    HB3  LYS  47           1HB      LYS  47  -7.442   7.308  -2.475
  348    HG2  LYS  47           2HG      LYS  47  -8.283  10.055  -2.226
  349    HG3  LYS  47           1HG      LYS  47  -6.874   9.909  -3.278
  350    HD2  LYS  47           2HD      LYS  47  -9.086   7.961  -3.652
  351    HD3  LYS  47           1HD      LYS  47  -9.357   9.621  -4.185
  352    HE2  LYS  47           2HE      LYS  47  -7.744   9.507  -5.812
  353    HE3  LYS  47           1HE      LYS  47  -6.817   8.274  -4.960
  354    HZ1  LYS  47           3HZ      LYS  47  -9.367   7.870  -6.429
  355    HZ2  LYS  47           1HZ      LYS  47  -8.591   6.676  -5.514
  356    HZ3  LYS  47           2HZ      LYS  47  -7.837   7.314  -6.887
  357    H    LEU  48           H        LEU  48  -5.539   7.694   0.606
  358    HA   LEU  48           HA       LEU  48  -6.095   4.860   0.929
  359    HG   LEU  48           HG       LEU  48  -4.250   3.495   0.775
  360    HB2  LEU  48           2HB      LEU  48  -3.847   6.004   0.203
  361    HB3  LEU  48           1HB      LEU  48  -3.610   6.189   1.930
  362   HD11  LEU  48          1HD1      LEU  48  -2.346   4.396  -0.500
  363   HD12  LEU  48          2HD1      LEU  48  -1.893   3.033   0.522
  364   HD13  LEU  48          3HD1      LEU  48  -1.487   4.678   1.016
  365   HD21  LEU  48          3HD2      LEU  48  -4.137   4.233   3.307
  366   HD22  LEU  48          1HD2      LEU  48  -2.409   3.985   3.052
  367   HD23  LEU  48          2HD2      LEU  48  -3.544   2.664   2.769
  368    H    GLN  49           H        GLN  49  -6.827   3.973   2.725
  369    HA   GLN  49           HA       GLN  49  -6.457   5.347   5.290
  370    HB2  GLN  49           2HB      GLN  49  -8.735   4.698   5.945
  371    HB3  GLN  49           1HB      GLN  49  -8.744   5.776   4.559
  372    HG2  GLN  49           2HG      GLN  49  -8.856   2.816   4.163
  373    HG3  GLN  49           1HG      GLN  49 -10.308   3.712   4.603
  374   HE21  GLN  49          1HE2      GLN  49  -8.442   2.620   2.075
  375   HE22  GLN  49          2HE2      GLN  49  -9.072   3.626   0.820
  376    H    ILE  50           H        ILE  50  -6.060   4.003   7.044
  377    HA   ILE  50           HA       ILE  50  -4.744   1.626   6.690
  378    HB   ILE  50           HB       ILE  50  -5.308   1.094   9.095
  379   HG12  ILE  50          2HG1      ILE  50  -6.283   3.643   9.869
  380   HG13  ILE  50          1HG1      ILE  50  -7.341   3.062   8.589
  381   HG21  ILE  50          1HG2      ILE  50  -3.953   2.894   9.981
  382   HG22  ILE  50          2HG2      ILE  50  -4.270   3.870   8.546
  383   HG23  ILE  50          3HG2      ILE  50  -3.333   2.383   8.411
  384   HD11  ILE  50          3HD1      ILE  50  -6.642   1.222  10.816
  385   HD12  ILE  50          1HD1      ILE  50  -8.102   1.302   9.831
  386   HD13  ILE  50          2HD1      ILE  50  -7.823   2.502  11.092
  387    H    GLY  51           H        GLY  51  -5.306  -0.363   6.060
  388    HA2  GLY  51           2HA      GLY  51  -6.782  -2.289   6.588
  389    HA3  GLY  51           1HA      GLY  51  -8.127  -1.187   6.382
  390    H    ASP  52           H        ASP  52  -6.505   0.028   4.008
  391    HA   ASP  52           HA       ASP  52  -7.761  -1.560   2.027
  392    HB2  ASP  52           2HB      ASP  52  -6.453  -0.020   0.438
  393    HB3  ASP  52           1HB      ASP  52  -7.653   0.714   1.491
  394    H    LYS  53           H        LYS  53  -6.621  -2.515   0.156
  395    HA   LYS  53           HA       LYS  53  -4.136  -3.811   1.041
  396    HB2  LYS  53           2HB      LYS  53  -4.735  -5.544  -0.733
  397    HB3  LYS  53           1HB      LYS  53  -5.700  -5.519   0.730
  398    HG2  LYS  53           2HG      LYS  53  -6.969  -3.808  -1.119
  399    HG3  LYS  53           1HG      LYS  53  -6.539  -5.289  -1.978
  400    HD2  LYS  53           2HD      LYS  53  -7.643  -5.768   0.684
  401    HD3  LYS  53           1HD      LYS  53  -8.761  -4.936  -0.400
  402    HE2  LYS  53           2HE      LYS  53  -8.988  -6.727  -1.763
  403    HE3  LYS  53           1HE      LYS  53  -7.306  -7.219  -1.569
  404    HZ1  LYS  53           3HZ      LYS  53  -9.333  -7.571   0.565
  405    HZ2  LYS  53           1HZ      LYS  53  -7.797  -8.274   0.462
  406    HZ3  LYS  53           2HZ      LYS  53  -9.019  -8.755  -0.603
  407    H    LEU  54           H        LEU  54  -2.477  -4.110  -0.368
  408    HA   LEU  54           HA       LEU  54  -2.339  -2.115  -2.511
  409    HG   LEU  54           HG       LEU  54  -1.125  -0.633  -1.314
  410    HB2  LEU  54           2HB      LEU  54  -0.497  -3.080  -0.519
  411    HB3  LEU  54           1HB      LEU  54   0.218  -3.172  -2.116
  412   HD11  LEU  54          1HD1      LEU  54   1.650  -1.393  -0.413
  413   HD12  LEU  54          2HD1      LEU  54   0.240  -1.257   0.638
  414   HD13  LEU  54          3HD1      LEU  54   0.862   0.168  -0.194
  415   HD21  LEU  54          3HD2      LEU  54   1.300  -1.334  -2.960
  416   HD22  LEU  54          1HD2      LEU  54   0.725   0.305  -2.660
  417   HD23  LEU  54          2HD2      LEU  54  -0.281  -0.830  -3.559
  418    H    LEU  55           H        LEU  55  -3.016  -2.954  -4.357
  419    HA   LEU  55           HA       LEU  55  -2.587  -5.649  -5.169
  420    HG   LEU  55           HG       LEU  55  -3.038  -5.985  -7.624
  421    HB2  LEU  55           2HB      LEU  55  -4.520  -4.376  -5.948
  422    HB3  LEU  55           1HB      LEU  55  -3.466  -3.225  -6.745
  423   HD11  LEU  55          1HD1      LEU  55  -5.122  -5.956  -9.035
  424   HD12  LEU  55          2HD1      LEU  55  -5.728  -4.685  -7.974
  425   HD13  LEU  55          3HD1      LEU  55  -5.367  -6.282  -7.320
  426   HD21  LEU  55          3HD2      LEU  55  -2.764  -4.997  -9.702
  427   HD22  LEU  55          1HD2      LEU  55  -2.225  -3.732  -8.599
  428   HD23  LEU  55          2HD2      LEU  55  -3.833  -3.649  -9.317
  429    H    ALA  56           H        ALA  56  -1.242  -2.501  -6.235
  430    HA   ALA  56           HA       ALA  56   1.306  -3.802  -6.790
  431    HB1  ALA  56           3HB      ALA  56  -0.334  -2.581  -9.021
  432    HB2  ALA  56           1HB      ALA  56   0.187  -4.260  -8.880
  433    HB3  ALA  56           2HB      ALA  56   1.376  -2.986  -9.159
  434    H    VAL  57           H        VAL  57   3.061  -2.318  -7.069
  435    HA   VAL  57           HA       VAL  57   2.452   0.537  -6.845
  436    HB   VAL  57           HB       VAL  57   4.522   0.406  -5.081
  437   HG11  VAL  57          1HG1      VAL  57   2.730   1.842  -4.676
  438   HG12  VAL  57          2HG1      VAL  57   2.692   0.708  -3.325
  439   HG13  VAL  57          3HG1      VAL  57   1.557   0.526  -4.664
  440   HG21  VAL  57          3HG2      VAL  57   4.132  -1.290  -3.448
  441   HG22  VAL  57          1HG2      VAL  57   4.295  -2.084  -5.015
  442   HG23  VAL  57          2HG2      VAL  57   2.699  -1.862  -4.302
  443    H    ASN  58           H        ASN  58   3.708   1.668  -8.168
  444    HA   ASN  58           HA       ASN  58   5.423   2.303  -9.518
  445    HB2  ASN  58           2HB      ASN  58   6.883   0.566  -7.559
  446    HB3  ASN  58           1HB      ASN  58   7.723   1.137  -8.993
  447   HD21  ASN  58          1HD2      ASN  58   8.652   3.062  -8.900
  448   HD22  ASN  58          2HD2      ASN  58   8.342   4.272  -7.707
  449    H    ASN  59           H        ASN  59   3.664   0.116 -10.208
  450    HA   ASN  59           HA       ASN  59   3.369  -1.039 -12.184
  451    HB2  ASN  59           2HB      ASN  59   5.617   0.156 -12.878
  452    HB3  ASN  59           1HB      ASN  59   6.291  -1.453 -12.633
  453   HD21  ASN  59          1HD2      ASN  59   4.163   0.511 -14.554
  454   HD22  ASN  59          2HD2      ASN  59   3.950  -0.623 -15.840
  455    H    VAL  60           H        VAL  60   5.387  -2.069  -9.568
  456    HA   VAL  60           HA       VAL  60   5.284  -4.871 -10.364
  457    HB   VAL  60           HB       VAL  60   6.453  -5.327  -8.241
  458   HG11  VAL  60          1HG1      VAL  60   8.488  -3.704  -8.850
  459   HG12  VAL  60          2HG1      VAL  60   7.519  -3.508 -10.311
  460   HG13  VAL  60          3HG1      VAL  60   8.060  -5.113  -9.822
  461   HG21  VAL  60          3HG2      VAL  60   6.874  -2.419  -7.783
  462   HG22  VAL  60          1HG2      VAL  60   6.987  -3.767  -6.653
  463   HG23  VAL  60          2HG2      VAL  60   5.408  -3.183  -7.173
  464    H    CYS  61           H        CYS  61   4.194  -6.501  -9.168
  465    HA   CYS  61           HA       CYS  61   1.755  -5.544  -7.918
  466    HG   CYS  61           HG       CYS  61   3.826  -8.768  -8.067
  467    HB2  CYS  61           2HB      CYS  61   1.045  -7.881  -7.933
  468    HB3  CYS  61           1HB      CYS  61   1.597  -7.377  -9.524
  469    H    LEU  62           H        LEU  62   1.341  -5.516  -5.802
  470    HA   LEU  62           HA       LEU  62   3.417  -6.510  -3.992
  471    HG   LEU  62           HG       LEU  62   3.582  -5.287  -1.804
  472    HB2  LEU  62           2HB      LEU  62   2.200  -4.051  -4.180
  473    HB3  LEU  62           1HB      LEU  62   1.328  -4.806  -2.864
  474   HD11  LEU  62          1HD1      LEU  62   5.226  -5.074  -3.359
  475   HD12  LEU  62          2HD1      LEU  62   5.263  -3.445  -2.686
  476   HD13  LEU  62          3HD1      LEU  62   4.416  -3.754  -4.202
  477   HD21  LEU  62          3HD2      LEU  62   3.703  -3.154  -0.786
  478   HD22  LEU  62          1HD2      LEU  62   2.009  -3.412  -1.199
  479   HD23  LEU  62          2HD2      LEU  62   3.009  -2.361  -2.199
  480    H    GLU  63           H        GLU  63   1.179  -8.142  -5.213
  481    HA   GLU  63           HA       GLU  63  -0.282  -8.855  -2.765
  482    HB2  GLU  63           2HB      GLU  63  -0.887  -9.477  -5.657
  483    HB3  GLU  63           1HB      GLU  63  -1.831 -10.061  -4.293
  484    HG2  GLU  63           2HG      GLU  63  -2.086  -7.582  -3.670
  485    HG3  GLU  63           1HG      GLU  63  -1.544  -7.265  -5.317
  486    H    GLU  64           H        GLU  64   2.135 -10.051  -4.942
  487    HA   GLU  64           HA       GLU  64   2.022 -12.651  -3.569
  488    HB2  GLU  64           2HB      GLU  64   1.912 -12.072  -6.380
  489    HB3  GLU  64           1HB      GLU  64   3.321 -13.055  -6.022
  490    HG2  GLU  64           2HG      GLU  64   1.850 -14.732  -6.306
  491    HG3  GLU  64           1HG      GLU  64   1.487 -14.398  -4.614
  492    H    VAL  65           H        VAL  65   3.475 -10.850  -2.314
  493    HA   VAL  65           HA       VAL  65   6.208 -11.770  -2.758
  494    HB   VAL  65           HB       VAL  65   7.101  -9.434  -2.491
  495   HG11  VAL  65          1HG1      VAL  65   7.035  -8.954  -4.822
  496   HG12  VAL  65          2HG1      VAL  65   5.519  -9.832  -5.023
  497   HG13  VAL  65          3HG1      VAL  65   7.004 -10.708  -4.650
  498   HG21  VAL  65          3HG2      VAL  65   4.246  -8.710  -3.140
  499   HG22  VAL  65          1HG2      VAL  65   5.606  -7.590  -3.223
  500   HG23  VAL  65          2HG2      VAL  65   5.142  -8.301  -1.677
  501    H    THR  66           H        THR  66   7.591 -11.548  -0.995
  502    HA   THR  66           HA       THR  66   6.398 -11.808   1.557
  503    HB   THR  66           HB       THR  66   9.188 -11.067   1.758
  504    HG1  THR  66           1HG      THR  66   9.766 -11.765  -0.147
  505   HG21  THR  66          3HG2      THR  66   7.901 -12.600   3.267
  506   HG22  THR  66          1HG2      THR  66   9.476 -13.190   2.738
  507   HG23  THR  66          2HG2      THR  66   8.005 -13.814   1.993
  508    H    HIS  67           H        HIS  67   7.027 -10.433   3.481
  509    HA   HIS  67           HA       HIS  67   6.032  -7.866   3.167
  510    HD1  HIS  67           1HD      HIS  67   4.733  -7.159   6.310
  511    HD2  HIS  67           2HD      HIS  67   8.546  -5.832   5.358
  512    HE1  HIS  67           1HE      HIS  67   4.805  -4.754   7.012
  513    HE2  HIS  67           2HE      HIS  67   7.068  -3.939   6.294
  514    HB2  HIS  67           2HB      HIS  67   6.113  -8.964   5.367
  515    HB3  HIS  67           1HB      HIS  67   7.857  -8.739   5.428
  516    H    GLU  68           H        GLU  68   9.411  -8.920   3.067
  517    HA   GLU  68           HA       GLU  68  10.719  -6.497   3.114
  518    HB2  GLU  68           2HB      GLU  68  12.448  -7.564   1.670
  519    HB3  GLU  68           1HB      GLU  68  11.967  -8.559   3.035
  520    HG2  GLU  68           2HG      GLU  68  10.298  -9.569   1.255
  521    HG3  GLU  68           1HG      GLU  68  11.511  -8.961   0.132
  522    H    GLU  69           H        GLU  69   9.247  -8.088   0.290
  523    HA   GLU  69           HA       GLU  69   9.921  -6.115  -1.609
  524    HB2  GLU  69           2HB      GLU  69   7.960  -8.349  -1.480
  525    HB3  GLU  69           1HB      GLU  69   7.709  -7.121  -2.713
  526    HG2  GLU  69           2HG      GLU  69   8.960  -8.785  -3.764
  527    HG3  GLU  69           1HG      GLU  69  10.124  -7.516  -3.385
  528    H    ALA  70           H        ALA  70   7.193  -6.423   0.607
  529    HA   ALA  70           HA       ALA  70   5.488  -4.447  -0.433
  530    HB1  ALA  70           3HB      ALA  70   5.871  -5.016   2.500
  531    HB2  ALA  70           1HB      ALA  70   5.008  -6.107   1.417
  532    HB3  ALA  70           2HB      ALA  70   4.414  -4.467   1.675
  533    H    VAL  71           H        VAL  71   8.205  -4.257   1.809
  534    HA   VAL  71           HA       VAL  71   7.933  -1.403   2.174
  535    HB   VAL  71           HB       VAL  71   9.994  -3.393   3.127
  536   HG11  VAL  71          1HG1      VAL  71  10.018  -0.405   3.303
  537   HG12  VAL  71          2HG1      VAL  71  11.333  -1.513   2.909
  538   HG13  VAL  71          3HG1      VAL  71  10.753  -1.387   4.572
  539   HG21  VAL  71          3HG2      VAL  71   7.602  -3.122   4.124
  540   HG22  VAL  71          1HG2      VAL  71   8.276  -1.669   4.857
  541   HG23  VAL  71          2HG2      VAL  71   8.993  -3.242   5.203
  542    H    THR  72           H        THR  72   9.970  -3.592   0.301
  543    HA   THR  72           HA       THR  72  11.874  -1.706  -0.548
  544    HB   THR  72           HB       THR  72  10.935  -4.258  -1.869
  545    HG1  THR  72           1HG      THR  72  12.033  -5.075  -0.294
  546   HG21  THR  72          3HG2      THR  72  12.051  -3.026  -3.573
  547   HG22  THR  72          1HG2      THR  72  13.178  -4.240  -2.964
  548   HG23  THR  72          2HG2      THR  72  13.341  -2.557  -2.465
  549    H    ALA  73           H        ALA  73   8.695  -2.562  -1.822
  550    HA   ALA  73           HA       ALA  73   9.009  -1.023  -4.229
  551    HB1  ALA  73           3HB      ALA  73   6.461  -2.126  -3.061
  552    HB2  ALA  73           1HB      ALA  73   7.575  -3.063  -4.056
  553    HB3  ALA  73           2HB      ALA  73   6.762  -1.651  -4.733
  554    H    LEU  74           H        LEU  74   7.547  -0.570  -1.034
  555    HA   LEU  74           HA       LEU  74   6.248   1.898  -1.711
  556    HG   LEU  74           HG       LEU  74   4.570   0.149   1.121
  557    HB2  LEU  74           2HB      LEU  74   6.842   0.420   0.831
  558    HB3  LEU  74           1HB      LEU  74   6.258   2.069   0.893
  559   HD11  LEU  74          1HD1      LEU  74   2.844   1.443  -0.026
  560   HD12  LEU  74          2HD1      LEU  74   4.091   2.360  -0.870
  561   HD13  LEU  74          3HD1      LEU  74   3.938   2.485   0.882
  562   HD21  LEU  74          3HD2      LEU  74   3.836  -0.990  -0.738
  563   HD22  LEU  74          1HD2      LEU  74   5.572  -0.913  -1.033
  564   HD23  LEU  74          2HD2      LEU  74   4.488   0.204  -1.860
  565    H    LYS  75           H        LYS  75   9.342   0.906  -0.419
  566    HA   LYS  75           HA       LYS  75  10.145   3.571   0.343
  567    HB2  LYS  75           2HB      LYS  75  12.136   2.638   1.113
  568    HB3  LYS  75           1HB      LYS  75  10.960   1.357   1.362
  569    HG2  LYS  75           2HG      LYS  75  11.785   0.098  -0.432
  570    HG3  LYS  75           1HG      LYS  75  12.671   1.467  -1.100
  571    HD2  LYS  75           2HD      LYS  75  14.440   0.518  -0.082
  572    HD3  LYS  75           1HD      LYS  75  13.787   1.286   1.365
  573    HE2  LYS  75           2HE      LYS  75  12.373  -1.075   1.207
  574    HE3  LYS  75           1HE      LYS  75  13.987  -1.535   0.668
  575    HZ1  LYS  75           3HZ      LYS  75  13.661  -1.742   3.089
  576    HZ2  LYS  75           1HZ      LYS  75  13.421  -0.069   3.189
  577    HZ3  LYS  75           2HZ      LYS  75  14.917  -0.683   2.688
  578    H    ASN  76           H        ASN  76  10.345   1.673  -2.570
  579    HA   ASN  76           HA       ASN  76  12.497   3.159  -3.735
  580    HB2  ASN  76           2HB      ASN  76  11.024   0.815  -4.393
  581    HB3  ASN  76           1HB      ASN  76  10.919   1.914  -5.764
  582   HD21  ASN  76          1HD2      ASN  76  13.207   3.100  -6.027
  583   HD22  ASN  76          2HD2      ASN  76  14.525   1.996  -6.166
  584    H    THR  77           H        THR  77  11.489   5.265  -3.156
  585    HA   THR  77           HA       THR  77   9.279   6.167  -4.777
  586    HB   THR  77           HB       THR  77   9.691   6.934  -2.425
  587    HG1  THR  77           1HG      THR  77   8.410   8.392  -3.202
  588   HG21  THR  77          3HG2      THR  77  11.374   8.336  -1.801
  589   HG22  THR  77          1HG2      THR  77  11.648   8.921  -3.442
  590   HG23  THR  77          2HG2      THR  77  12.228   7.324  -2.967
  591    H    SER  78           H        SER  78   9.387   8.010  -6.196
  592    HA   SER  78           HA       SER  78  12.010   8.574  -7.371
  593    HG   SER  78           HG       SER  78  12.020   6.450  -9.114
  594    HB2  SER  78           2HB      SER  78   9.564   7.775  -8.981
  595    HB3  SER  78           1HB      SER  78  11.101   8.315  -9.656
  596    H    ASP  79           H        ASP  79   9.746   9.792  -9.450
  597    HA   ASP  79           HA       ASP  79   9.791  12.412  -8.141
  598    HB2  ASP  79           2HB      ASP  79   9.141  11.546 -10.969
  599    HB3  ASP  79           1HB      ASP  79   8.904  13.192 -10.392
  600    H    PHE  80           H        PHE  80   7.584  10.099  -9.646
  601    HA   PHE  80           HA       PHE  80   5.363  11.209  -8.061
  602    HD1  PHE  80           1HD      PHE  80   5.411  13.380 -10.154
  603    HD2  PHE  80           2HD      PHE  80   2.200  10.605  -9.855
  604    HE1  PHE  80           1HE      PHE  80   3.818  15.247 -10.006
  605    HE2  PHE  80           2HE      PHE  80   0.599  12.469  -9.706
  606    HZ   PHE  80           HZ       PHE  80   1.408  14.793  -9.783
  607    HB2  PHE  80           2HB      PHE  80   5.567  10.932 -10.912
  608    HB3  PHE  80           1HB      PHE  80   4.329   9.828 -10.325
  609    H    VAL  81           H        VAL  81   3.542   9.419  -7.859
  610    HA   VAL  81           HA       VAL  81   4.701   6.742  -7.766
  611    HB   VAL  81           HB       VAL  81   4.238   8.385  -5.433
  612   HG11  VAL  81          1HG1      VAL  81   2.030   7.464  -5.285
  613   HG12  VAL  81          2HG1      VAL  81   3.042   6.687  -4.066
  614   HG13  VAL  81          3HG1      VAL  81   2.642   5.831  -5.555
  615   HG21  VAL  81          3HG2      VAL  81   5.261   5.569  -5.766
  616   HG22  VAL  81          1HG2      VAL  81   5.430   6.558  -4.316
  617   HG23  VAL  81          2HG2      VAL  81   6.226   7.045  -5.812
  618    H    TYR  82           H        TYR  82   3.238   5.186  -8.357
  619    HA   TYR  82           HA       TYR  82   0.415   6.019  -8.527
  620    HD1  TYR  82           2HD      TYR  82  -0.739   3.086 -10.235
  621    HD2  TYR  82           1HD      TYR  82   0.139   6.971 -11.722
  622    HE1  TYR  82           2HE      TYR  82  -2.919   3.144 -11.350
  623    HE2  TYR  82           1HE      TYR  82  -2.044   7.042 -12.845
  624    HH   TYR  82           HH       TYR  82  -4.337   5.898 -12.502
  625    HB2  TYR  82           2HB      TYR  82   1.829   5.707 -10.697
  626    HB3  TYR  82           1HB      TYR  82   1.609   3.991 -10.386
  627    H    LEU  83           H        LEU  83  -0.352   5.086  -6.738
  628    HA   LEU  83           HA       LEU  83   0.343   2.379  -6.010
  629    HG   LEU  83           HG       LEU  83   0.016   1.796  -3.850
  630    HB2  LEU  83           2HB      LEU  83  -0.146   4.394  -4.448
  631    HB3  LEU  83           1HB      LEU  83  -1.829   3.968  -4.696
  632   HD11  LEU  83          1HD1      LEU  83  -0.963   3.963  -1.996
  633   HD12  LEU  83          2HD1      LEU  83   0.715   3.593  -2.392
  634   HD13  LEU  83          3HD1      LEU  83  -0.254   2.431  -1.487
  635   HD21  LEU  83          3HD2      LEU  83  -1.943   0.782  -3.646
  636   HD22  LEU  83          1HD2      LEU  83  -2.792   2.276  -4.040
  637   HD23  LEU  83          2HD2      LEU  83  -2.375   1.914  -2.365
  638    H    LYS  84           H        LYS  84  -0.862   0.581  -6.154
  639    HA   LYS  84           HA       LYS  84  -3.485   0.765  -7.474
  640    HB2  LYS  84           2HB      LYS  84  -1.317  -1.294  -7.848
  641    HB3  LYS  84           1HB      LYS  84  -2.959  -1.500  -8.438
  642    HG2  LYS  84           2HG      LYS  84  -1.933   1.027  -9.314
  643    HG3  LYS  84           1HG      LYS  84  -0.796  -0.259  -9.727
  644    HD2  LYS  84           2HD      LYS  84  -2.126  -0.451 -11.548
  645    HD3  LYS  84           1HD      LYS  84  -3.100  -1.437 -10.456
  646    HE2  LYS  84           2HE      LYS  84  -4.793   0.006 -10.543
  647    HE3  LYS  84           1HE      LYS  84  -3.733   1.364 -10.169
  648    HZ1  LYS  84           3HZ      LYS  84  -4.307   0.218 -12.845
  649    HZ2  LYS  84           1HZ      LYS  84  -3.086   1.355 -12.562
  650    HZ3  LYS  84           2HZ      LYS  84  -4.703   1.762 -12.281
  651    H    VAL  85           H        VAL  85  -5.169  -0.126  -6.375
  652    HA   VAL  85           HA       VAL  85  -4.500  -1.949  -4.162
  653    HB   VAL  85           HB       VAL  85  -6.672   0.152  -4.266
  654   HG11  VAL  85          1HG1      VAL  85  -6.546  -0.791  -1.675
  655   HG12  VAL  85          2HG1      VAL  85  -6.415  -2.256  -2.649
  656   HG13  VAL  85          3HG1      VAL  85  -7.795  -1.176  -2.862
  657   HG21  VAL  85          3HG2      VAL  85  -4.051  -0.054  -2.838
  658   HG22  VAL  85          1HG2      VAL  85  -5.370   0.893  -2.151
  659   HG23  VAL  85          2HG2      VAL  85  -4.728   1.299  -3.742
  660    H    ALA  86           H        ALA  86  -5.660  -3.793  -3.953
  661    HA   ALA  86           HA       ALA  86  -7.422  -4.534  -6.139
  662    HB1  ALA  86           3HB      ALA  86  -6.861  -6.343  -3.833
  663    HB2  ALA  86           1HB      ALA  86  -5.571  -5.982  -4.980
  664    HB3  ALA  86           2HB      ALA  86  -7.067  -6.729  -5.541
  665    H    LYS  87           H        LYS  87  -9.586  -5.146  -5.934
  666    HA   LYS  87           HA       LYS  87 -10.904  -4.143  -3.507
  667    HB2  LYS  87           2HB      LYS  87 -11.393  -3.415  -6.044
  668    HB3  LYS  87           1HB      LYS  87 -12.501  -4.775  -5.929
  669    HG2  LYS  87           2HG      LYS  87 -13.952  -3.605  -4.720
  670    HG3  LYS  87           1HG      LYS  87 -12.693  -3.040  -3.620
  671    HD2  LYS  87           2HD      LYS  87 -12.679  -1.031  -4.580
  672    HD3  LYS  87           1HD      LYS  87 -12.433  -1.744  -6.174
  673    HE2  LYS  87           2HE      LYS  87 -14.444  -0.689  -6.489
  674    HE3  LYS  87           1HE      LYS  87 -14.993  -2.286  -5.984
  675    HZ1  LYS  87           3HZ      LYS  87 -16.196  -0.565  -4.819
  676    HZ2  LYS  87           1HZ      LYS  87 -14.756   0.111  -4.243
  677    HZ3  LYS  87           2HZ      LYS  87 -15.237  -1.425  -3.724
  678    HA   PRO  88           HA       PRO  88 -11.648  -8.515  -2.683
  679    HB2  PRO  88           2HB      PRO  88 -12.681  -8.162  -0.201
  680    HB3  PRO  88           1HB      PRO  88 -10.947  -8.112  -0.533
  681    HG2  PRO  88           2HG      PRO  88 -12.872  -5.852  -0.172
  682    HG3  PRO  88           1HG      PRO  88 -11.222  -6.026   0.451
  683    HD2  PRO  88           2HD      PRO  88 -11.832  -4.532  -1.736
  684    HD3  PRO  88           1HD      PRO  88 -10.271  -5.350  -1.529
  685    H    THR  89           H        THR  89 -13.366  -9.434  -3.688
  686    HA   THR  89           HA       THR  89 -16.055  -8.645  -2.844
  687    HB   THR  89           HB       THR  89 -15.305  -8.982  -5.754
  688    HG1  THR  89           1HG      THR  89 -14.509  -7.043  -5.359
  689   HG21  THR  89          3HG2      THR  89 -17.493  -7.898  -6.157
  690   HG22  THR  89          1HG2      THR  89 -17.842  -8.051  -4.435
  691   HG23  THR  89          2HG2      THR  89 -17.615  -9.496  -5.421
  692    H    GLY  90           H        GLY  90 -16.949 -10.427  -2.059
  693    HA2  GLY  90           2HA      GLY  90 -17.724 -12.582  -1.910
  694    HA3  GLY  90           1HA      GLY  90 -17.347 -12.758  -3.615
  695    H    SER  91           H        SER  91 -14.930 -11.940  -1.183
  696    HA   SER  91           HA       SER  91 -13.092 -13.853  -1.984
  697    HG   SER  91           HG       SER  91 -11.561 -11.320  -0.175
  698    HB2  SER  91           2HB      SER  91 -13.431 -12.408   0.643
  699    HB3  SER  91           1HB      SER  91 -12.071 -13.488   0.327
  700    H    HIS  92           H        HIS  92 -15.576 -14.081   0.534
  701    HA   HIS  92           HA       HIS  92 -14.797 -16.519   1.664
  702    HD1  HIS  92           1HD      HIS  92 -17.797 -15.564  -0.652
  703    HD2  HIS  92           2HD      HIS  92 -18.578 -13.611   2.933
  704    HE1  HIS  92           1HE      HIS  92 -19.563 -13.859  -1.187
  705    HE2  HIS  92           2HE      HIS  92 -20.086 -12.755   1.016
  706    HB2  HIS  92           2HB      HIS  92 -17.287 -16.724   2.253
  707    HB3  HIS  92           1HB      HIS  92 -16.423 -15.320   2.864
  708    HA   ARG 301           HA       ARG 301   1.600 -10.769  10.031
  709    HE   ARG 301           HE       ARG 301  -1.211 -11.978  15.240
  710    H1   ARG 301           1HT      ARG 301   1.352 -12.919  11.176
  711    H2   ARG 301           2HT      ARG 301   2.714 -12.497  12.131
  712    H3   ARG 301           3HT      ARG 301   2.869 -12.644  10.429
  713    HB2  ARG 301           2HB      ARG 301   0.614  -9.518  12.016
  714    HB3  ARG 301           1HB      ARG 301  -0.173 -11.026  11.578
  715    HG2  ARG 301           2HG      ARG 301   1.943 -11.284  13.598
  716    HG3  ARG 301           1HG      ARG 301   0.544 -10.332  14.094
  717    HD2  ARG 301           2HD      ARG 301  -0.034 -12.878  12.714
  718    HD3  ARG 301           1HD      ARG 301   0.686 -13.010  14.315
  719   HH11  ARG 301          1HH1      ARG 301  -1.533 -12.417  11.772
  720   HH12  ARG 301          2HH1      ARG 301  -3.246 -12.181  11.784
  721   HH21  ARG 301          1HH2      ARG 301  -3.467 -11.674  15.237
  722   HH22  ARG 301          2HH2      ARG 301  -4.344 -11.761  13.746
  723    H    ARG 302           H        ARG 302   2.688  -8.885   9.779
  724    HA   ARG 302           HA       ARG 302   4.529  -7.893  11.761
  725    HE   ARG 302           HE       ARG 302   8.152 -10.500   9.433
  726    HB2  ARG 302           2HB      ARG 302   5.852  -9.675  10.653
  727    HB3  ARG 302           1HB      ARG 302   5.619  -8.864   9.113
  728    HG2  ARG 302           2HG      ARG 302   6.765  -6.862  10.113
  729    HG3  ARG 302           1HG      ARG 302   7.181  -7.889  11.487
  730    HD2  ARG 302           2HD      ARG 302   7.938  -8.371   8.607
  731    HD3  ARG 302           1HD      ARG 302   9.012  -7.785   9.874
  732   HH11  ARG 302          1HH1      ARG 302   9.465  -8.245  11.770
  733   HH12  ARG 302          2HH1      ARG 302  10.164  -9.486  12.754
  734   HH21  ARG 302          1HH2      ARG 302   9.076 -12.127  10.736
  735   HH22  ARG 302          2HH2      ARG 302   9.943 -11.689  12.169
  736    H    GLU 303           H        GLU 303   4.510  -5.741  11.667
  737    HA   GLU 303           HA       GLU 303   3.791  -4.449   9.114
  738    HB2  GLU 303           2HB      GLU 303   2.735  -2.662  10.410
  739    HB3  GLU 303           1HB      GLU 303   1.998  -4.219  10.753
  740    HG2  GLU 303           2HG      GLU 303   2.891  -4.320  12.888
  741    HG3  GLU 303           1HG      GLU 303   4.161  -3.154  12.518
  742    H    THR 304           H        THR 304   4.888  -2.607   8.497
  743    HA   THR 304           HA       THR 304   6.976  -1.535  10.201
  744    HB   THR 304           HB       THR 304   7.491  -3.410   8.026
  745    HG1  THR 304           1HG      THR 304   8.565  -3.916   9.775
  746   HG21  THR 304          3HG2      THR 304   9.070  -0.854   8.032
  747   HG22  THR 304          1HG2      THR 304   8.049  -1.455   6.726
  748   HG23  THR 304          2HG2      THR 304   9.509  -2.335   7.180
  749    H    GLN 305           H        GLN 305   7.554   0.557   9.694
  750    HA   GLN 305           HA       GLN 305   5.733   2.037   8.085
  751    HB2  GLN 305           2HB      GLN 305   7.919   2.629   9.925
  752    HB3  GLN 305           1HB      GLN 305   7.860   3.737   8.559
  753    HG2  GLN 305           2HG      GLN 305   5.740   4.509   9.113
  754    HG3  GLN 305           1HG      GLN 305   5.398   3.119  10.142
  755   HE21  GLN 305          1HE2      GLN 305   5.045   3.999  12.084
  756   HE22  GLN 305          2HE2      GLN 305   6.144   5.037  12.919
  757    H    VAL 306           H        VAL 306   6.259   3.408   6.289
  758    HA   VAL 306           HA       VAL 306   8.656   2.773   4.760
  759    HB   VAL 306           HB       VAL 306   7.201   2.421   2.686
  760   HG11  VAL 306          1HG1      VAL 306   8.524   0.664   3.868
  761   HG12  VAL 306          2HG1      VAL 306   7.099   0.055   3.027
  762   HG13  VAL 306          3HG1      VAL 306   7.071   0.254   4.780
  763   HG21  VAL 306          3HG2      VAL 306   4.974   1.422   3.139
  764   HG22  VAL 306          1HG2      VAL 306   5.073   3.130   3.567
  765   HG23  VAL 306          2HG2      VAL 306   5.142   1.901   4.829
  Start of MODEL   11
    1    HA   MET   1           HA       MET   1  -8.980   1.679  -9.245
    2    H1   MET   1           1HT      MET   1  -9.659  -0.639  -9.146
    3    H2   MET   1           2HT      MET   1  -8.106  -1.039  -8.534
    4    H3   MET   1           3HT      MET   1  -8.265  -0.361 -10.103
    5    HB2  MET   1           2HB      MET   1 -10.211   0.497  -7.335
    6    HB3  MET   1           1HB      MET   1  -8.678   0.518  -6.476
    7    HG2  MET   1           2HG      MET   1  -9.677   2.404  -5.659
    8    HG3  MET   1           1HG      MET   1  -8.737   3.069  -6.995
    9    HE1  MET   1           3HE      MET   1 -12.117   4.347  -5.699
   10    HE2  MET   1           1HE      MET   1 -11.595   5.396  -7.017
   11    HE3  MET   1           2HE      MET   1 -10.412   4.768  -5.870
   12    H    GLU   2           H        GLU   2  -7.393   3.170  -9.158
   13    HA   GLU   2           HA       GLU   2  -4.777   2.361  -8.065
   14    HB2  GLU   2           2HB      GLU   2  -3.652   3.472  -9.884
   15    HB3  GLU   2           1HB      GLU   2  -4.807   2.331 -10.557
   16    HG2  GLU   2           2HG      GLU   2  -5.620   5.174 -10.190
   17    HG3  GLU   2           1HG      GLU   2  -4.576   4.737 -11.541
   18    H    ILE   3           H        ILE   3  -3.409   4.142  -7.332
   19    HA   ILE   3           HA       ILE   3  -4.736   6.696  -6.908
   20    HB   ILE   3           HB       ILE   3  -3.621   5.009  -4.659
   21   HG12  ILE   3          2HG1      ILE   3  -6.406   6.145  -4.893
   22   HG13  ILE   3          1HG1      ILE   3  -5.993   4.557  -5.530
   23   HG21  ILE   3          1HG2      ILE   3  -2.962   7.128  -4.061
   24   HG22  ILE   3          2HG2      ILE   3  -4.557   7.030  -3.313
   25   HG23  ILE   3          3HG2      ILE   3  -4.346   7.896  -4.835
   26   HD11  ILE   3          3HD1      ILE   3  -6.403   3.711  -3.533
   27   HD12  ILE   3          1HD1      ILE   3  -6.641   5.323  -2.857
   28   HD13  ILE   3          2HD1      ILE   3  -5.027   4.614  -2.901
   29    H    LYS   4           H        LYS   4  -3.231   7.735  -8.180
   30    HA   LYS   4           HA       LYS   4  -0.388   7.431  -7.529
   31    HB2  LYS   4           2HB      LYS   4  -1.246   7.361  -9.925
   32    HB3  LYS   4           1HB      LYS   4  -1.591   9.077  -9.758
   33    HG2  LYS   4           2HG      LYS   4   0.803   9.463  -9.259
   34    HG3  LYS   4           1HG      LYS   4   1.107   7.752  -9.565
   35    HD2  LYS   4           2HD      LYS   4   1.638   8.857 -11.579
   36    HD3  LYS   4           1HD      LYS   4   0.054   8.126 -11.848
   37    HE2  LYS   4           2HE      LYS   4  -0.399  10.690 -10.761
   38    HE3  LYS   4           1HE      LYS   4   0.829  10.878 -12.012
   39    HZ1  LYS   4           3HZ      LYS   4  -1.431  11.107 -12.879
   40    HZ2  LYS   4           1HZ      LYS   4  -1.791   9.529 -12.388
   41    HZ3  LYS   4           2HZ      LYS   4  -0.626   9.797 -13.584
   42    H    LEU   5           H        LEU   5   0.914   9.244  -6.857
   43    HA   LEU   5           HA       LEU   5  -0.414  11.780  -6.421
   44    HG   LEU   5           HG       LEU   5  -1.664  12.158  -4.728
   45    HB2  LEU   5           2HB      LEU   5   0.083   9.826  -4.308
   46    HB3  LEU   5           1HB      LEU   5   0.842  11.372  -3.986
   47   HD11  LEU   5          1HD1      LEU   5  -2.089   9.538  -4.603
   48   HD12  LEU   5          2HD1      LEU   5  -3.302  10.716  -4.099
   49   HD13  LEU   5          3HD1      LEU   5  -2.293   9.918  -2.893
   50   HD21  LEU   5          3HD2      LEU   5  -1.942  12.780  -2.488
   51   HD22  LEU   5          1HD2      LEU   5  -0.195  12.736  -2.717
   52   HD23  LEU   5          2HD2      LEU   5  -1.010  11.406  -1.895
   53    H    ILE   6           H        ILE   6   1.248  13.358  -5.386
   54    HA   ILE   6           HA       ILE   6   3.779  12.963  -6.799
   55    HB   ILE   6           HB       ILE   6   2.500  15.067  -7.171
   56   HG12  ILE   6          2HG1      ILE   6   5.177  15.550  -5.850
   57   HG13  ILE   6          1HG1      ILE   6   4.989  14.869  -7.463
   58   HG21  ILE   6          1HG2      ILE   6   3.364  15.961  -4.444
   59   HG22  ILE   6          2HG2      ILE   6   1.801  15.181  -4.696
   60   HG23  ILE   6          3HG2      ILE   6   2.180  16.688  -5.530
   61   HD11  ILE   6          3HD1      ILE   6   3.559  17.050  -7.837
   62   HD12  ILE   6          1HD1      ILE   6   5.316  17.054  -7.988
   63   HD13  ILE   6          2HD1      ILE   6   4.557  17.640  -6.508
   64    H    LYS   7           H        LYS   7   5.591  12.441  -5.773
   65    HA   LYS   7           HA       LYS   7   5.764  11.730  -3.116
   66    HB2  LYS   7           2HB      LYS   7   7.366  11.082  -4.903
   67    HB3  LYS   7           1HB      LYS   7   8.044  12.701  -4.843
   68    HG2  LYS   7           2HG      LYS   7   9.524  11.580  -3.521
   69    HG3  LYS   7           1HG      LYS   7   8.372  12.130  -2.304
   70    HD2  LYS   7           2HD      LYS   7   7.387   9.678  -3.266
   71    HD3  LYS   7           1HD      LYS   7   9.120   9.452  -3.025
   72    HE2  LYS   7           2HE      LYS   7   8.401   8.960  -0.923
   73    HE3  LYS   7           1HE      LYS   7   8.589  10.704  -0.750
   74    HZ1  LYS   7           3HZ      LYS   7   6.250   9.138  -0.497
   75    HZ2  LYS   7           1HZ      LYS   7   6.028  10.280  -1.724
   76    HZ3  LYS   7           2HZ      LYS   7   6.465  10.783  -0.171
   77    H    GLY   8           H        GLY   8   6.170  12.726  -1.223
   78    HA2  GLY   8           2HA      GLY   8   6.280  15.643  -1.223
   79    HA3  GLY   8           1HA      GLY   8   5.965  14.611   0.164
   80    HA   PRO   9           HA       PRO   9  10.314  16.109   0.578
   81    HB2  PRO   9           2HB      PRO   9   9.698  16.431   3.408
   82    HB3  PRO   9           1HB      PRO   9  10.197  17.647   2.233
   83    HG2  PRO   9           2HG      PRO   9   7.703  17.565   3.305
   84    HG3  PRO   9           1HG      PRO   9   8.038  18.190   1.679
   85    HD2  PRO   9           2HD      PRO   9   6.979  15.507   2.501
   86    HD3  PRO   9           1HD      PRO   9   6.467  16.557   1.161
   87    H    LYS  10           H        LYS  10   9.162  14.674   3.635
   88    HA   LYS  10           HA       LYS  10  11.398  12.953   3.805
   89    HB2  LYS  10           2HB      LYS  10   9.857  11.826   5.631
   90    HB3  LYS  10           1HB      LYS  10  10.616  13.384   5.911
   91    HG2  LYS  10           2HG      LYS  10   8.642  14.516   5.837
   92    HG3  LYS  10           1HG      LYS  10   7.898  13.374   4.719
   93    HD2  LYS  10           2HD      LYS  10   6.772  12.676   6.539
   94    HD3  LYS  10           1HD      LYS  10   8.262  11.805   6.907
   95    HE2  LYS  10           2HE      LYS  10   9.006  13.568   8.352
   96    HE3  LYS  10           1HE      LYS  10   7.661  14.598   7.867
   97    HZ1  LYS  10           3HZ      LYS  10   6.135  13.032   8.894
   98    HZ2  LYS  10           1HZ      LYS  10   7.271  13.579  10.022
   99    HZ3  LYS  10           2HZ      LYS  10   7.422  12.035   9.352
  100    H    GLY  11           H        GLY  11   7.936  12.100   3.372
  101    HA2  GLY  11           2HA      GLY  11   8.241  10.359   1.262
  102    HA3  GLY  11           1HA      GLY  11   8.564   9.395   2.692
  103    H    LEU  12           H        LEU  12   6.700   8.171   1.873
  104    HA   LEU  12           HA       LEU  12   4.115   9.103   1.619
  105    HG   LEU  12           HG       LEU  12   5.217   7.460   0.064
  106    HB2  LEU  12           2HB      LEU  12   5.015   6.440   2.717
  107    HB3  LEU  12           1HB      LEU  12   3.394   6.804   2.163
  108   HD11  LEU  12          1HD1      LEU  12   6.616   5.768   1.417
  109   HD12  LEU  12          2HD1      LEU  12   6.429   5.522  -0.320
  110   HD13  LEU  12          3HD1      LEU  12   5.467   4.573   0.815
  111   HD21  LEU  12          3HD2      LEU  12   2.722   6.594   0.197
  112   HD22  LEU  12          1HD2      LEU  12   3.511   5.032  -0.026
  113   HD23  LEU  12          2HD2      LEU  12   3.732   6.309  -1.221
  114    H    GLY  13           H        GLY  13   5.798   8.131   4.593
  115    HA2  GLY  13           2HA      GLY  13   5.393   8.793   6.762
  116    HA3  GLY  13           1HA      GLY  13   4.098   9.815   6.169
  117    H    PHE  14           H        PHE  14   4.583   6.277   6.050
  118    HA   PHE  14           HA       PHE  14   2.588   5.785   8.021
  119    HD1  PHE  14           2HD      PHE  14   2.725   3.179   5.133
  120    HD2  PHE  14           1HD      PHE  14   0.856   6.826   3.985
  121    HE1  PHE  14           2HE      PHE  14   3.009   2.573   2.770
  122    HE2  PHE  14           1HE      PHE  14   1.129   6.220   1.618
  123    HZ   PHE  14           HZ       PHE  14   2.206   4.092   1.007
  124    HB2  PHE  14           2HB      PHE  14   0.929   4.667   6.605
  125    HB3  PHE  14           1HB      PHE  14   1.073   6.368   6.201
  126    H    SER  15           H        SER  15   1.888   3.203   7.577
  127    HA   SER  15           HA       SER  15   4.414   1.801   7.096
  128    HG   SER  15           HG       SER  15   2.715   2.782   9.975
  129    HB2  SER  15           2HB      SER  15   3.398   0.234   9.006
  130    HB3  SER  15           1HB      SER  15   4.451   1.594   9.380
  131    H    ILE  16           H        ILE  16   3.894  -0.697   7.067
  132    HA   ILE  16           HA       ILE  16   1.292  -1.369   5.995
  133    HB   ILE  16           HB       ILE  16   1.868  -1.973   3.833
  134   HG12  ILE  16          2HG1      ILE  16   4.024  -3.107   4.494
  135   HG13  ILE  16          1HG1      ILE  16   4.011  -2.335   2.915
  136   HG21  ILE  16          1HG2      ILE  16   1.682   0.413   3.948
  137   HG22  ILE  16          2HG2      ILE  16   2.916  -0.016   2.765
  138   HG23  ILE  16          3HG2      ILE  16   3.389   0.561   4.362
  139   HD11  ILE  16          3HD1      ILE  16   4.933  -0.549   4.983
  140   HD12  ILE  16          1HD1      ILE  16   5.686  -1.007   3.455
  141   HD13  ILE  16          2HD1      ILE  16   5.901  -2.023   4.885
  142    H    ALA  17           H        ALA  17   1.319  -3.698   5.226
  143    HA   ALA  17           HA       ALA  17   3.289  -5.390   6.577
  144    HB1  ALA  17           3HB      ALA  17   1.751  -5.719   8.213
  145    HB2  ALA  17           1HB      ALA  17   1.050  -6.829   7.037
  146    HB3  ALA  17           2HB      ALA  17   0.407  -5.192   7.202
  147    H    GLY  18           H        GLY  18   3.011  -7.765   5.648
  148    HA2  GLY  18           2HA      GLY  18   1.479  -8.337   3.467
  149    HA3  GLY  18           1HA      GLY  18   2.794  -7.420   2.784
  150    H    GLY  19           H        GLY  19   1.755 -10.432   2.812
  151    HA2  GLY  19           2HA      GLY  19   3.168 -12.117   1.882
  152    HA3  GLY  19           1HA      GLY  19   4.507 -11.468   2.809
  153    H    VAL  20           H        VAL  20   3.785 -14.193   2.687
  154    HA   VAL  20           HA       VAL  20   2.249 -15.022   4.909
  155    HB   VAL  20           HB       VAL  20   3.441 -17.222   4.648
  156   HG11  VAL  20          1HG1      VAL  20   2.174 -15.932   2.238
  157   HG12  VAL  20          2HG1      VAL  20   1.389 -16.901   3.485
  158   HG13  VAL  20          3HG1      VAL  20   2.513 -17.658   2.358
  159   HG21  VAL  20          3HG2      VAL  20   5.568 -16.169   3.783
  160   HG22  VAL  20          1HG2      VAL  20   4.741 -15.963   2.240
  161   HG23  VAL  20          2HG2      VAL  20   4.997 -17.581   2.895
  162    H    GLY  21           H        GLY  21   2.824 -15.584   7.000
  163    HA2  GLY  21           2HA      GLY  21   4.206 -15.839   8.872
  164    HA3  GLY  21           1HA      GLY  21   5.597 -15.462   7.866
  165    H    ASN  22           H        ASN  22   3.983 -13.020   6.939
  166    HA   ASN  22           HA       ASN  22   4.165 -11.317   9.304
  167    HB2  ASN  22           2HB      ASN  22   5.186  -9.605   7.508
  168    HB3  ASN  22           1HB      ASN  22   6.214 -10.635   8.481
  169   HD21  ASN  22          1HD2      ASN  22   4.391 -10.804   5.435
  170   HD22  ASN  22          2HD2      ASN  22   5.644 -11.595   4.547
  171    H    GLN  23           H        GLN  23   2.003 -12.497   7.480
  172    HA   GLN  23           HA       GLN  23   0.877 -10.574   5.833
  173    HB2  GLN  23           2HB      GLN  23  -0.259 -12.898   7.356
  174    HB3  GLN  23           1HB      GLN  23  -1.301 -11.851   6.406
  175    HG2  GLN  23           2HG      GLN  23   0.073 -12.362   4.415
  176    HG3  GLN  23           1HG      GLN  23   1.007 -13.491   5.395
  177   HE21  GLN  23          1HE2      GLN  23  -2.370 -12.758   4.565
  178   HE22  GLN  23          2HE2      GLN  23  -2.870 -14.406   4.439
  179    H    HIS  24           H        HIS  24  -0.779  -9.123   6.044
  180    HA   HIS  24           HA       HIS  24  -1.052  -7.875   8.660
  181    HD1  HIS  24           1HD      HIS  24  -0.668  -4.968   8.754
  182    HD2  HIS  24           2HD      HIS  24  -4.313  -5.594   6.878
  183    HE1  HIS  24           1HE      HIS  24  -2.158  -3.148   9.586
  184    HE2  HIS  24           2HE      HIS  24  -4.324  -3.448   8.335
  185    HB2  HIS  24           2HB      HIS  24  -0.624  -6.512   6.608
  186    HB3  HIS  24           1HB      HIS  24  -2.185  -7.008   5.992
  187    H    ILE  25           H        ILE  25  -2.900  -9.835   6.469
  188    HA   ILE  25           HA       ILE  25  -5.098  -9.889   8.377
  189    HB   ILE  25           HB       ILE  25  -5.254  -8.299   6.106
  190   HG12  ILE  25          2HG1      ILE  25  -7.615  -8.039   6.716
  191   HG13  ILE  25          1HG1      ILE  25  -7.520  -9.477   7.726
  192   HG21  ILE  25          1HG2      ILE  25  -6.926  -9.266   4.668
  193   HG22  ILE  25          2HG2      ILE  25  -6.929 -10.752   5.620
  194   HG23  ILE  25          3HG2      ILE  25  -5.494 -10.293   4.703
  195   HD11  ILE  25          3HD1      ILE  25  -6.182  -8.407   9.307
  196   HD12  ILE  25          1HD1      ILE  25  -7.379  -7.194   8.853
  197   HD13  ILE  25          2HD1      ILE  25  -5.745  -7.111   8.194
  198    HA   PRO  26           HA       PRO  26  -4.799 -14.264   7.706
  199    HB2  PRO  26           2HB      PRO  26  -7.745 -14.200   8.150
  200    HB3  PRO  26           1HB      PRO  26  -6.507 -15.180   8.942
  201    HG2  PRO  26           2HG      PRO  26  -7.600 -13.095  10.186
  202    HG3  PRO  26           1HG      PRO  26  -5.877 -13.473  10.371
  203    HD2  PRO  26           2HD      PRO  26  -7.188 -11.322   8.773
  204    HD3  PRO  26           1HD      PRO  26  -5.643 -11.305   9.646
  205    H    GLY  27           H        GLY  27  -4.575 -15.116   5.738
  206    HA2  GLY  27           2HA      GLY  27  -5.472 -16.206   3.839
  207    HA3  GLY  27           1HA      GLY  27  -6.895 -15.188   3.952
  208    H    ASP  28           H        ASP  28  -5.901 -12.659   3.928
  209    HA   ASP  28           HA       ASP  28  -5.003 -12.442   1.184
  210    HB2  ASP  28           2HB      ASP  28  -6.555 -10.845   2.947
  211    HB3  ASP  28           1HB      ASP  28  -5.158  -9.888   2.464
  212    H    ASN  29           H        ASN  29  -2.914 -12.683   0.809
  213    HA   ASN  29           HA       ASN  29  -0.914 -11.804   2.729
  214    HB2  ASN  29           2HB      ASN  29  -0.108 -12.844   0.060
  215    HB3  ASN  29           1HB      ASN  29   0.594 -13.148   1.645
  216   HD21  ASN  29          1HD2      ASN  29  -1.729 -14.155  -0.703
  217   HD22  ASN  29          2HD2      ASN  29  -2.215 -15.610   0.092
  218    H    SER  30           H        SER  30  -2.627  -9.942   0.899
  219    HA   SER  30           HA       SER  30  -0.766  -8.630  -0.813
  220    HG   SER  30           HG       SER  30  -4.298  -8.973  -0.568
  221    HB2  SER  30           2HB      SER  30  -3.266  -7.372   0.313
  222    HB3  SER  30           1HB      SER  30  -2.480  -7.045  -1.231
  223    H    ILE  31           H        ILE  31  -0.702  -6.037  -0.427
  224    HA   ILE  31           HA       ILE  31   0.636  -5.778   2.176
  225    HB   ILE  31           HB       ILE  31   0.883  -3.905  -0.178
  226   HG12  ILE  31          2HG1      ILE  31   2.103  -5.563  -1.094
  227   HG13  ILE  31          1HG1      ILE  31   3.329  -5.065   0.056
  228   HG21  ILE  31          1HG2      ILE  31   2.537  -4.117   2.326
  229   HG22  ILE  31          2HG2      ILE  31   1.335  -2.872   1.989
  230   HG23  ILE  31          3HG2      ILE  31   2.789  -2.985   0.997
  231   HD11  ILE  31          3HD1      ILE  31   3.361  -7.230   0.604
  232   HD12  ILE  31          1HD1      ILE  31   1.774  -7.534  -0.099
  233   HD13  ILE  31          2HD1      ILE  31   1.904  -6.858   1.522
  234    H    TYR  32           H        TYR  32  -0.615  -5.021   3.729
  235    HA   TYR  32           HA       TYR  32  -2.618  -2.952   3.115
  236    HD1  TYR  32           2HD      TYR  32  -2.419  -6.444   3.220
  237    HD2  TYR  32           1HD      TYR  32  -5.669  -4.093   4.629
  238    HE1  TYR  32           2HE      TYR  32  -3.978  -7.911   2.022
  239    HE2  TYR  32           1HE      TYR  32  -7.253  -5.546   3.448
  240    HH   TYR  32           HH       TYR  32  -6.418  -7.609   1.054
  241    HB2  TYR  32           2HB      TYR  32  -2.383  -4.906   5.396
  242    HB3  TYR  32           1HB      TYR  32  -3.559  -3.601   5.365
  243    H    VAL  33           H        VAL  33  -2.707  -1.048   4.271
  244    HA   VAL  33           HA       VAL  33  -0.282  -0.128   5.483
  245    HB   VAL  33           HB       VAL  33  -2.996   1.173   5.181
  246   HG11  VAL  33          1HG1      VAL  33  -2.301   2.382   6.976
  247   HG12  VAL  33          2HG1      VAL  33  -1.436   3.264   5.717
  248   HG13  VAL  33          3HG1      VAL  33  -0.593   2.052   6.681
  249   HG21  VAL  33          3HG2      VAL  33  -0.761   0.856   3.446
  250   HG22  VAL  33          1HG2      VAL  33  -0.915   2.565   3.853
  251   HG23  VAL  33          2HG2      VAL  33  -2.279   1.699   3.146
  252    H    THR  34           H        THR  34   0.261  -0.198   7.586
  253    HA   THR  34           HA       THR  34  -1.705  -1.247   9.474
  254    HB   THR  34           HB       THR  34   0.123  -1.915  10.845
  255    HG1  THR  34           1HG      THR  34   1.695  -0.527  10.920
  256   HG21  THR  34          3HG2      THR  34   0.138  -2.616   8.051
  257   HG22  THR  34          1HG2      THR  34   0.444  -3.615   9.470
  258   HG23  THR  34          2HG2      THR  34   1.758  -2.693   8.743
  259    H    LYS  35           H        LYS  35   0.241   1.648   8.983
  260    HA   LYS  35           HA       LYS  35  -1.343   3.077  10.922
  261    HB2  LYS  35           2HB      LYS  35   1.569   2.502  11.462
  262    HB3  LYS  35           1HB      LYS  35   0.744   3.880  12.170
  263    HG2  LYS  35           2HG      LYS  35  -0.963   1.971  12.899
  264    HG3  LYS  35           1HG      LYS  35   0.506   0.998  12.776
  265    HD2  LYS  35           2HD      LYS  35   1.625   2.313  14.392
  266    HD3  LYS  35           1HD      LYS  35   0.400   3.582  14.316
  267    HE2  LYS  35           2HE      LYS  35  -1.121   2.373  15.561
  268    HE3  LYS  35           1HE      LYS  35  -0.397   0.823  15.136
  269    HZ1  LYS  35           3HZ      LYS  35   1.473   1.335  16.568
  270    HZ2  LYS  35           1HZ      LYS  35   0.028   1.417  17.444
  271    HZ3  LYS  35           2HZ      LYS  35   0.804   2.838  16.960
  272    H    ILE  36           H        ILE  36  -1.674   5.058  10.107
  273    HA   ILE  36           HA       ILE  36   0.263   6.092   8.160
  274    HB   ILE  36           HB       ILE  36  -2.605   6.908   8.642
  275   HG12  ILE  36          2HG1      ILE  36  -1.320   5.516   6.279
  276   HG13  ILE  36          1HG1      ILE  36  -2.247   4.701   7.534
  277   HG21  ILE  36          1HG2      ILE  36  -2.366   8.345   6.690
  278   HG22  ILE  36          2HG2      ILE  36  -0.668   7.891   6.546
  279   HG23  ILE  36          3HG2      ILE  36  -1.218   8.812   7.945
  280   HD11  ILE  36          3HD1      ILE  36  -3.846   6.807   6.555
  281   HD12  ILE  36          1HD1      ILE  36  -4.084   5.069   6.377
  282   HD13  ILE  36          2HD1      ILE  36  -3.167   5.961   5.162
  283    H    ILE  37           H        ILE  37   1.603   7.674   8.748
  284    HA   ILE  37           HA       ILE  37   1.452   8.904  11.315
  285    HB   ILE  37           HB       ILE  37   3.314   9.068   8.987
  286   HG12  ILE  37          2HG1      ILE  37   4.388   8.906  11.696
  287   HG13  ILE  37          1HG1      ILE  37   3.235   7.625  11.338
  288   HG21  ILE  37          1HG2      ILE  37   3.203  11.373   9.452
  289   HG22  ILE  37          2HG2      ILE  37   4.653  10.782  10.262
  290   HG23  ILE  37          3HG2      ILE  37   3.190  11.098  11.195
  291   HD11  ILE  37          3HD1      ILE  37   4.654   6.578   9.975
  292   HD12  ILE  37          1HD1      ILE  37   5.888   7.559  10.765
  293   HD13  ILE  37          2HD1      ILE  37   5.201   8.078   9.227
  294    H    GLU  38           H        GLU  38   0.984  11.024  11.868
  295    HA   GLU  38           HA       GLU  38  -1.051  12.369  10.568
  296    HB2  GLU  38           2HB      GLU  38  -0.079  12.695  12.960
  297    HB3  GLU  38           1HB      GLU  38   0.983  13.872  12.199
  298    HG2  GLU  38           2HG      GLU  38  -0.771  15.297  11.672
  299    HG3  GLU  38           1HG      GLU  38  -1.982  14.024  11.835
  300    H    GLY  39           H        GLY  39  -1.193  14.120   9.181
  301    HA2  GLY  39           2HA      GLY  39  -0.622  15.404   7.370
  302    HA3  GLY  39           1HA      GLY  39   0.857  15.739   8.253
  303    H    GLY  40           H        GLY  40   0.091  12.465   7.288
  304    HA2  GLY  40           2HA      GLY  40   2.481  12.417   5.633
  305    HA3  GLY  40           1HA      GLY  40   1.520  11.032   6.124
  306    H    ALA  41           H        ALA  41   2.343  11.005   3.609
  307    HA   ALA  41           HA       ALA  41   0.968  12.298   1.610
  308    HB1  ALA  41           3HB      ALA  41   2.853  10.785   1.218
  309    HB2  ALA  41           1HB      ALA  41   1.481  10.398   0.180
  310    HB3  ALA  41           2HB      ALA  41   1.821   9.405   1.598
  311    H    ALA  42           H        ALA  42  -0.016   9.297   3.279
  312    HA   ALA  42           HA       ALA  42  -2.463   9.048   1.826
  313    HB1  ALA  42           3HB      ALA  42  -3.004   7.363   3.636
  314    HB2  ALA  42           1HB      ALA  42  -1.419   7.726   4.320
  315    HB3  ALA  42           2HB      ALA  42  -1.545   7.051   2.696
  316    H    HIS  43           H        HIS  43  -1.738   9.976   5.196
  317    HA   HIS  43           HA       HIS  43  -4.290  10.571   6.064
  318    HD1  HIS  43           1HD      HIS  43  -2.978  14.144   7.653
  319    HD2  HIS  43           2HD      HIS  43  -4.358  10.614   9.357
  320    HE1  HIS  43           1HE      HIS  43  -4.411  14.853   9.593
  321    HE2  HIS  43           2HE      HIS  43  -5.155  12.698  10.669
  322    HB2  HIS  43           2HB      HIS  43  -2.264  10.489   7.495
  323    HB3  HIS  43           1HB      HIS  43  -1.756  12.035   6.826
  324    H    LYS  44           H        LYS  44  -1.999  12.743   4.425
  325    HA   LYS  44           HA       LYS  44  -3.723  15.014   4.514
  326    HB2  LYS  44           2HB      LYS  44  -1.251  14.404   2.896
  327    HB3  LYS  44           1HB      LYS  44  -2.104  15.939   2.801
  328    HG2  LYS  44           2HG      LYS  44  -1.614  15.347   5.542
  329    HG3  LYS  44           1HG      LYS  44  -0.113  15.142   4.638
  330    HD2  LYS  44           2HD      LYS  44  -0.762  17.422   3.563
  331    HD3  LYS  44           1HD      LYS  44  -1.805  17.587   4.977
  332    HE2  LYS  44           2HE      LYS  44   0.047  17.443   6.461
  333    HE3  LYS  44           1HE      LYS  44   1.131  16.952   5.161
  334    HZ1  LYS  44           3HZ      LYS  44  -0.180  19.607   5.399
  335    HZ2  LYS  44           1HZ      LYS  44   0.876  19.134   4.163
  336    HZ3  LYS  44           2HZ      LYS  44   1.439  19.275   5.752
  337    H    ASP  45           H        ASP  45  -3.046  12.535   2.078
  338    HA   ASP  45           HA       ASP  45  -4.498  13.745  -0.025
  339    HB2  ASP  45           2HB      ASP  45  -2.805  11.933  -0.319
  340    HB3  ASP  45           1HB      ASP  45  -3.957  10.795   0.371
  341    H    GLY  46           H        GLY  46  -5.406  11.110   2.226
  342    HA2  GLY  46           2HA      GLY  46  -7.556  10.978   3.240
  343    HA3  GLY  46           1HA      GLY  46  -8.208  11.935   1.921
  344    H    LYS  47           H        LYS  47  -6.851  10.280  -0.133
  345    HA   LYS  47           HA       LYS  47  -8.921   8.436  -0.601
  346    HB2  LYS  47           2HB      LYS  47  -7.311   9.535  -2.279
  347    HB3  LYS  47           1HB      LYS  47  -6.202   8.233  -1.870
  348    HG2  LYS  47           2HG      LYS  47  -7.250   7.405  -3.739
  349    HG3  LYS  47           1HG      LYS  47  -8.209   6.691  -2.443
  350    HD2  LYS  47           2HD      LYS  47  -9.974   7.528  -3.541
  351    HD3  LYS  47           1HD      LYS  47  -9.482   9.077  -2.857
  352    HE2  LYS  47           2HE      LYS  47  -8.990   9.884  -4.871
  353    HE3  LYS  47           1HE      LYS  47  -7.966   8.496  -5.234
  354    HZ1  LYS  47           3HZ      LYS  47  -9.924   7.273  -5.936
  355    HZ2  LYS  47           1HZ      LYS  47  -9.784   8.712  -6.815
  356    HZ3  LYS  47           2HZ      LYS  47 -10.917   8.590  -5.566
  357    H    LEU  48           H        LEU  48  -5.601   7.942   0.632
  358    HA   LEU  48           HA       LEU  48  -6.121   5.099   0.950
  359    HG   LEU  48           HG       LEU  48  -4.259   3.723   0.937
  360    HB2  LEU  48           2HB      LEU  48  -3.897   6.198   0.184
  361    HB3  LEU  48           1HB      LEU  48  -3.643   6.499   1.893
  362   HD11  LEU  48          1HD1      LEU  48  -1.729   3.417   0.921
  363   HD12  LEU  48          2HD1      LEU  48  -1.635   5.171   0.764
  364   HD13  LEU  48          3HD1      LEU  48  -2.455   4.217  -0.473
  365   HD21  LEU  48          3HD2      LEU  48  -2.312   4.167   3.066
  366   HD22  LEU  48          1HD2      LEU  48  -3.718   3.103   3.009
  367   HD23  LEU  48          2HD2      LEU  48  -3.916   4.805   3.426
  368    H    GLN  49           H        GLN  49  -6.945   4.269   2.715
  369    HA   GLN  49           HA       GLN  49  -6.472   5.539   5.311
  370    HB2  GLN  49           2HB      GLN  49  -8.742   5.357   5.946
  371    HB3  GLN  49           1HB      GLN  49  -8.759   6.090   4.353
  372    HG2  GLN  49           2HG      GLN  49  -9.174   3.147   4.810
  373    HG3  GLN  49           1HG      GLN  49 -10.491   4.316   4.788
  374   HE21  GLN  49          1HE2      GLN  49  -8.406   2.377   2.927
  375   HE22  GLN  49          2HE2      GLN  49  -8.917   2.911   1.367
  376    H    ILE  50           H        ILE  50  -6.280   4.082   7.056
  377    HA   ILE  50           HA       ILE  50  -5.118   1.654   6.718
  378    HB   ILE  50           HB       ILE  50  -5.988   0.980   8.973
  379   HG12  ILE  50          2HG1      ILE  50  -7.079   3.299   9.985
  380   HG13  ILE  50          1HG1      ILE  50  -7.825   3.199   8.393
  381   HG21  ILE  50          1HG2      ILE  50  -3.986   2.075   9.142
  382   HG22  ILE  50          2HG2      ILE  50  -5.016   3.149  10.089
  383   HG23  ILE  50          3HG2      ILE  50  -4.609   3.560   8.423
  384   HD11  ILE  50          3HD1      ILE  50  -8.777   2.002  10.620
  385   HD12  ILE  50          1HD1      ILE  50  -7.831   0.693   9.913
  386   HD13  ILE  50          2HD1      ILE  50  -9.111   1.463   8.975
  387    H    GLY  51           H        GLY  51  -5.733  -0.519   6.452
  388    HA2  GLY  51           2HA      GLY  51  -7.381  -2.241   6.447
  389    HA3  GLY  51           1HA      GLY  51  -8.607  -1.036   6.113
  390    H    ASP  52           H        ASP  52  -6.629   0.149   4.003
  391    HA   ASP  52           HA       ASP  52  -7.708  -1.330   1.839
  392    HB2  ASP  52           2HB      ASP  52  -6.187   0.234   0.473
  393    HB3  ASP  52           1HB      ASP  52  -7.509   0.943   1.385
  394    H    LYS  53           H        LYS  53  -6.536  -2.371   0.161
  395    HA   LYS  53           HA       LYS  53  -4.025  -3.592   1.098
  396    HB2  LYS  53           2HB      LYS  53  -4.649  -5.511  -0.405
  397    HB3  LYS  53           1HB      LYS  53  -5.689  -5.286   0.989
  398    HG2  LYS  53           2HG      LYS  53  -6.497  -3.995  -1.555
  399    HG3  LYS  53           1HG      LYS  53  -6.657  -5.747  -1.423
  400    HD2  LYS  53           2HD      LYS  53  -7.653  -4.234   0.893
  401    HD3  LYS  53           1HD      LYS  53  -8.535  -3.957  -0.609
  402    HE2  LYS  53           2HE      LYS  53  -9.331  -6.085  -0.697
  403    HE3  LYS  53           1HE      LYS  53  -7.906  -6.766   0.085
  404    HZ1  LYS  53           3HZ      LYS  53  -9.978  -5.179   1.497
  405    HZ2  LYS  53           1HZ      LYS  53  -8.686  -6.015   2.198
  406    HZ3  LYS  53           2HZ      LYS  53  -9.941  -6.869   1.455
  407    H    LEU  54           H        LEU  54  -2.402  -3.940  -0.343
  408    HA   LEU  54           HA       LEU  54  -2.411  -2.114  -2.636
  409    HG   LEU  54           HG       LEU  54  -0.883  -0.588  -2.338
  410    HB2  LEU  54           2HB      LEU  54  -0.522  -2.606  -0.675
  411    HB3  LEU  54           1HB      LEU  54   0.144  -3.381  -2.099
  412   HD11  LEU  54          1HD1      LEU  54   0.442   0.067  -0.655
  413   HD12  LEU  54          2HD1      LEU  54   1.742  -0.166  -1.822
  414   HD13  LEU  54          3HD1      LEU  54   1.366  -1.433  -0.655
  415   HD21  LEU  54          3HD2      LEU  54  -0.187  -1.627  -4.361
  416   HD22  LEU  54          1HD2      LEU  54   1.311  -2.197  -3.627
  417   HD23  LEU  54          2HD2      LEU  54   1.067  -0.474  -3.909
  418    H    LEU  55           H        LEU  55  -2.896  -2.868  -4.523
  419    HA   LEU  55           HA       LEU  55  -2.664  -5.659  -5.197
  420    HG   LEU  55           HG       LEU  55  -2.971  -5.500  -8.177
  421    HB2  LEU  55           2HB      LEU  55  -4.549  -4.185  -5.961
  422    HB3  LEU  55           1HB      LEU  55  -3.407  -3.345  -6.992
  423   HD11  LEU  55          1HD1      LEU  55  -5.400  -6.521  -6.727
  424   HD12  LEU  55          2HD1      LEU  55  -3.752  -6.922  -6.250
  425   HD13  LEU  55          3HD1      LEU  55  -4.349  -7.395  -7.841
  426   HD21  LEU  55          3HD2      LEU  55  -5.544  -4.043  -8.162
  427   HD22  LEU  55          1HD2      LEU  55  -5.500  -5.568  -9.048
  428   HD23  LEU  55          2HD2      LEU  55  -4.376  -4.274  -9.462
  429    H    ALA  56           H        ALA  56  -1.249  -2.593  -6.405
  430    HA   ALA  56           HA       ALA  56   1.274  -3.933  -6.879
  431    HB1  ALA  56           3HB      ALA  56  -0.387  -2.941  -9.205
  432    HB2  ALA  56           1HB      ALA  56   0.185  -4.586  -8.927
  433    HB3  ALA  56           2HB      ALA  56   1.335  -3.305  -9.317
  434    H    VAL  57           H        VAL  57   2.997  -2.420  -7.532
  435    HA   VAL  57           HA       VAL  57   2.353   0.414  -7.473
  436    HB   VAL  57           HB       VAL  57   2.561  -0.154  -5.081
  437   HG11  VAL  57          1HG1      VAL  57   4.323  -1.990  -5.637
  438   HG12  VAL  57          2HG1      VAL  57   4.410  -1.116  -4.108
  439   HG13  VAL  57          3HG1      VAL  57   5.477  -0.671  -5.440
  440   HG21  VAL  57          3HG2      VAL  57   3.799   1.718  -4.512
  441   HG22  VAL  57          1HG2      VAL  57   3.379   2.041  -6.194
  442   HG23  VAL  57          2HG2      VAL  57   4.987   1.446  -5.785
  443    H    ASN  58           H        ASN  58   3.567   1.400  -8.952
  444    HA   ASN  58           HA       ASN  58   5.255   1.901 -10.390
  445    HB2  ASN  58           2HB      ASN  58   6.977   0.224  -8.545
  446    HB3  ASN  58           1HB      ASN  58   7.569   1.311  -9.795
  447   HD21  ASN  58          1HD2      ASN  58   6.406   3.591  -9.558
  448   HD22  ASN  58          2HD2      ASN  58   6.521   4.259  -7.969
  449    H    ASN  59           H        ASN  59   3.547  -0.338 -10.830
  450    HA   ASN  59           HA       ASN  59   3.251  -1.770 -12.600
  451    HB2  ASN  59           2HB      ASN  59   6.254  -1.674 -12.941
  452    HB3  ASN  59           1HB      ASN  59   5.144  -2.532 -14.000
  453   HD21  ASN  59          1HD2      ASN  59   3.793  -1.371 -15.374
  454   HD22  ASN  59          2HD2      ASN  59   4.062   0.299 -15.727
  455    H    VAL  60           H        VAL  60   5.221  -2.404  -9.857
  456    HA   VAL  60           HA       VAL  60   5.247  -5.284 -10.322
  457    HB   VAL  60           HB       VAL  60   6.462  -5.485  -8.234
  458   HG11  VAL  60          1HG1      VAL  60   7.994  -5.137  -9.907
  459   HG12  VAL  60          2HG1      VAL  60   8.389  -3.808  -8.816
  460   HG13  VAL  60          3HG1      VAL  60   7.410  -3.510 -10.252
  461   HG21  VAL  60          3HG2      VAL  60   5.196  -3.205  -7.433
  462   HG22  VAL  60          1HG2      VAL  60   6.838  -2.636  -7.728
  463   HG23  VAL  60          2HG2      VAL  60   6.553  -3.964  -6.604
  464    H    CYS  61           H        CYS  61   4.091  -6.796  -9.085
  465    HA   CYS  61           HA       CYS  61   1.652  -5.743  -7.920
  466    HG   CYS  61           HG       CYS  61   3.761  -8.943  -7.939
  467    HB2  CYS  61           2HB      CYS  61   0.924  -8.068  -7.777
  468    HB3  CYS  61           1HB      CYS  61   1.510  -7.688  -9.391
  469    H    LEU  62           H        LEU  62   1.207  -5.556  -5.822
  470    HA   LEU  62           HA       LEU  62   3.211  -6.479  -3.903
  471    HG   LEU  62           HG       LEU  62   3.606  -4.995  -1.955
  472    HB2  LEU  62           2HB      LEU  62   1.996  -3.989  -4.303
  473    HB3  LEU  62           1HB      LEU  62   1.280  -4.620  -2.839
  474   HD11  LEU  62          1HD1      LEU  62   5.423  -3.744  -3.064
  475   HD12  LEU  62          2HD1      LEU  62   4.346  -3.444  -4.427
  476   HD13  LEU  62          3HD1      LEU  62   4.822  -5.093  -4.026
  477   HD21  LEU  62          3HD2      LEU  62   2.170  -2.975  -1.470
  478   HD22  LEU  62          1HD2      LEU  62   3.111  -2.122  -2.692
  479   HD23  LEU  62          2HD2      LEU  62   3.906  -2.758  -1.252
  480    H    GLU  63           H        GLU  63   1.018  -8.121  -5.063
  481    HA   GLU  63           HA       GLU  63  -0.574  -8.638  -2.645
  482    HB2  GLU  63           2HB      GLU  63  -1.618  -8.098  -4.975
  483    HB3  GLU  63           1HB      GLU  63  -1.233  -9.775  -5.338
  484    HG2  GLU  63           2HG      GLU  63  -2.481 -10.211  -3.068
  485    HG3  GLU  63           1HG      GLU  63  -3.213  -8.649  -3.429
  486    H    GLU  64           H        GLU  64   1.819 -10.032  -4.746
  487    HA   GLU  64           HA       GLU  64   1.600 -12.549  -3.244
  488    HB2  GLU  64           2HB      GLU  64   1.577 -12.098  -6.109
  489    HB3  GLU  64           1HB      GLU  64   2.785 -13.273  -5.626
  490    HG2  GLU  64           2HG      GLU  64   0.875 -14.529  -6.079
  491    HG3  GLU  64           1HG      GLU  64   0.924 -14.409  -4.321
  492    H    VAL  65           H        VAL  65   3.186 -10.569  -2.285
  493    HA   VAL  65           HA       VAL  65   5.877 -11.672  -2.742
  494    HB   VAL  65           HB       VAL  65   6.823  -9.358  -2.428
  495   HG11  VAL  65          1HG1      VAL  65   5.159  -9.770  -4.911
  496   HG12  VAL  65          2HG1      VAL  65   6.732 -10.508  -4.607
  497   HG13  VAL  65          3HG1      VAL  65   6.595  -8.757  -4.762
  498   HG21  VAL  65          3HG2      VAL  65   5.378  -7.455  -2.991
  499   HG22  VAL  65          1HG2      VAL  65   4.849  -8.266  -1.517
  500   HG23  VAL  65          2HG2      VAL  65   3.982  -8.531  -3.031
  501    H    THR  66           H        THR  66   7.412 -11.244  -1.018
  502    HA   THR  66           HA       THR  66   6.269 -11.670   1.563
  503    HB   THR  66           HB       THR  66   9.139 -10.875   1.231
  504    HG1  THR  66           1HG      THR  66   9.379 -12.315  -0.265
  505   HG21  THR  66          3HG2      THR  66   8.873 -11.560   3.384
  506   HG22  THR  66          1HG2      THR  66   9.277 -13.097   2.621
  507   HG23  THR  66          2HG2      THR  66   7.595 -12.708   2.981
  508    H    HIS  67           H        HIS  67   7.180 -10.275   3.473
  509    HA   HIS  67           HA       HIS  67   6.047  -7.723   3.202
  510    HD1  HIS  67           1HD      HIS  67   4.776  -7.042   6.261
  511    HD2  HIS  67           2HD      HIS  67   8.607  -5.685   5.435
  512    HE1  HIS  67           1HE      HIS  67   4.813  -4.644   6.985
  513    HE2  HIS  67           2HE      HIS  67   7.082  -3.805   6.320
  514    HB2  HIS  67           2HB      HIS  67   6.221  -8.842   5.386
  515    HB3  HIS  67           1HB      HIS  67   7.957  -8.569   5.400
  516    H    GLU  68           H        GLU  68   9.434  -8.740   3.004
  517    HA   GLU  68           HA       GLU  68  10.681  -6.277   2.993
  518    HB2  GLU  68           2HB      GLU  68  11.370  -8.688   1.297
  519    HB3  GLU  68           1HB      GLU  68  12.438  -7.324   1.595
  520    HG2  GLU  68           2HG      GLU  68  11.331  -9.066   3.780
  521    HG3  GLU  68           1HG      GLU  68  12.872  -9.365   2.979
  522    H    GLU  69           H        GLU  69   9.181  -7.980   0.256
  523    HA   GLU  69           HA       GLU  69   9.802  -6.062  -1.716
  524    HB2  GLU  69           2HB      GLU  69   7.548  -8.064  -1.561
  525    HB3  GLU  69           1HB      GLU  69   7.910  -7.106  -2.990
  526    HG2  GLU  69           2HG      GLU  69   9.754  -9.095  -1.685
  527    HG3  GLU  69           1HG      GLU  69   8.825  -9.352  -3.161
  528    H    ALA  70           H        ALA  70   7.136  -6.324   0.574
  529    HA   ALA  70           HA       ALA  70   5.410  -4.376  -0.504
  530    HB1  ALA  70           3HB      ALA  70   5.795  -4.982   2.426
  531    HB2  ALA  70           1HB      ALA  70   4.874  -6.009   1.328
  532    HB3  ALA  70           2HB      ALA  70   4.350  -4.354   1.635
  533    H    VAL  71           H        VAL  71   8.121  -4.154   1.750
  534    HA   VAL  71           HA       VAL  71   7.835  -1.310   2.125
  535    HB   VAL  71           HB       VAL  71   9.905  -3.304   3.033
  536   HG11  VAL  71          1HG1      VAL  71  11.310  -1.504   2.915
  537   HG12  VAL  71          2HG1      VAL  71  10.595  -1.220   4.502
  538   HG13  VAL  71          3HG1      VAL  71  10.006  -0.331   3.097
  539   HG21  VAL  71          3HG2      VAL  71   8.222  -1.576   4.794
  540   HG22  VAL  71          1HG2      VAL  71   8.931  -3.157   5.120
  541   HG23  VAL  71          2HG2      VAL  71   7.529  -3.020   4.059
  542    H    THR  72           H        THR  72   9.909  -3.462   0.244
  543    HA   THR  72           HA       THR  72  11.763  -1.538  -0.625
  544    HB   THR  72           HB       THR  72  10.875  -4.122  -1.916
  545    HG1  THR  72           1HG      THR  72  13.063  -3.453  -0.241
  546   HG21  THR  72          3HG2      THR  72  13.260  -2.398  -2.548
  547   HG22  THR  72          1HG2      THR  72  11.939  -2.835  -3.633
  548   HG23  THR  72          2HG2      THR  72  13.066  -4.071  -3.072
  549    H    ALA  73           H        ALA  73   8.594  -2.481  -1.862
  550    HA   ALA  73           HA       ALA  73   8.836  -0.980  -4.288
  551    HB1  ALA  73           3HB      ALA  73   7.338  -3.074  -3.669
  552    HB2  ALA  73           1HB      ALA  73   6.842  -1.899  -4.886
  553    HB3  ALA  73           2HB      ALA  73   6.181  -1.808  -3.254
  554    H    LEU  74           H        LEU  74   7.413  -0.463  -1.077
  555    HA   LEU  74           HA       LEU  74   6.048   1.955  -1.761
  556    HG   LEU  74           HG       LEU  74   4.494   0.772   1.356
  557    HB2  LEU  74           2HB      LEU  74   6.761   0.483   0.720
  558    HB3  LEU  74           1HB      LEU  74   6.438   2.195   0.884
  559   HD11  LEU  74          1HD1      LEU  74   4.186   2.564  -1.044
  560   HD12  LEU  74          2HD1      LEU  74   4.176   3.074   0.644
  561   HD13  LEU  74          3HD1      LEU  74   2.884   2.046   0.027
  562   HD21  LEU  74          3HD2      LEU  74   3.485   0.095  -1.114
  563   HD22  LEU  74          1HD2      LEU  74   4.188  -1.014   0.064
  564   HD23  LEU  74          2HD2      LEU  74   5.186  -0.352  -1.229
  565    H    LYS  75           H        LYS  75   9.213   1.066  -0.598
  566    HA   LYS  75           HA       LYS  75  10.052   3.781  -0.069
  567    HB2  LYS  75           2HB      LYS  75  12.115   2.905   0.617
  568    HB3  LYS  75           1HB      LYS  75  10.940   1.690   1.093
  569    HG2  LYS  75           2HG      LYS  75  11.582   0.241  -0.647
  570    HG3  LYS  75           1HG      LYS  75  12.486   1.508  -1.476
  571    HD2  LYS  75           2HD      LYS  75  14.141   0.216  -0.448
  572    HD3  LYS  75           1HD      LYS  75  13.934   1.588   0.642
  573    HE2  LYS  75           2HE      LYS  75  12.716   0.307   2.195
  574    HE3  LYS  75           1HE      LYS  75  12.443  -0.991   1.033
  575    HZ1  LYS  75           3HZ      LYS  75  14.792  -1.523   1.114
  576    HZ2  LYS  75           1HZ      LYS  75  14.128  -1.578   2.670
  577    HZ3  LYS  75           2HZ      LYS  75  15.075  -0.258   2.200
  578    H    ASN  76           H        ASN  76   9.980   1.755  -2.868
  579    HA   ASN  76           HA       ASN  76  12.109   3.085  -4.269
  580    HB2  ASN  76           2HB      ASN  76  11.230   0.689  -4.645
  581    HB3  ASN  76           1HB      ASN  76   9.944   1.450  -5.576
  582   HD21  ASN  76          1HD2      ASN  76  10.336   2.056  -7.624
  583   HD22  ASN  76          2HD2      ASN  76  11.873   1.944  -8.403
  584    H    THR  77           H        THR  77  10.993   5.232  -3.600
  585    HA   THR  77           HA       THR  77   9.314   6.109  -5.857
  586    HB   THR  77           HB       THR  77   8.368   7.817  -4.196
  587    HG1  THR  77           1HG      THR  77   8.536   7.309  -2.048
  588   HG21  THR  77          3HG2      THR  77   6.590   6.481  -3.595
  589   HG22  THR  77          1HG2      THR  77   7.599   5.050  -3.385
  590   HG23  THR  77          2HG2      THR  77   7.237   5.644  -5.006
  591    H    SER  78           H        SER  78   9.809   8.057  -6.797
  592    HA   SER  78           HA       SER  78  12.161   9.481  -5.729
  593    HG   SER  78           HG       SER  78  13.288   7.469  -8.319
  594    HB2  SER  78           2HB      SER  78  11.572   8.672  -8.575
  595    HB3  SER  78           1HB      SER  78  12.715   9.957  -8.187
  596    H    ASP  79           H        ASP  79  10.005  10.093  -8.502
  597    HA   ASP  79           HA       ASP  79   9.488  12.770  -7.402
  598    HB2  ASP  79           2HB      ASP  79   9.176  11.754 -10.239
  599    HB3  ASP  79           1HB      ASP  79   8.873  13.405  -9.705
  600    H    PHE  80           H        PHE  80   7.832  10.167  -9.182
  601    HA   PHE  80           HA       PHE  80   5.355  10.864  -7.748
  602    HD1  PHE  80           1HD      PHE  80   5.546  13.203  -9.743
  603    HD2  PHE  80           2HD      PHE  80   2.426  10.309  -9.804
  604    HE1  PHE  80           1HE      PHE  80   3.877  15.006  -9.624
  605    HE2  PHE  80           2HE      PHE  80   0.751  12.108  -9.684
  606    HZ   PHE  80           HZ       PHE  80   1.476  14.460  -9.594
  607    HB2  PHE  80           2HB      PHE  80   5.849  10.810 -10.597
  608    HB3  PHE  80           1HB      PHE  80   4.613   9.634 -10.167
  609    H    VAL  81           H        VAL  81   3.793   8.998  -7.621
  610    HA   VAL  81           HA       VAL  81   5.056   6.379  -7.861
  611    HB   VAL  81           HB       VAL  81   5.550   7.016  -5.565
  612   HG11  VAL  81          1HG1      VAL  81   3.550   8.618  -5.444
  613   HG12  VAL  81          2HG1      VAL  81   3.986   7.728  -3.987
  614   HG13  VAL  81          3HG1      VAL  81   2.617   7.201  -4.965
  615   HG21  VAL  81          3HG2      VAL  81   4.666   5.108  -4.444
  616   HG22  VAL  81          1HG2      VAL  81   4.897   4.666  -6.135
  617   HG23  VAL  81          2HG2      VAL  81   3.280   5.036  -5.534
  618    H    TYR  82           H        TYR  82   3.676   5.095  -8.936
  619    HA   TYR  82           HA       TYR  82   0.825   5.763  -8.896
  620    HD1  TYR  82           1HD      TYR  82   0.485   2.207 -10.684
  621    HD2  TYR  82           2HD      TYR  82  -0.196   6.266 -11.756
  622    HE1  TYR  82           1HE      TYR  82  -1.659   1.575 -11.684
  623    HE2  TYR  82           2HE      TYR  82  -2.352   5.643 -12.759
  624    HH   TYR  82           HH       TYR  82  -3.212   3.015 -13.779
  625    HB2  TYR  82           2HB      TYR  82   2.016   5.501 -11.081
  626    HB3  TYR  82           1HB      TYR  82   2.290   3.812 -10.670
  627    H    LEU  83           H        LEU  83   0.014   4.904  -7.102
  628    HA   LEU  83           HA       LEU  83   0.635   2.188  -6.295
  629    HG   LEU  83           HG       LEU  83  -0.893   1.496  -4.344
  630    HB2  LEU  83           2HB      LEU  83   0.428   4.086  -4.679
  631    HB3  LEU  83           1HB      LEU  83  -1.287   4.138  -5.034
  632   HD11  LEU  83          1HD1      LEU  83   1.307   1.750  -3.537
  633   HD12  LEU  83          2HD1      LEU  83   0.273   1.728  -2.109
  634   HD13  LEU  83          3HD1      LEU  83   0.915   3.257  -2.709
  635   HD21  LEU  83          3HD2      LEU  83  -2.754   2.962  -3.702
  636   HD22  LEU  83          1HD2      LEU  83  -1.700   3.781  -2.549
  637   HD23  LEU  83          2HD2      LEU  83  -2.102   2.079  -2.322
  638    H    LYS  84           H        LYS  84  -0.674   0.462  -6.382
  639    HA   LYS  84           HA       LYS  84  -3.320   0.790  -7.621
  640    HB2  LYS  84           2HB      LYS  84  -1.109  -1.057  -8.257
  641    HB3  LYS  84           1HB      LYS  84  -2.713  -1.769  -8.230
  642    HG2  LYS  84           2HG      LYS  84  -1.995   0.669  -9.838
  643    HG3  LYS  84           1HG      LYS  84  -1.945  -0.978 -10.467
  644    HD2  LYS  84           2HD      LYS  84  -4.367   0.479  -9.411
  645    HD3  LYS  84           1HD      LYS  84  -4.033   0.070 -11.094
  646    HE2  LYS  84           2HE      LYS  84  -3.878  -2.375 -10.057
  647    HE3  LYS  84           1HE      LYS  84  -4.946  -1.655  -8.855
  648    HZ1  LYS  84           3HZ      LYS  84  -5.682  -2.688 -11.282
  649    HZ2  LYS  84           1HZ      LYS  84  -5.768  -1.014 -11.510
  650    HZ3  LYS  84           2HZ      LYS  84  -6.644  -1.743 -10.261
  651    H    VAL  85           H        VAL  85  -5.015   0.035  -6.482
  652    HA   VAL  85           HA       VAL  85  -4.487  -1.965  -4.401
  653    HB   VAL  85           HB       VAL  85  -6.043  -0.796  -2.878
  654   HG11  VAL  85          1HG1      VAL  85  -3.501  -0.452  -2.934
  655   HG12  VAL  85          2HG1      VAL  85  -4.473   0.704  -2.023
  656   HG13  VAL  85          3HG1      VAL  85  -3.868   1.130  -3.624
  657   HG21  VAL  85          3HG2      VAL  85  -6.632   1.553  -3.306
  658   HG22  VAL  85          1HG2      VAL  85  -7.340   0.465  -4.501
  659   HG23  VAL  85          2HG2      VAL  85  -5.921   1.427  -4.915
  660    H    ALA  86           H        ALA  86  -5.985  -3.542  -4.220
  661    HA   ALA  86           HA       ALA  86  -8.247  -3.446  -6.091
  662    HB1  ALA  86           3HB      ALA  86  -6.960  -5.345  -6.540
  663    HB2  ALA  86           1HB      ALA  86  -8.309  -5.958  -5.584
  664    HB3  ALA  86           2HB      ALA  86  -6.733  -5.711  -4.830
  665    H    LYS  87           H        LYS  87 -10.330  -4.237  -5.422
  666    HA   LYS  87           HA       LYS  87 -10.867  -3.659  -2.596
  667    HB2  LYS  87           2HB      LYS  87 -12.693  -3.708  -5.003
  668    HB3  LYS  87           1HB      LYS  87 -13.250  -3.456  -3.355
  669    HG2  LYS  87           2HG      LYS  87 -12.974  -1.285  -3.738
  670    HG3  LYS  87           1HG      LYS  87 -11.239  -1.590  -3.637
  671    HD2  LYS  87           2HD      LYS  87 -11.566  -0.430  -5.667
  672    HD3  LYS  87           1HD      LYS  87 -11.330  -2.120  -6.116
  673    HE2  LYS  87           2HE      LYS  87 -13.616  -2.432  -6.564
  674    HE3  LYS  87           1HE      LYS  87 -14.071  -0.958  -5.710
  675    HZ1  LYS  87           3HZ      LYS  87 -14.163  -0.749  -8.148
  676    HZ2  LYS  87           1HZ      LYS  87 -12.494  -1.019  -8.227
  677    HZ3  LYS  87           2HZ      LYS  87 -13.094   0.355  -7.442
  678    HA   PRO  88           HA       PRO  88 -11.661  -7.959  -1.840
  679    HB2  PRO  88           2HB      PRO  88 -13.087  -7.734   0.456
  680    HB3  PRO  88           1HB      PRO  88 -11.340  -7.489   0.385
  681    HG2  PRO  88           2HG      PRO  88 -13.537  -5.459   0.429
  682    HG3  PRO  88           1HG      PRO  88 -11.986  -5.449   1.287
  683    HD2  PRO  88           2HD      PRO  88 -12.430  -4.024  -0.983
  684    HD3  PRO  88           1HD      PRO  88 -10.835  -4.669  -0.545
  685    H    THR  89           H        THR  89 -13.386  -9.503  -1.782
  686    HA   THR  89           HA       THR  89 -16.097  -8.529  -2.222
  687    HB   THR  89           HB       THR  89 -16.238 -10.166  -4.231
  688    HG1  THR  89           1HG      THR  89 -14.437 -10.914  -4.988
  689   HG21  THR  89          3HG2      THR  89 -15.684  -8.491  -5.825
  690   HG22  THR  89          1HG2      THR  89 -14.642  -7.659  -4.671
  691   HG23  THR  89          2HG2      THR  89 -16.387  -7.691  -4.419
  692    H    GLY  90           H        GLY  90 -14.508 -11.674  -2.833
  693    HA2  GLY  90           2HA      GLY  90 -14.547 -13.486  -1.251
  694    HA3  GLY  90           1HA      GLY  90 -15.996 -12.787  -0.545
  695    H    SER  91           H        SER  91 -15.151 -15.443  -1.950
  696    HA   SER  91           HA       SER  91 -16.997 -15.630  -4.153
  697    HG   SER  91           HG       SER  91 -15.790 -18.616  -2.138
  698    HB2  SER  91           2HB      SER  91 -16.377 -18.057  -4.117
  699    HB3  SER  91           1HB      SER  91 -14.993 -16.973  -4.242
  700    H    HIS  92           H        HIS  92 -16.976 -16.567  -0.753
  701    HA   HIS  92           HA       HIS  92 -19.237 -18.211  -0.718
  702    HD1  HIS  92           1HD      HIS  92 -16.080 -15.951   1.150
  703    HD2  HIS  92           2HD      HIS  92 -19.856 -15.215   2.723
  704    HE1  HIS  92           1HE      HIS  92 -15.894 -13.743   2.340
  705    HE2  HIS  92           2HE      HIS  92 -18.172 -13.351   3.340
  706    HB2  HIS  92           2HB      HIS  92 -19.344 -17.737   1.684
  707    HB3  HIS  92           1HB      HIS  92 -17.684 -18.026   1.177
  708    HA   ARG 301           HA       ARG 301   2.251 -10.764  10.456
  709    HE   ARG 301           HE       ARG 301   0.111 -11.498  14.690
  710    H1   ARG 301           1HT      ARG 301   3.656 -12.164  11.859
  711    H2   ARG 301           2HT      ARG 301   1.989 -12.568  11.895
  712    H3   ARG 301           3HT      ARG 301   2.695 -11.714  13.206
  713    HB2  ARG 301           2HB      ARG 301   1.147 -10.028  13.172
  714    HB3  ARG 301           1HB      ARG 301   0.921  -9.032  11.742
  715    HG2  ARG 301           2HG      ARG 301  -0.757 -10.294  11.023
  716    HG3  ARG 301           1HG      ARG 301   0.169 -11.779  11.244
  717    HD2  ARG 301           2HD      ARG 301  -1.337 -10.287  13.390
  718    HD3  ARG 301           1HD      ARG 301  -1.860 -11.778  12.608
  719   HH11  ARG 301          1HH1      ARG 301  -1.049 -13.548  12.096
  720   HH12  ARG 301          2HH1      ARG 301  -0.366 -14.989  12.767
  721   HH21  ARG 301          1HH2      ARG 301   1.007 -13.399  15.565
  722   HH22  ARG 301          2HH2      ARG 301   0.799 -14.906  14.736
  723    H    ARG 302           H        ARG 302   3.517  -9.149   9.741
  724    HA   ARG 302           HA       ARG 302   5.234  -7.754  11.689
  725    HE   ARG 302           HE       ARG 302   8.621  -9.007  11.296
  726    HB2  ARG 302           2HB      ARG 302   6.636  -9.275  10.448
  727    HB3  ARG 302           1HB      ARG 302   5.954  -8.732   8.924
  728    HG2  ARG 302           2HG      ARG 302   8.123  -7.776   9.157
  729    HG3  ARG 302           1HG      ARG 302   6.933  -6.490   9.341
  730    HD2  ARG 302           2HD      ARG 302   8.625  -6.189  11.004
  731    HD3  ARG 302           1HD      ARG 302   7.153  -6.725  11.810
  732   HH11  ARG 302          1HH1      ARG 302   9.074  -6.060  13.136
  733   HH12  ARG 302          2HH1      ARG 302  10.113  -6.804  14.303
  734   HH21  ARG 302          1HH2      ARG 302   9.991  -9.980  12.838
  735   HH22  ARG 302          2HH2      ARG 302  10.634  -9.029  14.134
  736    H    GLU 303           H        GLU 303   5.116  -5.612  11.667
  737    HA   GLU 303           HA       GLU 303   3.951  -4.278   9.309
  738    HB2  GLU 303           2HB      GLU 303   3.532  -3.544  12.217
  739    HB3  GLU 303           1HB      GLU 303   2.897  -2.659  10.838
  740    HG2  GLU 303           2HG      GLU 303   1.071  -3.883  11.459
  741    HG3  GLU 303           1HG      GLU 303   1.786  -4.942  10.245
  742    H    THR 304           H        THR 304   5.330  -2.893   8.391
  743    HA   THR 304           HA       THR 304   7.270  -1.517  10.109
  744    HB   THR 304           HB       THR 304   7.806  -3.382   7.975
  745    HG1  THR 304           1HG      THR 304   9.048  -3.645   9.677
  746   HG21  THR 304          3HG2      THR 304   9.176  -0.724   7.691
  747   HG22  THR 304          1HG2      THR 304   8.026  -1.416   6.548
  748   HG23  THR 304          2HG2      THR 304   9.574  -2.211   6.830
  749    H    GLN 305           H        GLN 305   7.842   0.578   9.546
  750    HA   GLN 305           HA       GLN 305   5.862   2.020   8.050
  751    HB2  GLN 305           2HB      GLN 305   8.210   2.742   9.727
  752    HB3  GLN 305           1HB      GLN 305   7.661   3.926   8.548
  753    HG2  GLN 305           2HG      GLN 305   5.563   4.136   9.565
  754    HG3  GLN 305           1HG      GLN 305   5.774   2.656  10.500
  755   HE21  GLN 305          1HE2      GLN 305   7.365   5.806  10.033
  756   HE22  GLN 305          2HE2      GLN 305   7.708   6.066  11.706
  757    H    VAL 306           H        VAL 306   6.227   3.377   6.252
  758    HA   VAL 306           HA       VAL 306   8.674   3.000   4.713
  759    HB   VAL 306           HB       VAL 306   7.356   2.456   2.648
  760   HG11  VAL 306          1HG1      VAL 306   7.223   0.095   3.103
  761   HG12  VAL 306          2HG1      VAL 306   7.147   0.392   4.839
  762   HG13  VAL 306          3HG1      VAL 306   8.620   0.764   3.945
  763   HG21  VAL 306          3HG2      VAL 306   5.117   1.240   3.310
  764   HG22  VAL 306          1HG2      VAL 306   5.150   2.978   3.010
  765   HG23  VAL 306          2HG2      VAL 306   5.161   2.369   4.664
  Start of MODEL   12
    1    HA   MET   1           HA       MET   1  -8.969   2.363  -9.116
    2    H1   MET   1           1HT      MET   1  -8.166  -0.301  -8.148
    3    H2   MET   1           2HT      MET   1  -8.119   0.238  -9.777
    4    H3   MET   1           3HT      MET   1  -9.622   0.098  -8.961
    5    HB2  MET   1           2HB      MET   1 -10.002   1.139  -7.002
    6    HB3  MET   1           1HB      MET   1  -8.492   1.640  -6.255
    7    HG2  MET   1           2HG      MET   1  -9.804   3.419  -5.734
    8    HG3  MET   1           1HG      MET   1  -9.139   3.973  -7.269
    9    HE1  MET   1           3HE      MET   1 -12.968   4.656  -6.107
   10    HE2  MET   1           1HE      MET   1 -11.681   3.931  -5.144
   11    HE3  MET   1           2HE      MET   1 -13.012   2.934  -5.731
   12    H    GLU   2           H        GLU   2  -7.403   3.877  -9.177
   13    HA   GLU   2           HA       GLU   2  -4.754   3.191  -8.088
   14    HB2  GLU   2           2HB      GLU   2  -3.702   4.214 -10.040
   15    HB3  GLU   2           1HB      GLU   2  -4.745   2.883 -10.519
   16    HG2  GLU   2           2HG      GLU   2  -5.855   5.643 -10.536
   17    HG3  GLU   2           1HG      GLU   2  -4.751   5.160 -11.821
   18    H    ILE   3           H        ILE   3  -3.351   5.066  -7.658
   19    HA   ILE   3           HA       ILE   3  -4.734   7.621  -7.354
   20    HB   ILE   3           HB       ILE   3  -3.207   6.221  -5.144
   21   HG12  ILE   3          2HG1      ILE   3  -5.616   6.901  -4.080
   22   HG13  ILE   3          1HG1      ILE   3  -6.082   6.567  -5.745
   23   HG21  ILE   3          1HG2      ILE   3  -3.821   8.221  -3.795
   24   HG22  ILE   3          2HG2      ILE   3  -4.364   8.995  -5.285
   25   HG23  ILE   3          3HG2      ILE   3  -2.670   8.544  -5.092
   26   HD11  ILE   3          3HD1      ILE   3  -4.846   4.717  -3.741
   27   HD12  ILE   3          1HD1      ILE   3  -4.830   4.364  -5.468
   28   HD13  ILE   3          2HD1      ILE   3  -6.365   4.545  -4.621
   29    H    LYS   4           H        LYS   4  -3.372   9.373  -7.750
   30    HA   LYS   4           HA       LYS   4  -0.593   8.671  -8.413
   31    HB2  LYS   4           2HB      LYS   4  -2.554  10.582  -9.565
   32    HB3  LYS   4           1HB      LYS   4  -0.867  11.076  -9.563
   33    HG2  LYS   4           2HG      LYS   4  -0.568   8.622 -10.555
   34    HG3  LYS   4           1HG      LYS   4  -2.219   8.936 -11.090
   35    HD2  LYS   4           2HD      LYS   4  -1.575  10.769 -12.388
   36    HD3  LYS   4           1HD      LYS   4  -0.037  10.943 -11.542
   37    HE2  LYS   4           2HE      LYS   4   0.541  10.009 -13.610
   38    HE3  LYS   4           1HE      LYS   4   0.545   8.644 -12.494
   39    HZ1  LYS   4           3HZ      LYS   4  -0.568   8.036 -14.516
   40    HZ2  LYS   4           1HZ      LYS   4  -1.619   9.357 -14.400
   41    HZ3  LYS   4           2HZ      LYS   4  -1.711   8.102 -13.270
   42    H    LEU   5           H        LEU   5   0.277   8.857  -6.420
   43    HA   LEU   5           HA       LEU   5  -0.007  11.323  -4.909
   44    HG   LEU   5           HG       LEU   5  -1.029   9.843  -3.216
   45    HB2  LEU   5           2HB      LEU   5   0.889   8.619  -4.346
   46    HB3  LEU   5           1HB      LEU   5   1.955   9.821  -3.643
   47   HD11  LEU   5          1HD1      LEU   5  -0.160   7.738  -2.374
   48   HD12  LEU   5          2HD1      LEU   5  -0.593   8.808  -1.040
   49   HD13  LEU   5          3HD1      LEU   5   1.100   8.594  -1.486
   50   HD21  LEU   5          3HD2      LEU   5   0.077  11.960  -2.801
   51   HD22  LEU   5          1HD2      LEU   5   1.263  11.164  -1.768
   52   HD23  LEU   5          2HD2      LEU   5  -0.429  11.231  -1.277
   53    H    ILE   6           H        ILE   6   1.363  12.949  -4.770
   54    HA   ILE   6           HA       ILE   6   3.648  13.001  -6.557
   55    HB   ILE   6           HB       ILE   6   2.124  15.062  -4.988
   56   HG12  ILE   6          2HG1      ILE   6   2.482  16.143  -7.400
   57   HG13  ILE   6          1HG1      ILE   6   2.713  14.454  -7.831
   58   HG21  ILE   6          1HG2      ILE   6   3.679  16.800  -5.327
   59   HG22  ILE   6          2HG2      ILE   6   4.719  15.797  -6.335
   60   HG23  ILE   6          3HG2      ILE   6   4.594  15.481  -4.602
   61   HD11  ILE   6          3HD1      ILE   6   0.314  15.415  -6.309
   62   HD12  ILE   6          1HD1      ILE   6   0.536  13.880  -7.148
   63   HD13  ILE   6          2HD1      ILE   6   0.379  15.376  -8.071
   64    H    LYS   7           H        LYS   7   5.627  12.430  -5.861
   65    HA   LYS   7           HA       LYS   7   6.274  11.905  -3.174
   66    HB2  LYS   7           2HB      LYS   7   7.388  10.909  -5.199
   67    HB3  LYS   7           1HB      LYS   7   8.237  12.434  -5.401
   68    HG2  LYS   7           2HG      LYS   7   9.782  11.150  -4.273
   69    HG3  LYS   7           1HG      LYS   7   9.016  12.051  -2.963
   70    HD2  LYS   7           2HD      LYS   7   7.407   9.901  -3.038
   71    HD3  LYS   7           1HD      LYS   7   8.905   9.169  -3.614
   72    HE2  LYS   7           2HE      LYS   7  10.070   9.797  -1.642
   73    HE3  LYS   7           1HE      LYS   7   8.753  10.844  -1.119
   74    HZ1  LYS   7           3HZ      LYS   7   7.437   9.037  -0.546
   75    HZ2  LYS   7           1HZ      LYS   7   8.979   8.557  -0.036
   76    HZ3  LYS   7           2HZ      LYS   7   8.334   7.943  -1.475
   77    H    GLY   8           H        GLY   8   6.406  13.386  -1.624
   78    HA2  GLY   8           2HA      GLY   8   7.427  16.063  -2.260
   79    HA3  GLY   8           1HA      GLY   8   6.529  15.617  -0.817
   80    HA   PRO   9           HA       PRO   9  11.170  15.657   0.052
   81    HB2  PRO   9           2HB      PRO   9  10.789  18.067   1.632
   82    HB3  PRO   9           1HB      PRO   9  11.832  17.816   0.231
   83    HG2  PRO   9           2HG      PRO   9   9.630  19.411   0.180
   84    HG3  PRO   9           1HG      PRO   9  10.240  18.554  -1.246
   85    HD2  PRO   9           2HD      PRO   9   7.980  17.818   0.584
   86    HD3  PRO   9           1HD      PRO   9   8.060  17.747  -1.191
   87    H    LYS  10           H        LYS  10   9.587  13.925   1.240
   88    HA   LYS  10           HA       LYS  10  10.393  13.997   3.992
   89    HB2  LYS  10           2HB      LYS  10   7.683  14.781   3.252
   90    HB3  LYS  10           1HB      LYS  10   7.697  13.406   4.348
   91    HG2  LYS  10           2HG      LYS  10   8.447  14.625   6.089
   92    HG3  LYS  10           1HG      LYS  10   9.461  15.652   5.076
   93    HD2  LYS  10           2HD      LYS  10   7.810  17.166   4.726
   94    HD3  LYS  10           1HD      LYS  10   6.541  15.941   4.720
   95    HE2  LYS  10           2HE      LYS  10   6.797  15.755   7.189
   96    HE3  LYS  10           1HE      LYS  10   7.939  17.097   7.130
   97    HZ1  LYS  10           3HZ      LYS  10   5.672  17.792   7.712
   98    HZ2  LYS  10           1HZ      LYS  10   5.117  17.240   6.211
   99    HZ3  LYS  10           2HZ      LYS  10   6.216  18.524   6.288
  100    H    GLY  11           H        GLY  11   7.789  12.383   2.134
  101    HA2  GLY  11           2HA      GLY  11   8.838  10.072   1.338
  102    HA3  GLY  11           1HA      GLY  11   8.748   9.792   3.070
  103    H    LEU  12           H        LEU  12   7.227   8.179   3.023
  104    HA   LEU  12           HA       LEU  12   4.711   8.601   1.632
  105    HG   LEU  12           HG       LEU  12   5.877   6.884   0.426
  106    HB2  LEU  12           2HB      LEU  12   5.713   6.295   3.298
  107    HB3  LEU  12           1HB      LEU  12   4.158   6.326   2.494
  108   HD11  LEU  12          1HD1      LEU  12   7.774   6.385   1.998
  109   HD12  LEU  12          2HD1      LEU  12   7.739   5.421   0.522
  110   HD13  LEU  12          3HD1      LEU  12   7.196   4.719   2.045
  111   HD21  LEU  12          3HD2      LEU  12   4.014   5.357   0.303
  112   HD22  LEU  12          1HD2      LEU  12   4.838   4.215   1.364
  113   HD23  LEU  12          2HD2      LEU  12   5.479   4.542  -0.246
  114    H    GLY  13           H        GLY  13   5.780   8.078   5.003
  115    HA2  GLY  13           2HA      GLY  13   4.952   9.107   6.915
  116    HA3  GLY  13           1HA      GLY  13   3.699   9.856   5.945
  117    H    PHE  14           H        PHE  14   4.368   6.383   6.115
  118    HA   PHE  14           HA       PHE  14   2.304   5.847   8.007
  119    HD1  PHE  14           2HD      PHE  14   2.339   3.098   5.110
  120    HD2  PHE  14           1HD      PHE  14   1.127   6.999   3.919
  121    HE1  PHE  14           2HE      PHE  14   2.803   2.519   2.769
  122    HE2  PHE  14           1HE      PHE  14   1.582   6.426   1.572
  123    HZ   PHE  14           HZ       PHE  14   2.419   4.185   0.993
  124    HB2  PHE  14           2HB      PHE  14   0.761   4.658   6.503
  125    HB3  PHE  14           1HB      PHE  14   0.860   6.368   6.116
  126    H    SER  15           H        SER  15   1.704   3.240   7.556
  127    HA   SER  15           HA       SER  15   4.289   1.904   7.199
  128    HG   SER  15           HG       SER  15   2.381   2.784   9.974
  129    HB2  SER  15           2HB      SER  15   3.184   0.272   9.003
  130    HB3  SER  15           1HB      SER  15   4.183   1.639   9.480
  131    H    ILE  16           H        ILE  16   3.884  -0.569   6.990
  132    HA   ILE  16           HA       ILE  16   1.335  -1.275   5.806
  133    HB   ILE  16           HB       ILE  16   1.943  -1.638   3.634
  134   HG12  ILE  16          2HG1      ILE  16   3.945  -3.044   4.242
  135   HG13  ILE  16          1HG1      ILE  16   4.081  -2.134   2.745
  136   HG21  ILE  16          1HG2      ILE  16   1.997   0.732   3.905
  137   HG22  ILE  16          2HG2      ILE  16   3.249   0.267   2.754
  138   HG23  ILE  16          3HG2      ILE  16   3.686   0.678   4.412
  139   HD11  ILE  16          3HD1      ILE  16   5.084  -0.655   5.007
  140   HD12  ILE  16          1HD1      ILE  16   5.855  -1.041   3.469
  141   HD13  ILE  16          2HD1      ILE  16   5.908  -2.205   4.799
  142    H    ALA  17           H        ALA  17   1.404  -3.551   5.002
  143    HA   ALA  17           HA       ALA  17   3.369  -5.255   6.347
  144    HB1  ALA  17           3HB      ALA  17   1.319  -6.779   6.848
  145    HB2  ALA  17           1HB      ALA  17   0.394  -5.283   6.713
  146    HB3  ALA  17           2HB      ALA  17   1.665  -5.426   7.925
  147    H    GLY  18           H        GLY  18   3.123  -7.594   5.367
  148    HA2  GLY  18           2HA      GLY  18   1.683  -8.165   3.122
  149    HA3  GLY  18           1HA      GLY  18   3.023  -7.235   2.501
  150    H    GLY  19           H        GLY  19   1.977 -10.334   2.718
  151    HA2  GLY  19           2HA      GLY  19   3.456 -12.004   1.820
  152    HA3  GLY  19           1HA      GLY  19   4.768 -11.273   2.718
  153    H    VAL  20           H        VAL  20   4.081 -14.024   2.629
  154    HA   VAL  20           HA       VAL  20   2.646 -14.883   4.901
  155    HB   VAL  20           HB       VAL  20   3.861 -17.047   4.612
  156   HG11  VAL  20          1HG1      VAL  20   1.814 -16.754   3.425
  157   HG12  VAL  20          2HG1      VAL  20   2.964 -17.513   2.324
  158   HG13  VAL  20          3HG1      VAL  20   2.609 -15.792   2.178
  159   HG21  VAL  20          3HG2      VAL  20   5.400 -17.366   2.794
  160   HG22  VAL  20          1HG2      VAL  20   5.992 -16.048   3.806
  161   HG23  VAL  20          2HG2      VAL  20   5.198 -15.694   2.271
  162    H    GLY  21           H        GLY  21   3.407 -15.683   6.914
  163    HA2  GLY  21           2HA      GLY  21   4.893 -15.896   8.703
  164    HA3  GLY  21           1HA      GLY  21   6.175 -15.267   7.679
  165    H    ASN  22           H        ASN  22   4.244 -12.963   7.021
  166    HA   ASN  22           HA       ASN  22   4.350 -11.473   9.538
  167    HB2  ASN  22           2HB      ASN  22   5.380  -9.559   8.490
  168    HB3  ASN  22           1HB      ASN  22   6.409 -10.940   8.132
  169   HD21  ASN  22          1HD2      ASN  22   4.298  -8.552   6.880
  170   HD22  ASN  22          2HD2      ASN  22   4.596  -8.877   5.216
  171    H    GLN  23           H        GLN  23   2.292 -12.755   7.613
  172    HA   GLN  23           HA       GLN  23   0.835 -11.037   6.135
  173    HB2  GLN  23           2HB      GLN  23   0.311 -13.505   7.586
  174    HB3  GLN  23           1HB      GLN  23  -1.127 -12.510   7.410
  175    HG2  GLN  23           2HG      GLN  23  -0.633 -12.388   4.961
  176    HG3  GLN  23           1HG      GLN  23   0.638 -13.581   5.226
  177   HE21  GLN  23          1HE2      GLN  23   0.018 -15.672   6.029
  178   HE22  GLN  23          2HE2      GLN  23  -1.560 -16.289   5.697
  179    H    HIS  24           H        HIS  24  -0.659  -9.483   6.365
  180    HA   HIS  24           HA       HIS  24  -0.927  -8.217   8.966
  181    HD1  HIS  24           1HD      HIS  24  -0.402  -5.391   9.075
  182    HD2  HIS  24           2HD      HIS  24  -4.035  -5.732   7.098
  183    HE1  HIS  24           1HE      HIS  24  -1.783  -3.471   9.881
  184    HE2  HIS  24           2HE      HIS  24  -3.943  -3.624   8.598
  185    HB2  HIS  24           2HB      HIS  24  -0.431  -6.913   6.889
  186    HB3  HIS  24           1HB      HIS  24  -2.022  -7.336   6.289
  187    H    ILE  25           H        ILE  25  -2.821 -10.178   6.822
  188    HA   ILE  25           HA       ILE  25  -5.018 -10.146   8.732
  189    HB   ILE  25           HB       ILE  25  -5.615  -9.745   5.803
  190   HG12  ILE  25          2HG1      ILE  25  -5.451  -7.675   8.002
  191   HG13  ILE  25          1HG1      ILE  25  -4.491  -7.733   6.527
  192   HG21  ILE  25          1HG2      ILE  25  -7.254 -10.796   7.524
  193   HG22  ILE  25          2HG2      ILE  25  -7.835  -9.560   6.408
  194   HG23  ILE  25          3HG2      ILE  25  -7.452  -9.132   8.076
  195   HD11  ILE  25          3HD1      ILE  25  -7.409  -7.096   6.812
  196   HD12  ILE  25          1HD1      ILE  25  -6.648  -7.443   5.260
  197   HD13  ILE  25          2HD1      ILE  25  -6.114  -6.059   6.214
  198    HA   PRO  26           HA       PRO  26  -4.624 -14.533   7.994
  199    HB2  PRO  26           2HB      PRO  26  -7.472 -14.497   8.877
  200    HB3  PRO  26           1HB      PRO  26  -6.127 -15.489   9.452
  201    HG2  PRO  26           2HG      PRO  26  -7.011 -13.441  10.900
  202    HG3  PRO  26           1HG      PRO  26  -5.277 -13.796  10.792
  203    HD2  PRO  26           2HD      PRO  26  -6.861 -11.647   9.457
  204    HD3  PRO  26           1HD      PRO  26  -5.203 -11.602  10.088
  205    H    GLY  27           H        GLY  27  -4.739 -15.435   6.040
  206    HA2  GLY  27           2HA      GLY  27  -5.848 -16.415   4.220
  207    HA3  GLY  27           1HA      GLY  27  -7.276 -15.470   4.603
  208    H    ASP  28           H        ASP  28  -4.937 -13.201   4.688
  209    HA   ASP  28           HA       ASP  28  -4.946 -12.748   1.782
  210    HB2  ASP  28           2HB      ASP  28  -6.332 -11.223   3.748
  211    HB3  ASP  28           1HB      ASP  28  -5.000 -10.238   3.155
  212    H    ASN  29           H        ASN  29  -2.881 -12.809   1.139
  213    HA   ASN  29           HA       ASN  29  -0.775 -11.978   2.987
  214    HB2  ASN  29           2HB      ASN  29  -0.334 -13.185   0.267
  215    HB3  ASN  29           1HB      ASN  29   0.753 -13.179   1.653
  216   HD21  ASN  29          1HD2      ASN  29   0.585 -14.748   3.176
  217   HD22  ASN  29          2HD2      ASN  29  -0.510 -16.080   3.067
  218    H    SER  30           H        SER  30  -2.621 -10.242   1.034
  219    HA   SER  30           HA       SER  30  -0.789  -8.917  -0.685
  220    HG   SER  30           HG       SER  30  -3.802  -9.588  -1.134
  221    HB2  SER  30           2HB      SER  30  -3.024  -7.254   0.216
  222    HB3  SER  30           1HB      SER  30  -2.610  -7.794  -1.409
  223    H    ILE  31           H        ILE  31  -0.725  -6.316  -0.349
  224    HA   ILE  31           HA       ILE  31   0.596  -6.007   2.246
  225    HB   ILE  31           HB       ILE  31   0.982  -4.623  -0.370
  226   HG12  ILE  31          2HG1      ILE  31   3.344  -4.953   0.136
  227   HG13  ILE  31          1HG1      ILE  31   2.941  -5.553   1.735
  228   HG21  ILE  31          1HG2      ILE  31   1.477  -3.384   2.313
  229   HG22  ILE  31          2HG2      ILE  31   0.652  -2.696   0.916
  230   HG23  ILE  31          3HG2      ILE  31   2.400  -2.916   0.886
  231   HD11  ILE  31          3HD1      ILE  31   2.766  -6.885  -0.900
  232   HD12  ILE  31          1HD1      ILE  31   1.566  -7.316   0.316
  233   HD13  ILE  31          2HD1      ILE  31   3.281  -7.519   0.661
  234    H    TYR  32           H        TYR  32  -0.503  -5.105   3.815
  235    HA   TYR  32           HA       TYR  32  -2.610  -3.152   3.172
  236    HD1  TYR  32           2HD      TYR  32  -2.445  -6.718   3.332
  237    HD2  TYR  32           1HD      TYR  32  -5.610  -4.147   4.523
  238    HE1  TYR  32           2HE      TYR  32  -4.027  -8.100   2.059
  239    HE2  TYR  32           1HE      TYR  32  -7.212  -5.509   3.268
  240    HH   TYR  32           HH       TYR  32  -7.133  -8.193   2.488
  241    HB2  TYR  32           2HB      TYR  32  -2.351  -5.155   5.402
  242    HB3  TYR  32           1HB      TYR  32  -3.520  -3.842   5.446
  243    H    VAL  33           H        VAL  33  -2.745  -1.239   4.287
  244    HA   VAL  33           HA       VAL  33  -0.365  -0.265   5.548
  245    HB   VAL  33           HB       VAL  33  -3.077   0.974   5.082
  246   HG11  VAL  33          1HG1      VAL  33  -1.882   3.122   5.836
  247   HG12  VAL  33          2HG1      VAL  33  -0.759   2.040   6.661
  248   HG13  VAL  33          3HG1      VAL  33  -2.473   2.020   7.079
  249   HG21  VAL  33          3HG2      VAL  33  -1.397   2.574   3.811
  250   HG22  VAL  33          1HG2      VAL  33  -1.993   1.087   3.073
  251   HG23  VAL  33          2HG2      VAL  33  -0.392   1.124   3.812
  252    H    THR  34           H        THR  34   0.095  -0.179   7.671
  253    HA   THR  34           HA       THR  34  -1.900  -1.271   9.519
  254    HB   THR  34           HB       THR  34  -0.134  -2.007  10.885
  255    HG1  THR  34           1HG      THR  34   1.403  -0.608  11.158
  256   HG21  THR  34          3HG2      THR  34   1.564  -2.422   8.599
  257   HG22  THR  34          1HG2      THR  34  -0.128  -2.727   8.205
  258   HG23  THR  34          2HG2      THR  34   0.633  -3.585   9.543
  259    H    LYS  35           H        LYS  35   0.053   1.623   9.035
  260    HA   LYS  35           HA       LYS  35  -1.571   3.054  10.946
  261    HB2  LYS  35           2HB      LYS  35   1.311   2.420  11.514
  262    HB3  LYS  35           1HB      LYS  35   0.591   3.901  12.121
  263    HG2  LYS  35           2HG      LYS  35  -1.225   1.973  12.863
  264    HG3  LYS  35           1HG      LYS  35   0.334   1.173  13.068
  265    HD2  LYS  35           2HD      LYS  35   0.190   2.183  15.105
  266    HD3  LYS  35           1HD      LYS  35   0.939   3.501  14.205
  267    HE2  LYS  35           2HE      LYS  35  -2.042   3.219  14.516
  268    HE3  LYS  35           1HE      LYS  35  -1.043   4.111  15.661
  269    HZ1  LYS  35           3HZ      LYS  35  -1.832   5.699  14.160
  270    HZ2  LYS  35           1HZ      LYS  35  -1.544   4.721  12.809
  271    HZ3  LYS  35           2HZ      LYS  35  -0.246   5.408  13.650
  272    H    ILE  36           H        ILE  36  -1.959   4.986  10.050
  273    HA   ILE  36           HA       ILE  36  -0.022   6.044   8.122
  274    HB   ILE  36           HB       ILE  36  -2.896   6.841   8.606
  275   HG12  ILE  36          2HG1      ILE  36  -1.521   5.209   6.469
  276   HG13  ILE  36          1HG1      ILE  36  -2.830   4.709   7.533
  277   HG21  ILE  36          1HG2      ILE  36  -2.697   8.304   6.712
  278   HG22  ILE  36          2HG2      ILE  36  -1.038   7.779   6.423
  279   HG23  ILE  36          3HG2      ILE  36  -1.428   8.714   7.866
  280   HD11  ILE  36          3HD1      ILE  36  -4.179   6.565   6.353
  281   HD12  ILE  36          1HD1      ILE  36  -3.891   5.040   5.514
  282   HD13  ILE  36          2HD1      ILE  36  -2.922   6.461   5.120
  283    H    ILE  37           H        ILE  37   1.318   7.624   8.724
  284    HA   ILE  37           HA       ILE  37   1.066   8.926  11.265
  285    HB   ILE  37           HB       ILE  37   3.046   9.150   9.005
  286   HG12  ILE  37          2HG1      ILE  37   4.562   8.493  11.017
  287   HG13  ILE  37          1HG1      ILE  37   3.049   8.032  11.790
  288   HG21  ILE  37          1HG2      ILE  37   3.013  11.372   9.744
  289   HG22  ILE  37          2HG2      ILE  37   4.364  10.632  10.600
  290   HG23  ILE  37          3HG2      ILE  37   2.834  10.898  11.434
  291   HD11  ILE  37          3HD1      ILE  37   2.620   6.379  10.156
  292   HD12  ILE  37          1HD1      ILE  37   4.306   6.192  10.641
  293   HD13  ILE  37          2HD1      ILE  37   3.910   6.979   9.114
  294    H    GLU  38           H        GLU  38   0.660  11.106  11.687
  295    HA   GLU  38           HA       GLU  38  -1.256  12.396  10.109
  296    HB2  GLU  38           2HB      GLU  38   0.448  13.232  12.422
  297    HB3  GLU  38           1HB      GLU  38  -0.469  14.456  11.554
  298    HG2  GLU  38           2HG      GLU  38  -2.475  12.860  11.920
  299    HG3  GLU  38           1HG      GLU  38  -1.458  12.150  13.172
  300    H    GLY  39           H        GLY  39  -1.183  14.230   8.796
  301    HA2  GLY  39           2HA      GLY  39  -0.364  15.558   7.126
  302    HA3  GLY  39           1HA      GLY  39   1.055  15.744   8.139
  303    H    GLY  40           H        GLY  40   0.271  12.526   7.094
  304    HA2  GLY  40           2HA      GLY  40   2.709  12.473   5.502
  305    HA3  GLY  40           1HA      GLY  40   1.751  11.084   5.991
  306    H    ALA  41           H        ALA  41   2.661  11.094   3.476
  307    HA   ALA  41           HA       ALA  41   1.304  12.334   1.442
  308    HB1  ALA  41           3HB      ALA  41   3.241  10.775   1.210
  309    HB2  ALA  41           1HB      ALA  41   1.964  10.537   0.015
  310    HB3  ALA  41           2HB      ALA  41   2.110   9.432   1.382
  311    H    ALA  42           H        ALA  42   0.353   9.245   2.984
  312    HA   ALA  42           HA       ALA  42  -2.074   9.020   1.504
  313    HB1  ALA  42           3HB      ALA  42  -1.015   7.619   3.944
  314    HB2  ALA  42           1HB      ALA  42  -1.172   7.000   2.300
  315    HB3  ALA  42           2HB      ALA  42  -2.613   7.276   3.279
  316    H    HIS  43           H        HIS  43  -1.389   9.883   4.897
  317    HA   HIS  43           HA       HIS  43  -3.941  10.376   5.802
  318    HD1  HIS  43           1HD      HIS  43  -2.869  14.015   7.261
  319    HD2  HIS  43           2HD      HIS  43  -3.833  10.459   9.182
  320    HE1  HIS  43           1HE      HIS  43  -4.237  14.683   9.258
  321    HE2  HIS  43           2HE      HIS  43  -4.722  12.523  10.464
  322    HB2  HIS  43           2HB      HIS  43  -1.887  10.403   7.196
  323    HB3  HIS  43           1HB      HIS  43  -1.463  11.963   6.505
  324    H    LYS  44           H        LYS  44  -1.767  12.667   4.159
  325    HA   LYS  44           HA       LYS  44  -3.575  14.858   4.236
  326    HB2  LYS  44           2HB      LYS  44  -1.127  14.291   2.567
  327    HB3  LYS  44           1HB      LYS  44  -2.044  15.784   2.427
  328    HG2  LYS  44           2HG      LYS  44  -1.415  15.240   5.183
  329    HG3  LYS  44           1HG      LYS  44   0.044  15.232   4.189
  330    HD2  LYS  44           2HD      LYS  44  -0.749  17.426   3.222
  331    HD3  LYS  44           1HD      LYS  44  -1.985  17.439   4.481
  332    HE2  LYS  44           2HE      LYS  44  -0.289  18.699   5.429
  333    HE3  LYS  44           1HE      LYS  44   0.002  17.097   6.101
  334    HZ1  LYS  44           3HZ      LYS  44   1.423  18.297   3.783
  335    HZ2  LYS  44           1HZ      LYS  44   1.690  16.741   4.394
  336    HZ3  LYS  44           2HZ      LYS  44   2.053  18.095   5.340
  337    H    ASP  45           H        ASP  45  -2.921  12.326   1.855
  338    HA   ASP  45           HA       ASP  45  -4.420  13.397  -0.272
  339    HB2  ASP  45           2HB      ASP  45  -2.771  11.368  -0.202
  340    HB3  ASP  45           1HB      ASP  45  -4.214  10.436   0.182
  341    H    GLY  46           H        GLY  46  -5.323  10.932   2.150
  342    HA2  GLY  46           2HA      GLY  46  -7.428  10.864   3.247
  343    HA3  GLY  46           1HA      GLY  46  -8.106  11.844   1.959
  344    H    LYS  47           H        LYS  47  -6.791  10.047  -0.083
  345    HA   LYS  47           HA       LYS  47  -8.985   8.299  -0.483
  346    HB2  LYS  47           2HB      LYS  47  -6.429   8.880  -1.867
  347    HB3  LYS  47           1HB      LYS  47  -7.149   7.310  -2.189
  348    HG2  LYS  47           2HG      LYS  47  -8.753   9.828  -2.423
  349    HG3  LYS  47           1HG      LYS  47  -7.729   9.261  -3.742
  350    HD2  LYS  47           2HD      LYS  47  -8.934   7.150  -3.802
  351    HD3  LYS  47           1HD      LYS  47  -9.922   7.656  -2.430
  352    HE2  LYS  47           2HE      LYS  47  -9.844   9.387  -4.852
  353    HE3  LYS  47           1HE      LYS  47 -10.785   7.898  -4.910
  354    HZ1  LYS  47           3HZ      LYS  47 -12.017   8.638  -2.970
  355    HZ2  LYS  47           1HZ      LYS  47 -12.131   9.781  -4.213
  356    HZ3  LYS  47           2HZ      LYS  47 -11.106  10.061  -2.898
  357    H    LEU  48           H        LEU  48  -5.697   7.805   0.752
  358    HA   LEU  48           HA       LEU  48  -6.169   4.949   1.038
  359    HG   LEU  48           HG       LEU  48  -4.394   3.658   0.804
  360    HB2  LEU  48           2HB      LEU  48  -3.934   6.254   0.398
  361    HB3  LEU  48           1HB      LEU  48  -3.725   6.233   2.138
  362   HD11  LEU  48          1HD1      LEU  48  -2.665   4.700  -0.640
  363   HD12  LEU  48          2HD1      LEU  48  -2.115   3.236   0.177
  364   HD13  LEU  48          3HD1      LEU  48  -1.612   4.819   0.770
  365   HD21  LEU  48          3HD2      LEU  48  -4.111   4.009   3.287
  366   HD22  LEU  48          1HD2      LEU  48  -2.395   4.271   2.964
  367   HD23  LEU  48          2HD2      LEU  48  -3.145   2.724   2.566
  368    H    GLN  49           H        GLN  49  -6.874   4.015   2.818
  369    HA   GLN  49           HA       GLN  49  -6.619   5.397   5.398
  370    HB2  GLN  49           2HB      GLN  49  -8.866   4.658   6.008
  371    HB3  GLN  49           1HB      GLN  49  -8.914   5.680   4.581
  372    HG2  GLN  49           2HG      GLN  49  -8.832   2.710   4.280
  373    HG3  GLN  49           1HG      GLN  49 -10.343   3.513   4.692
  374   HE21  GLN  49          1HE2      GLN  49  -8.327   2.547   2.202
  375   HE22  GLN  49          2HE2      GLN  49  -9.049   3.446   0.917
  376    H    ILE  50           H        ILE  50  -6.195   4.082   7.166
  377    HA   ILE  50           HA       ILE  50  -4.744   1.775   6.856
  378    HB   ILE  50           HB       ILE  50  -6.463   2.486   9.242
  379   HG12  ILE  50          2HG1      ILE  50  -3.508   2.864   9.202
  380   HG13  ILE  50          1HG1      ILE  50  -4.477   4.002   8.271
  381   HG21  ILE  50          1HG2      ILE  50  -4.786   1.078  10.487
  382   HG22  ILE  50          2HG2      ILE  50  -4.234   0.488   8.919
  383   HG23  ILE  50          3HG2      ILE  50  -5.892   0.190   9.439
  384   HD11  ILE  50          3HD1      ILE  50  -4.683   3.442  11.218
  385   HD12  ILE  50          1HD1      ILE  50  -5.781   4.487  10.317
  386   HD13  ILE  50          2HD1      ILE  50  -4.072   4.906  10.447
  387    H    GLY  51           H        GLY  51  -5.203  -0.210   6.174
  388    HA2  GLY  51           2HA      GLY  51  -6.555  -2.233   6.657
  389    HA3  GLY  51           1HA      GLY  51  -7.970  -1.215   6.491
  390    H    ASP  52           H        ASP  52  -6.505   0.147   4.100
  391    HA   ASP  52           HA       ASP  52  -7.735  -1.433   2.121
  392    HB2  ASP  52           2HB      ASP  52  -6.396   0.076   0.522
  393    HB3  ASP  52           1HB      ASP  52  -7.586   0.832   1.571
  394    H    LYS  53           H        LYS  53  -6.639  -2.380   0.226
  395    HA   LYS  53           HA       LYS  53  -4.172  -3.742   1.069
  396    HB2  LYS  53           2HB      LYS  53  -4.864  -5.497  -0.625
  397    HB3  LYS  53           1HB      LYS  53  -5.855  -5.378   0.820
  398    HG2  LYS  53           2HG      LYS  53  -6.762  -3.758  -1.459
  399    HG3  LYS  53           1HG      LYS  53  -6.833  -5.506  -1.687
  400    HD2  LYS  53           2HD      LYS  53  -7.868  -4.372   0.863
  401    HD3  LYS  53           1HD      LYS  53  -8.837  -4.166  -0.597
  402    HE2  LYS  53           2HE      LYS  53  -9.303  -6.386  -0.764
  403    HE3  LYS  53           1HE      LYS  53  -7.759  -6.874  -0.070
  404    HZ1  LYS  53           3HZ      LYS  53  -8.540  -6.512   2.088
  405    HZ2  LYS  53           1HZ      LYS  53  -9.827  -7.284   1.309
  406    HZ3  LYS  53           2HZ      LYS  53  -9.874  -5.614   1.570
  407    H    LEU  54           H        LEU  54  -2.551  -4.057  -0.363
  408    HA   LEU  54           HA       LEU  54  -2.476  -2.141  -2.583
  409    HG   LEU  54           HG       LEU  54  -1.137  -0.563  -1.925
  410    HB2  LEU  54           2HB      LEU  54  -0.605  -2.801  -0.563
  411    HB3  LEU  54           1HB      LEU  54   0.100  -3.261  -2.101
  412   HD11  LEU  54          1HD1      LEU  54   1.134   0.266  -1.091
  413   HD12  LEU  54          2HD1      LEU  54   1.369  -1.376  -0.494
  414   HD13  LEU  54          3HD1      LEU  54   0.018  -0.408   0.095
  415   HD21  LEU  54          3HD2      LEU  54   1.105  -0.162  -3.216
  416   HD22  LEU  54          1HD2      LEU  54  -0.266  -0.929  -4.015
  417   HD23  LEU  54          2HD2      LEU  54   1.066  -1.914  -3.411
  418    H    LEU  55           H        LEU  55  -3.176  -3.051  -4.377
  419    HA   LEU  55           HA       LEU  55  -2.738  -5.774  -5.089
  420    HG   LEU  55           HG       LEU  55  -3.047  -6.061  -7.651
  421    HB2  LEU  55           2HB      LEU  55  -4.686  -4.605  -5.921
  422    HB3  LEU  55           1HB      LEU  55  -3.683  -3.396  -6.697
  423   HD11  LEU  55          1HD1      LEU  55  -5.171  -6.343  -8.928
  424   HD12  LEU  55          2HD1      LEU  55  -5.896  -5.116  -7.888
  425   HD13  LEU  55          3HD1      LEU  55  -5.320  -6.631  -7.194
  426   HD21  LEU  55          3HD2      LEU  55  -2.423  -3.925  -8.724
  427   HD22  LEU  55          1HD2      LEU  55  -4.128  -3.624  -9.062
  428   HD23  LEU  55          2HD2      LEU  55  -3.310  -5.000  -9.804
  429    H    ALA  56           H        ALA  56  -1.441  -2.663  -6.319
  430    HA   ALA  56           HA       ALA  56   1.129  -3.949  -6.787
  431    HB1  ALA  56           3HB      ALA  56  -0.491  -2.847  -9.095
  432    HB2  ALA  56           1HB      ALA  56   0.006  -4.523  -8.861
  433    HB3  ALA  56           2HB      ALA  56   1.215  -3.279  -9.190
  434    H    VAL  57           H        VAL  57   2.853  -2.433  -7.195
  435    HA   VAL  57           HA       VAL  57   2.176   0.401  -7.105
  436    HB   VAL  57           HB       VAL  57   2.319  -0.249  -4.733
  437   HG11  VAL  57          1HG1      VAL  57   5.250  -0.721  -5.020
  438   HG12  VAL  57          2HG1      VAL  57   4.121  -2.045  -5.305
  439   HG13  VAL  57          3HG1      VAL  57   4.148  -1.231  -3.741
  440   HG21  VAL  57          3HG2      VAL  57   3.628   1.573  -4.038
  441   HG22  VAL  57          1HG2      VAL  57   3.067   2.003  -5.653
  442   HG23  VAL  57          2HG2      VAL  57   4.716   1.425  -5.417
  443    H    ASN  58           H        ASN  58   3.403   1.453  -8.499
  444    HA   ASN  58           HA       ASN  58   5.129   2.072  -9.843
  445    HB2  ASN  58           2HB      ASN  58   6.640   0.496  -7.775
  446    HB3  ASN  58           1HB      ASN  58   7.464   1.118  -9.199
  447   HD21  ASN  58          1HD2      ASN  58   7.660   3.355  -9.480
  448   HD22  ASN  58          2HD2      ASN  58   7.449   4.453  -8.163
  449    H    ASN  59           H        ASN  59   3.482  -0.192 -10.475
  450    HA   ASN  59           HA       ASN  59   3.314  -1.488 -12.372
  451    HB2  ASN  59           2HB      ASN  59   5.527  -0.266 -13.074
  452    HB3  ASN  59           1HB      ASN  59   6.276  -1.802 -12.649
  453   HD21  ASN  59          1HD2      ASN  59   4.106  -0.168 -14.825
  454   HD22  ASN  59          2HD2      ASN  59   4.039  -1.421 -16.013
  455    H    VAL  60           H        VAL  60   5.179  -2.291  -9.580
  456    HA   VAL  60           HA       VAL  60   5.177  -5.142 -10.237
  457    HB   VAL  60           HB       VAL  60   6.314  -5.443  -8.047
  458   HG11  VAL  60          1HG1      VAL  60   8.452  -4.281  -8.732
  459   HG12  VAL  60          2HG1      VAL  60   7.536  -3.586 -10.070
  460   HG13  VAL  60          3HG1      VAL  60   7.719  -5.336  -9.941
  461   HG21  VAL  60          3HG2      VAL  60   6.954  -3.700  -6.663
  462   HG22  VAL  60          1HG2      VAL  60   5.318  -3.246  -7.135
  463   HG23  VAL  60          2HG2      VAL  60   6.705  -2.482  -7.912
  464    H    CYS  61           H        CYS  61   4.099  -6.715  -8.960
  465    HA   CYS  61           HA       CYS  61   1.633  -5.730  -7.799
  466    HG   CYS  61           HG       CYS  61   3.765  -8.921  -7.660
  467    HB2  CYS  61           2HB      CYS  61   0.973  -8.078  -7.656
  468    HB3  CYS  61           1HB      CYS  61   1.544  -7.680  -9.271
  469    H    LEU  62           H        LEU  62   1.164  -5.595  -5.695
  470    HA   LEU  62           HA       LEU  62   3.241  -6.402  -3.799
  471    HG   LEU  62           HG       LEU  62   3.342  -5.006  -1.673
  472    HB2  LEU  62           2HB      LEU  62   1.946  -3.996  -4.151
  473    HB3  LEU  62           1HB      LEU  62   1.115  -4.691  -2.777
  474   HD11  LEU  62          1HD1      LEU  62   4.822  -5.056  -3.522
  475   HD12  LEU  62          2HD1      LEU  62   5.199  -3.596  -2.609
  476   HD13  LEU  62          3HD1      LEU  62   4.262  -3.487  -4.100
  477   HD21  LEU  62          3HD2      LEU  62   2.853  -2.138  -2.430
  478   HD22  LEU  62          1HD2      LEU  62   3.514  -2.772  -0.922
  479   HD23  LEU  62          2HD2      LEU  62   1.815  -3.029  -1.318
  480    H    GLU  63           H        GLU  63   1.289  -8.279  -4.895
  481    HA   GLU  63           HA       GLU  63  -0.178  -8.961  -2.432
  482    HB2  GLU  63           2HB      GLU  63  -1.324  -8.415  -4.800
  483    HB3  GLU  63           1HB      GLU  63  -1.054 -10.140  -5.004
  484    HG2  GLU  63           2HG      GLU  63  -2.211  -9.453  -2.422
  485    HG3  GLU  63           1HG      GLU  63  -3.216  -8.979  -3.789
  486    H    GLU  64           H        GLU  64   2.188 -10.059  -4.705
  487    HA   GLU  64           HA       GLU  64   2.125 -12.726  -3.456
  488    HB2  GLU  64           2HB      GLU  64   1.948 -12.036  -6.195
  489    HB3  GLU  64           1HB      GLU  64   3.505 -12.808  -5.947
  490    HG2  GLU  64           2HG      GLU  64   2.287 -14.674  -4.800
  491    HG3  GLU  64           1HG      GLU  64   0.785 -13.926  -5.340
  492    H    VAL  65           H        VAL  65   3.532 -10.637  -2.278
  493    HA   VAL  65           HA       VAL  65   6.284 -11.613  -2.602
  494    HB   VAL  65           HB       VAL  65   7.153  -9.295  -2.283
  495   HG11  VAL  65          1HG1      VAL  65   7.047 -10.446  -4.487
  496   HG12  VAL  65          2HG1      VAL  65   6.989  -8.688  -4.598
  497   HG13  VAL  65          3HG1      VAL  65   5.512  -9.632  -4.791
  498   HG21  VAL  65          3HG2      VAL  65   5.257  -8.168  -1.375
  499   HG22  VAL  65          1HG2      VAL  65   4.269  -8.570  -2.780
  500   HG23  VAL  65          2HG2      VAL  65   5.608  -7.434  -2.939
  501    H    THR  66           H        THR  66   7.687 -11.216  -0.811
  502    HA   THR  66           HA       THR  66   6.430 -11.623   1.717
  503    HB   THR  66           HB       THR  66   8.925 -11.225   2.491
  504    HG1  THR  66           1HG      THR  66  10.390 -11.542   0.823
  505   HG21  THR  66          3HG2      THR  66   8.444 -13.568   0.684
  506   HG22  THR  66          1HG2      THR  66   7.723 -13.435   2.289
  507   HG23  THR  66          2HG2      THR  66   9.478 -13.472   2.111
  508    H    HIS  67           H        HIS  67   7.754 -10.133   3.586
  509    HA   HIS  67           HA       HIS  67   6.437  -7.618   3.274
  510    HD1  HIS  67           1HD      HIS  67   4.995  -6.793   5.878
  511    HD2  HIS  67           2HD      HIS  67   8.951  -5.555   5.794
  512    HE1  HIS  67           1HE      HIS  67   4.965  -4.400   6.595
  513    HE2  HIS  67           2HE      HIS  67   7.341  -3.630   6.375
  514    HB2  HIS  67           2HB      HIS  67   6.624  -8.703   5.483
  515    HB3  HIS  67           1HB      HIS  67   8.340  -8.354   5.513
  516    H    GLU  68           H        GLU  68   9.823  -8.645   3.109
  517    HA   GLU  68           HA       GLU  68  11.072  -6.191   3.041
  518    HB2  GLU  68           2HB      GLU  68  12.801  -7.263   1.605
  519    HB3  GLU  68           1HB      GLU  68  12.378  -8.212   3.021
  520    HG2  GLU  68           2HG      GLU  68  10.686  -9.291   1.244
  521    HG3  GLU  68           1HG      GLU  68  11.980  -8.789   0.157
  522    H    GLU  69           H        GLU  69   9.510  -7.905   0.343
  523    HA   GLU  69           HA       GLU  69  10.087  -5.914  -1.605
  524    HB2  GLU  69           2HB      GLU  69   9.096  -8.459  -1.726
  525    HB3  GLU  69           1HB      GLU  69   7.654  -7.510  -2.057
  526    HG2  GLU  69           2HG      GLU  69  10.258  -7.261  -3.546
  527    HG3  GLU  69           1HG      GLU  69   8.858  -8.181  -4.093
  528    H    ALA  70           H        ALA  70   7.446  -6.395   0.675
  529    HA   ALA  70           HA       ALA  70   5.560  -4.583  -0.344
  530    HB1  ALA  70           3HB      ALA  70   4.733  -4.463   1.981
  531    HB2  ALA  70           1HB      ALA  70   6.177  -5.314   2.520
  532    HB3  ALA  70           2HB      ALA  70   5.030  -6.121   1.454
  533    H    VAL  71           H        VAL  71   8.307  -4.110   1.836
  534    HA   VAL  71           HA       VAL  71   7.843  -1.268   2.095
  535    HB   VAL  71           HB       VAL  71  10.058  -3.074   3.075
  536   HG11  VAL  71          1HG1      VAL  71   9.906  -0.096   3.055
  537   HG12  VAL  71          2HG1      VAL  71  11.297  -1.158   2.832
  538   HG13  VAL  71          3HG1      VAL  71  10.627  -0.909   4.444
  539   HG21  VAL  71          3HG2      VAL  71   8.296  -1.410   4.812
  540   HG22  VAL  71          1HG2      VAL  71   9.076  -2.955   5.147
  541   HG23  VAL  71          2HG2      VAL  71   7.653  -2.893   4.108
  542    H    THR  72           H        THR  72   9.921  -3.401   0.222
  543    HA   THR  72           HA       THR  72  11.735  -1.478  -0.726
  544    HB   THR  72           HB       THR  72  10.831  -4.139  -1.814
  545    HG1  THR  72           1HG      THR  72  12.244  -4.710  -0.385
  546   HG21  THR  72          3HG2      THR  72  12.871  -4.037  -3.268
  547   HG22  THR  72          1HG2      THR  72  12.918  -2.302  -2.958
  548   HG23  THR  72          2HG2      THR  72  11.530  -3.013  -3.781
  549    H    ALA  73           H        ALA  73   8.618  -2.609  -1.998
  550    HA   ALA  73           HA       ALA  73   8.740  -1.058  -4.378
  551    HB1  ALA  73           3HB      ALA  73   7.334  -3.193  -3.787
  552    HB2  ALA  73           1HB      ALA  73   6.716  -1.988  -4.916
  553    HB3  ALA  73           2HB      ALA  73   6.152  -2.004  -3.245
  554    H    LEU  74           H        LEU  74   7.351  -0.589  -1.138
  555    HA   LEU  74           HA       LEU  74   5.915   1.787  -1.784
  556    HG   LEU  74           HG       LEU  74   4.730   0.008   1.260
  557    HB2  LEU  74           2HB      LEU  74   6.878   0.514   0.758
  558    HB3  LEU  74           1HB      LEU  74   6.210   2.133   0.785
  559   HD11  LEU  74          1HD1      LEU  74   4.057   2.414   1.240
  560   HD12  LEU  74          2HD1      LEU  74   2.796   1.292   0.733
  561   HD13  LEU  74          3HD1      LEU  74   3.676   2.230  -0.472
  562   HD21  LEU  74          3HD2      LEU  74   3.582  -0.864  -0.614
  563   HD22  LEU  74          1HD2      LEU  74   5.302  -0.973  -0.983
  564   HD23  LEU  74          2HD2      LEU  74   4.326   0.306  -1.704
  565    H    LYS  75           H        LYS  75   9.198   1.015  -0.919
  566    HA   LYS  75           HA       LYS  75   9.903   3.819  -0.505
  567    HB2  LYS  75           2HB      LYS  75  11.989   3.085   0.278
  568    HB3  LYS  75           1HB      LYS  75  10.846   1.887   0.865
  569    HG2  LYS  75           2HG      LYS  75  11.583   0.271  -0.636
  570    HG3  LYS  75           1HG      LYS  75  12.344   1.458  -1.693
  571    HD2  LYS  75           2HD      LYS  75  14.149   0.469  -0.602
  572    HD3  LYS  75           1HD      LYS  75  13.875   1.949   0.320
  573    HE2  LYS  75           2HE      LYS  75  12.320   0.380   1.747
  574    HE3  LYS  75           1HE      LYS  75  13.338  -0.888   1.066
  575    HZ1  LYS  75           3HZ      LYS  75  15.284   0.306   1.928
  576    HZ2  LYS  75           1HZ      LYS  75  14.225  -0.157   3.164
  577    HZ3  LYS  75           2HZ      LYS  75  14.265   1.451   2.644
  578    H    ASN  76           H        ASN  76   9.714   1.696  -3.152
  579    HA   ASN  76           HA       ASN  76  11.902   2.821  -4.659
  580    HB2  ASN  76           2HB      ASN  76  10.853   0.443  -4.861
  581    HB3  ASN  76           1HB      ASN  76   9.653   1.237  -5.875
  582   HD21  ASN  76          1HD2      ASN  76  10.212   1.930  -7.903
  583   HD22  ASN  76          2HD2      ASN  76  11.725   1.554  -8.646
  584    H    THR  77           H        THR  77  10.758   5.016  -3.991
  585    HA   THR  77           HA       THR  77   9.107   5.853  -6.285
  586    HB   THR  77           HB       THR  77   8.072   7.535  -4.759
  587    HG1  THR  77           1HG      THR  77   9.370   6.052  -2.715
  588   HG21  THR  77          3HG2      THR  77   7.734   4.695  -3.825
  589   HG22  THR  77          1HG2      THR  77   6.879   5.454  -5.169
  590   HG23  THR  77          2HG2      THR  77   6.624   6.031  -3.521
  591    H    SER  78           H        SER  78   9.772   7.603  -7.405
  592    HA   SER  78           HA       SER  78  12.124   9.052  -6.375
  593    HG   SER  78           HG       SER  78  12.877   6.838  -8.721
  594    HB2  SER  78           2HB      SER  78  11.385   8.230  -9.179
  595    HB3  SER  78           1HB      SER  78  12.553   9.515  -8.872
  596    H    ASP  79           H        ASP  79   9.999   9.811  -9.127
  597    HA   ASP  79           HA       ASP  79   9.608  12.487  -8.006
  598    HB2  ASP  79           2HB      ASP  79  10.436  12.211 -10.358
  599    HB3  ASP  79           1HB      ASP  79   8.886  11.483 -10.768
  600    H    PHE  80           H        PHE  80   7.711   9.837  -9.438
  601    HA   PHE  80           HA       PHE  80   5.374  10.791  -7.920
  602    HD1  PHE  80           2HD      PHE  80   2.436   9.928  -9.113
  603    HD2  PHE  80           1HD      PHE  80   5.087  12.929 -10.556
  604    HE1  PHE  80           2HE      PHE  80   0.656  11.609  -8.888
  605    HE2  PHE  80           1HE      PHE  80   3.309  14.612 -10.334
  606    HZ   PHE  80           HZ       PHE  80   1.095  13.950  -9.491
  607    HB2  PHE  80           2HB      PHE  80   5.643  10.617 -10.747
  608    HB3  PHE  80           1HB      PHE  80   4.519   9.356 -10.246
  609    H    VAL  81           H        VAL  81   3.642   8.968  -7.768
  610    HA   VAL  81           HA       VAL  81   4.841   6.319  -7.650
  611    HB   VAL  81           HB       VAL  81   4.408   5.897  -5.412
  612   HG11  VAL  81          1HG1      VAL  81   5.023   8.841  -5.279
  613   HG12  VAL  81          2HG1      VAL  81   6.206   7.610  -5.719
  614   HG13  VAL  81          3HG1      VAL  81   5.469   7.592  -4.117
  615   HG21  VAL  81          3HG2      VAL  81   3.008   7.457  -3.979
  616   HG22  VAL  81          1HG2      VAL  81   2.139   6.507  -5.186
  617   HG23  VAL  81          2HG2      VAL  81   2.486   8.209  -5.486
  618    H    TYR  82           H        TYR  82   3.453   4.820  -8.428
  619    HA   TYR  82           HA       TYR  82   0.633   5.620  -8.732
  620    HD1  TYR  82           1HD      TYR  82   0.068   2.178 -10.509
  621    HD2  TYR  82           2HD      TYR  82   0.056   6.264 -11.696
  622    HE1  TYR  82           1HE      TYR  82  -2.045   1.821 -11.697
  623    HE2  TYR  82           2HE      TYR  82  -2.066   5.917 -12.883
  624    HH   TYR  82           HH       TYR  82  -3.197   3.449 -13.951
  625    HB2  TYR  82           2HB      TYR  82   2.060   5.230 -10.804
  626    HB3  TYR  82           1HB      TYR  82   2.075   3.531 -10.356
  627    H    LEU  83           H        LEU  83  -0.294   4.825  -6.953
  628    HA   LEU  83           HA       LEU  83   0.273   2.123  -6.054
  629    HG   LEU  83           HG       LEU  83  -0.224   1.613  -3.888
  630    HB2  LEU  83           2HB      LEU  83  -0.070   4.199  -4.569
  631    HB3  LEU  83           1HB      LEU  83  -1.781   3.950  -4.855
  632   HD11  LEU  83          1HD1      LEU  83   0.697   3.269  -2.445
  633   HD12  LEU  83          2HD1      LEU  83  -0.542   2.403  -1.536
  634   HD13  LEU  83          3HD1      LEU  83  -0.884   4.007  -2.184
  635   HD21  LEU  83          3HD2      LEU  83  -2.471   1.739  -2.421
  636   HD22  LEU  83          1HD2      LEU  83  -2.388   0.989  -4.016
  637   HD23  LEU  83          2HD2      LEU  83  -2.989   2.638  -3.847
  638    H    LYS  84           H        LYS  84  -0.963   0.395  -6.272
  639    HA   LYS  84           HA       LYS  84  -3.609   0.678  -7.522
  640    HB2  LYS  84           2HB      LYS  84  -1.497  -1.419  -7.968
  641    HB3  LYS  84           1HB      LYS  84  -3.169  -1.639  -8.458
  642    HG2  LYS  84           2HG      LYS  84  -2.531   0.804  -9.540
  643    HG3  LYS  84           1HG      LYS  84  -1.036  -0.117  -9.717
  644    HD2  LYS  84           2HD      LYS  84  -2.245  -0.558 -11.681
  645    HD3  LYS  84           1HD      LYS  84  -2.500  -1.982 -10.670
  646    HE2  LYS  84           2HE      LYS  84  -4.639  -1.539 -11.420
  647    HE3  LYS  84           1HE      LYS  84  -4.619  -0.707  -9.866
  648    HZ1  LYS  84           3HZ      LYS  84  -5.546   0.815 -11.344
  649    HZ2  LYS  84           1HZ      LYS  84  -4.439   0.462 -12.575
  650    HZ3  LYS  84           2HZ      LYS  84  -3.940   1.325 -11.209
  651    H    VAL  85           H        VAL  85  -5.310  -0.272  -6.497
  652    HA   VAL  85           HA       VAL  85  -4.657  -2.021  -4.219
  653    HB   VAL  85           HB       VAL  85  -6.931  -0.036  -4.420
  654   HG11  VAL  85          1HG1      VAL  85  -6.708  -0.835  -1.786
  655   HG12  VAL  85          2HG1      VAL  85  -6.490  -2.334  -2.689
  656   HG13  VAL  85          3HG1      VAL  85  -7.942  -1.360  -2.932
  657   HG21  VAL  85          3HG2      VAL  85  -5.722   1.011  -2.457
  658   HG22  VAL  85          1HG2      VAL  85  -4.949   1.189  -4.031
  659   HG23  VAL  85          2HG2      VAL  85  -4.345  -0.006  -2.883
  660    H    ALA  86           H        ALA  86  -5.822  -3.859  -3.938
  661    HA   ALA  86           HA       ALA  86  -7.421  -4.767  -6.181
  662    HB1  ALA  86           3HB      ALA  86  -6.858  -6.847  -5.546
  663    HB2  ALA  86           1HB      ALA  86  -7.213  -6.533  -3.847
  664    HB3  ALA  86           2HB      ALA  86  -5.665  -6.037  -4.531
  665    H    LYS  87           H        LYS  87  -9.585  -5.307  -6.134
  666    HA   LYS  87           HA       LYS  87 -11.124  -4.113  -3.956
  667    HB2  LYS  87           2HB      LYS  87 -11.442  -4.028  -6.686
  668    HB3  LYS  87           1HB      LYS  87 -12.621  -5.243  -6.212
  669    HG2  LYS  87           2HG      LYS  87 -13.248  -3.417  -4.408
  670    HG3  LYS  87           1HG      LYS  87 -12.534  -2.339  -5.610
  671    HD2  LYS  87           2HD      LYS  87 -14.573  -2.344  -6.543
  672    HD3  LYS  87           1HD      LYS  87 -14.126  -3.938  -7.154
  673    HE2  LYS  87           2HE      LYS  87 -15.896  -4.739  -6.068
  674    HE3  LYS  87           1HE      LYS  87 -15.027  -4.414  -4.569
  675    HZ1  LYS  87           3HZ      LYS  87 -17.209  -3.413  -4.519
  676    HZ2  LYS  87           1HZ      LYS  87 -16.894  -2.555  -5.944
  677    HZ3  LYS  87           2HZ      LYS  87 -16.030  -2.200  -4.533
  678    HA   PRO  88           HA       PRO  88 -11.621  -8.348  -2.452
  679    HB2  PRO  88           2HB      PRO  88 -12.717  -7.665  -0.070
  680    HB3  PRO  88           1HB      PRO  88 -10.981  -7.568  -0.386
  681    HG2  PRO  88           2HG      PRO  88 -13.039  -5.393  -0.432
  682    HG3  PRO  88           1HG      PRO  88 -11.406  -5.373   0.260
  683    HD2  PRO  88           2HD      PRO  88 -11.987  -4.276  -2.148
  684    HD3  PRO  88           1HD      PRO  88 -10.409  -4.999  -1.781
  685    H    THR  89           H        THR  89 -13.269  -9.495  -3.331
  686    HA   THR  89           HA       THR  89 -16.006  -8.795  -2.600
  687    HB   THR  89           HB       THR  89 -15.235  -9.377  -5.467
  688    HG1  THR  89           1HG      THR  89 -14.574  -7.363  -5.328
  689   HG21  THR  89          3HG2      THR  89 -17.524  -9.987  -4.972
  690   HG22  THR  89          1HG2      THR  89 -17.472  -8.554  -5.998
  691   HG23  THR  89          2HG2      THR  89 -17.816  -8.393  -4.276
  692    H    GLY  90           H        GLY  90 -16.418 -10.591  -1.421
  693    HA2  GLY  90           2HA      GLY  90 -17.304 -12.794  -1.409
  694    HA3  GLY  90           1HA      GLY  90 -16.357 -13.157  -2.844
  695    H    SER  91           H        SER  91 -16.421 -13.093   0.607
  696    HA   SER  91           HA       SER  91 -13.616 -13.588   0.981
  697    HG   SER  91           HG       SER  91 -14.943 -11.939   3.758
  698    HB2  SER  91           2HB      SER  91 -16.001 -13.720   2.826
  699    HB3  SER  91           1HB      SER  91 -14.375 -14.156   3.352
  700    H    HIS  92           H        HIS  92 -16.555 -15.598   1.275
  701    HA   HIS  92           HA       HIS  92 -14.929 -18.003   1.484
  702    HD1  HIS  92           1HD      HIS  92 -15.385 -18.549   4.125
  703    HD2  HIS  92           2HD      HIS  92 -17.866 -20.954   1.817
  704    HE1  HIS  92           1HE      HIS  92 -15.214 -20.848   5.128
  705    HE2  HIS  92           2HE      HIS  92 -16.659 -22.304   3.664
  706    HB2  HIS  92           2HB      HIS  92 -17.338 -17.315   2.582
  707    HB3  HIS  92           1HB      HIS  92 -17.845 -18.317   1.226
  708    HA   ARG 301           HA       ARG 301   2.268 -11.166  10.332
  709    HE   ARG 301           HE       ARG 301   1.268 -12.043  15.897
  710    H1   ARG 301           1HT      ARG 301   2.032 -13.194  11.662
  711    H2   ARG 301           2HT      ARG 301   3.142 -12.525  12.789
  712    H3   ARG 301           3HT      ARG 301   3.633 -12.827  11.173
  713    HB2  ARG 301           2HB      ARG 301   0.762  -9.876  11.798
  714    HB3  ARG 301           1HB      ARG 301   0.335 -11.579  11.748
  715    HG2  ARG 301           2HG      ARG 301   2.106 -11.249  13.916
  716    HG3  ARG 301           1HG      ARG 301   0.930  -9.936  14.001
  717    HD2  ARG 301           2HD      ARG 301  -0.871 -11.393  14.182
  718    HD3  ARG 301           1HD      ARG 301   0.033 -12.748  13.510
  719   HH11  ARG 301          1HH1      ARG 301  -1.829 -13.291  14.847
  720   HH12  ARG 301          2HH1      ARG 301  -2.126 -14.142  16.324
  721   HH21  ARG 301          1HH2      ARG 301   0.873 -13.168  17.843
  722   HH22  ARG 301          2HH2      ARG 301  -0.594 -14.072  18.026
  723    H    ARG 302           H        ARG 302   3.228  -9.231  10.004
  724    HA   ARG 302           HA       ARG 302   4.562  -7.785  12.094
  725    HE   ARG 302           HE       ARG 302   8.307  -9.841  12.179
  726    HB2  ARG 302           2HB      ARG 302   6.275  -9.461  11.646
  727    HB3  ARG 302           1HB      ARG 302   6.225  -9.087   9.929
  728    HG2  ARG 302           2HG      ARG 302   7.037  -6.820  10.409
  729    HG3  ARG 302           1HG      ARG 302   7.118  -7.226  12.125
  730    HD2  ARG 302           2HD      ARG 302   8.629  -8.685   9.959
  731    HD3  ARG 302           1HD      ARG 302   9.297  -7.369  10.921
  732   HH11  ARG 302          1HH1      ARG 302  10.878  -7.502  11.683
  733   HH12  ARG 302          2HH1      ARG 302  11.893  -8.187  12.905
  734   HH21  ARG 302          1HH2      ARG 302   9.656 -10.729  13.778
  735   HH22  ARG 302          2HH2      ARG 302  11.203 -10.016  14.090
  736    H    GLU 303           H        GLU 303   4.863  -5.665  11.584
  737    HA   GLU 303           HA       GLU 303   4.459  -4.830   8.801
  738    HB2  GLU 303           2HB      GLU 303   3.108  -2.866   9.828
  739    HB3  GLU 303           1HB      GLU 303   2.317  -4.413   9.563
  740    HG2  GLU 303           2HG      GLU 303   3.544  -4.183  12.197
  741    HG3  GLU 303           1HG      GLU 303   2.301  -2.973  11.888
  742    H    THR 304           H        THR 304   5.507  -2.949   8.186
  743    HA   THR 304           HA       THR 304   7.182  -1.656  10.216
  744    HB   THR 304           HB       THR 304   8.071  -3.292   8.030
  745    HG1  THR 304           1HG      THR 304   9.224  -3.551   9.784
  746   HG21  THR 304          3HG2      THR 304   9.220  -0.516   7.993
  747   HG22  THR 304          1HG2      THR 304   8.211  -1.225   6.731
  748   HG23  THR 304          2HG2      THR 304   9.797  -1.912   7.082
  749    H    GLN 305           H        GLN 305   7.673   0.525   9.876
  750    HA   GLN 305           HA       GLN 305   5.746   1.945   8.276
  751    HB2  GLN 305           2HB      GLN 305   7.979   2.868  10.082
  752    HB3  GLN 305           1HB      GLN 305   6.972   3.981   9.163
  753    HG2  GLN 305           2HG      GLN 305   5.190   3.704  10.513
  754    HG3  GLN 305           1HG      GLN 305   5.535   2.000  10.804
  755   HE21  GLN 305          1HE2      GLN 305   7.230   1.482  12.323
  756   HE22  GLN 305          2HE2      GLN 305   7.564   2.563  13.629
  757    H    VAL 306           H        VAL 306   6.134   3.254   6.519
  758    HA   VAL 306           HA       VAL 306   8.807   3.101   5.302
  759    HB   VAL 306           HB       VAL 306   7.713   2.838   3.071
  760   HG11  VAL 306          1HG1      VAL 306   7.140   0.601   5.019
  761   HG12  VAL 306          2HG1      VAL 306   8.709   0.937   4.288
  762   HG13  VAL 306          3HG1      VAL 306   7.352   0.449   3.274
  763   HG21  VAL 306          3HG2      VAL 306   5.363   1.819   3.187
  764   HG22  VAL 306          1HG2      VAL 306   5.505   3.567   3.383
  765   HG23  VAL 306          2HG2      VAL 306   5.271   2.538   4.796
  Start of MODEL   13
    1    HA   MET   1           HA       MET   1  -8.416   1.031  -9.238
    2    H1   MET   1           1HT      MET   1  -7.897  -0.056  -6.550
    3    H2   MET   1           2HT      MET   1  -7.459  -0.790  -8.037
    4    H3   MET   1           3HT      MET   1  -9.114  -0.568  -7.644
    5    HB2  MET   1           2HB      MET   1  -9.308   1.684  -6.502
    6    HB3  MET   1           1HB      MET   1  -8.720   3.056  -7.431
    7    HG2  MET   1           2HG      MET   1 -10.422   1.582  -9.127
    8    HG3  MET   1           1HG      MET   1 -11.238   1.733  -7.572
    9    HE1  MET   1           3HE      MET   1 -10.709   4.356  -6.304
   10    HE2  MET   1           1HE      MET   1 -12.348   3.840  -6.705
   11    HE3  MET   1           2HE      MET   1 -11.812   5.470  -7.113
   12    H    GLU   2           H        GLU   2  -7.115   2.841  -9.797
   13    HA   GLU   2           HA       GLU   2  -4.401   2.645  -8.773
   14    HB2  GLU   2           2HB      GLU   2  -3.756   4.005 -10.657
   15    HB3  GLU   2           1HB      GLU   2  -4.832   2.734 -11.214
   16    HG2  GLU   2           2HG      GLU   2  -6.596   4.740 -10.740
   17    HG3  GLU   2           1HG      GLU   2  -5.169   5.645 -11.238
   18    H    ILE   3           H        ILE   3  -3.245   4.301  -7.786
   19    HA   ILE   3           HA       ILE   3  -4.635   6.797  -7.190
   20    HB   ILE   3           HB       ILE   3  -3.464   4.969  -5.084
   21   HG12  ILE   3          2HG1      ILE   3  -6.253   6.103  -5.141
   22   HG13  ILE   3          1HG1      ILE   3  -5.863   4.612  -5.992
   23   HG21  ILE   3          1HG2      ILE   3  -4.206   6.771  -3.500
   24   HG22  ILE   3          2HG2      ILE   3  -4.408   7.818  -4.905
   25   HG23  ILE   3          3HG2      ILE   3  -2.817   7.173  -4.507
   26   HD11  ILE   3          3HD1      ILE   3  -5.126   3.611  -3.890
   27   HD12  ILE   3          1HD1      ILE   3  -6.804   4.151  -3.809
   28   HD13  ILE   3          2HD1      ILE   3  -5.533   5.102  -3.042
   29    H    LYS   4           H        LYS   4  -3.174   7.986  -8.398
   30    HA   LYS   4           HA       LYS   4  -0.315   7.716  -7.837
   31    HB2  LYS   4           2HB      LYS   4  -1.933   8.653 -10.079
   32    HB3  LYS   4           1HB      LYS   4  -0.653   9.784  -9.669
   33    HG2  LYS   4           2HG      LYS   4   1.028   8.222 -10.109
   34    HG3  LYS   4           1HG      LYS   4  -0.101   6.866 -10.063
   35    HD2  LYS   4           2HD      LYS   4  -0.982   7.368 -12.157
   36    HD3  LYS   4           1HD      LYS   4  -0.413   9.036 -12.103
   37    HE2  LYS   4           2HE      LYS   4   1.905   7.530 -11.927
   38    HE3  LYS   4           1HE      LYS   4   0.912   6.647 -13.084
   39    HZ1  LYS   4           3HZ      LYS   4   0.644   8.713 -14.342
   40    HZ2  LYS   4           1HZ      LYS   4   2.273   8.272 -14.207
   41    HZ3  LYS   4           2HZ      LYS   4   1.653   9.519 -13.248
   42    H    LEU   5           H        LEU   5   0.958   9.479  -7.015
   43    HA   LEU   5           HA       LEU   5  -0.438  11.907  -6.246
   44    HG   LEU   5           HG       LEU   5  -1.864  11.337  -4.528
   45    HB2  LEU   5           2HB      LEU   5   0.268   9.766  -4.409
   46    HB3  LEU   5           1HB      LEU   5   1.065  11.268  -3.984
   47   HD11  LEU   5          1HD1      LEU   5  -0.550   9.950  -2.250
   48   HD12  LEU   5          2HD1      LEU   5  -2.066   9.587  -3.076
   49   HD13  LEU   5          3HD1      LEU   5  -1.985  10.920  -1.925
   50   HD21  LEU   5          3HD2      LEU   5  -1.364  13.439  -3.944
   51   HD22  LEU   5          1HD2      LEU   5   0.181  12.974  -3.232
   52   HD23  LEU   5          2HD2      LEU   5  -1.304  12.817  -2.295
   53    H    ILE   6           H        ILE   6   1.201  13.498  -5.277
   54    HA   ILE   6           HA       ILE   6   3.667  13.286  -6.842
   55    HB   ILE   6           HB       ILE   6   2.258  15.340  -7.058
   56   HG12  ILE   6          2HG1      ILE   6   4.977  15.975  -5.910
   57   HG13  ILE   6          1HG1      ILE   6   4.769  15.204  -7.479
   58   HG21  ILE   6          1HG2      ILE   6   1.723  15.372  -4.557
   59   HG22  ILE   6          2HG2      ILE   6   2.036  16.917  -5.347
   60   HG23  ILE   6          3HG2      ILE   6   3.289  16.159  -4.364
   61   HD11  ILE   6          3HD1      ILE   6   4.135  17.983  -6.632
   62   HD12  ILE   6          1HD1      ILE   6   3.217  17.250  -7.948
   63   HD13  ILE   6          2HD1      ILE   6   4.971  17.403  -8.073
   64    H    LYS   7           H        LYS   7   5.509  12.714  -5.910
   65    HA   LYS   7           HA       LYS   7   5.669  12.593  -3.011
   66    HB2  LYS   7           2HB      LYS   7   6.671  11.011  -5.101
   67    HB3  LYS   7           1HB      LYS   7   8.082  11.760  -4.368
   68    HG2  LYS   7           2HG      LYS   7   5.983  10.169  -2.905
   69    HG3  LYS   7           1HG      LYS   7   7.581   9.588  -3.372
   70    HD2  LYS   7           2HD      LYS   7   7.021  11.888  -1.498
   71    HD3  LYS   7           1HD      LYS   7   7.510  10.263  -1.014
   72    HE2  LYS   7           2HE      LYS   7   9.536  10.678  -2.578
   73    HE3  LYS   7           1HE      LYS   7   9.093  12.378  -2.424
   74    HZ1  LYS   7           3HZ      LYS   7  10.753  11.742  -0.790
   75    HZ2  LYS   7           1HZ      LYS   7   9.728  10.545  -0.172
   76    HZ3  LYS   7           2HZ      LYS   7   9.309  12.177  -0.025
   77    H    GLY   8           H        GLY   8   6.229  14.409  -2.015
   78    HA2  GLY   8           2HA      GLY   8   8.169  16.224  -3.251
   79    HA3  GLY   8           1HA      GLY   8   7.144  16.588  -1.872
   80    HA   PRO   9           HA       PRO   9  11.402  15.633  -0.268
   81    HB2  PRO   9           2HB      PRO   9  11.275  18.175   1.129
   82    HB3  PRO   9           1HB      PRO   9  12.408  17.657  -0.119
   83    HG2  PRO   9           2HG      PRO   9  10.540  19.597  -0.511
   84    HG3  PRO   9           1HG      PRO   9  11.156  18.563  -1.812
   85    HD2  PRO   9           2HD      PRO   9   8.604  18.332  -0.252
   86    HD3  PRO   9           1HD      PRO   9   8.877  18.139  -2.000
   87    H    LYS  10           H        LYS  10   9.238  14.379   0.785
   88    HA   LYS  10           HA       LYS  10   9.676  14.696   3.652
   89    HB2  LYS  10           2HB      LYS  10   7.013  14.905   2.275
   90    HB3  LYS  10           1HB      LYS  10   7.120  14.309   3.925
   91    HG2  LYS  10           2HG      LYS  10   8.041  16.368   4.690
   92    HG3  LYS  10           1HG      LYS  10   8.232  16.959   3.039
   93    HD2  LYS  10           2HD      LYS  10   6.224  17.900   3.224
   94    HD3  LYS  10           1HD      LYS  10   5.533  16.277   3.264
   95    HE2  LYS  10           2HE      LYS  10   5.924  16.281   5.746
   96    HE3  LYS  10           1HE      LYS  10   6.353  17.985   5.607
   97    HZ1  LYS  10           3HZ      LYS  10   4.173  18.499   4.842
   98    HZ2  LYS  10           1HZ      LYS  10   4.006  17.563   6.244
   99    HZ3  LYS  10           2HZ      LYS  10   3.749  16.864   4.725
  100    H    GLY  11           H        GLY  11   7.228  12.808   1.879
  101    HA2  GLY  11           2HA      GLY  11   8.044  10.460   1.262
  102    HA3  GLY  11           1HA      GLY  11   8.483  10.369   2.960
  103    H    LEU  12           H        LEU  12   6.771   8.542   1.765
  104    HA   LEU  12           HA       LEU  12   4.080   8.901   1.762
  105    HG   LEU  12           HG       LEU  12   5.291   7.384   0.191
  106    HB2  LEU  12           2HB      LEU  12   5.508   6.535   2.973
  107    HB3  LEU  12           1HB      LEU  12   3.849   6.550   2.411
  108   HD11  LEU  12          1HD1      LEU  12   6.714   4.956   1.192
  109   HD12  LEU  12          2HD1      LEU  12   7.294   6.563   1.628
  110   HD13  LEU  12          3HD1      LEU  12   7.186   6.096  -0.068
  111   HD21  LEU  12          3HD2      LEU  12   4.649   5.268  -0.754
  112   HD22  LEU  12          1HD2      LEU  12   3.351   5.850   0.288
  113   HD23  LEU  12          2HD2      LEU  12   4.430   4.572   0.851
  114    H    GLY  13           H        GLY  13   5.948   8.039   4.694
  115    HA2  GLY  13           2HA      GLY  13   5.588   8.642   6.886
  116    HA3  GLY  13           1HA      GLY  13   4.326   9.726   6.332
  117    H    PHE  14           H        PHE  14   4.674   6.175   6.144
  118    HA   PHE  14           HA       PHE  14   2.677   5.726   8.129
  119    HD1  PHE  14           2HD      PHE  14   2.557   3.075   5.216
  120    HD2  PHE  14           1HD      PHE  14   1.139   6.936   4.099
  121    HE1  PHE  14           2HE      PHE  14   2.825   2.484   2.847
  122    HE2  PHE  14           1HE      PHE  14   1.404   6.344   1.729
  123    HZ   PHE  14           HZ       PHE  14   2.247   4.118   1.099
  124    HB2  PHE  14           2HB      PHE  14   0.982   4.666   6.703
  125    HB3  PHE  14           1HB      PHE  14   1.172   6.366   6.319
  126    H    SER  15           H        SER  15   1.934   3.140   7.688
  127    HA   SER  15           HA       SER  15   4.438   1.726   7.165
  128    HG   SER  15           HG       SER  15   2.424   1.186  10.627
  129    HB2  SER  15           2HB      SER  15   3.558   0.150   9.059
  130    HB3  SER  15           1HB      SER  15   4.462   1.600   9.472
  131    H    ILE  16           H        ILE  16   3.914  -0.765   7.158
  132    HA   ILE  16           HA       ILE  16   1.305  -1.449   6.117
  133    HB   ILE  16           HB       ILE  16   1.878  -2.086   3.950
  134   HG12  ILE  16          2HG1      ILE  16   4.107  -3.103   4.631
  135   HG13  ILE  16          1HG1      ILE  16   4.011  -2.404   3.021
  136   HG21  ILE  16          1HG2      ILE  16   2.801  -0.104   2.843
  137   HG22  ILE  16          2HG2      ILE  16   3.327   0.501   4.414
  138   HG23  ILE  16          3HG2      ILE  16   1.607   0.303   4.076
  139   HD11  ILE  16          3HD1      ILE  16   4.886  -0.479   4.978
  140   HD12  ILE  16          1HD1      ILE  16   5.629  -0.971   3.455
  141   HD13  ILE  16          2HD1      ILE  16   5.927  -1.902   4.925
  142    H    ALA  17           H        ALA  17   1.361  -3.785   5.336
  143    HA   ALA  17           HA       ALA  17   3.370  -5.448   6.652
  144    HB1  ALA  17           3HB      ALA  17   0.553  -5.237   7.432
  145    HB2  ALA  17           1HB      ALA  17   1.931  -5.884   8.322
  146    HB3  ALA  17           2HB      ALA  17   1.102  -6.888   7.136
  147    H    GLY  18           H        GLY  18   3.089  -7.830   5.755
  148    HA2  GLY  18           2HA      GLY  18   1.505  -8.444   3.635
  149    HA3  GLY  18           1HA      GLY  18   2.770  -7.501   2.892
  150    H    GLY  19           H        GLY  19   1.823 -10.490   2.865
  151    HA2  GLY  19           2HA      GLY  19   3.246 -12.145   1.913
  152    HA3  GLY  19           1HA      GLY  19   4.584 -11.485   2.833
  153    H    VAL  20           H        VAL  20   3.980 -14.202   2.695
  154    HA   VAL  20           HA       VAL  20   2.479 -15.120   4.913
  155    HB   VAL  20           HB       VAL  20   3.087 -16.540   2.958
  156   HG11  VAL  20          1HG1      VAL  20   5.234 -17.473   2.672
  157   HG12  VAL  20          2HG1      VAL  20   5.793 -16.863   4.230
  158   HG13  VAL  20          3HG1      VAL  20   5.489 -15.743   2.901
  159   HG21  VAL  20          3HG2      VAL  20   4.012 -17.722   5.572
  160   HG22  VAL  20          1HG2      VAL  20   3.321 -18.577   4.193
  161   HG23  VAL  20          2HG2      VAL  20   2.321 -17.472   5.136
  162    H    GLY  21           H        GLY  21   3.045 -15.517   7.008
  163    HA2  GLY  21           2HA      GLY  21   4.452 -15.765   8.872
  164    HA3  GLY  21           1HA      GLY  21   5.831 -15.377   7.855
  165    H    ASN  22           H        ASN  22   4.215 -12.965   6.891
  166    HA   ASN  22           HA       ASN  22   4.448 -11.240   9.249
  167    HB2  ASN  22           2HB      ASN  22   5.251  -9.496   7.383
  168    HB3  ASN  22           1HB      ASN  22   6.394 -10.493   8.264
  169   HD21  ASN  22          1HD2      ASN  22   7.958 -10.940   6.876
  170   HD22  ASN  22          2HD2      ASN  22   7.739 -11.590   5.290
  171    H    GLN  23           H        GLN  23   2.227 -12.500   7.434
  172    HA   GLN  23           HA       GLN  23   0.904 -10.621   5.944
  173    HB2  GLN  23           2HB      GLN  23  -0.078 -12.927   7.603
  174    HB3  GLN  23           1HB      GLN  23  -1.187 -11.940   6.663
  175    HG2  GLN  23           2HG      GLN  23   0.108 -12.499   4.632
  176    HG3  GLN  23           1HG      GLN  23   1.111 -13.570   5.608
  177   HE21  GLN  23          1HE2      GLN  23  -2.352 -12.943   5.066
  178   HE22  GLN  23          2HE2      GLN  23  -2.803 -14.608   4.958
  179    H    HIS  24           H        HIS  24  -0.683  -9.128   6.264
  180    HA   HIS  24           HA       HIS  24  -0.814  -7.894   8.895
  181    HD1  HIS  24           1HD      HIS  24  -0.434  -5.090   9.078
  182    HD2  HIS  24           2HD      HIS  24  -4.131  -5.479   7.233
  183    HE1  HIS  24           1HE      HIS  24  -1.839  -3.247  10.002
  184    HE2  HIS  24           2HE      HIS  24  -4.026  -3.399   8.769
  185    HB2  HIS  24           2HB      HIS  24  -0.522  -6.537   6.800
  186    HB3  HIS  24           1HB      HIS  24  -2.132  -7.022   6.311
  187    H    ILE  25           H        ILE  25  -2.766  -9.907   6.861
  188    HA   ILE  25           HA       ILE  25  -4.826 -10.006   8.907
  189    HB   ILE  25           HB       ILE  25  -5.670  -9.533   6.054
  190   HG12  ILE  25          2HG1      ILE  25  -5.484  -7.477   8.270
  191   HG13  ILE  25          1HG1      ILE  25  -4.450  -7.539   6.847
  192   HG21  ILE  25          1HG2      ILE  25  -7.154  -9.327   8.669
  193   HG22  ILE  25          2HG2      ILE  25  -7.273 -10.655   7.514
  194   HG23  ILE  25          3HG2      ILE  25  -7.833  -9.043   7.066
  195   HD11  ILE  25          3HD1      ILE  25  -7.395  -6.953   6.950
  196   HD12  ILE  25          1HD1      ILE  25  -6.502  -7.232   5.454
  197   HD13  ILE  25          2HD1      ILE  25  -6.086  -5.863   6.488
  198    HA   PRO  26           HA       PRO  26  -4.430 -14.330   7.903
  199    HB2  PRO  26           2HB      PRO  26  -6.928 -15.073   8.876
  200    HB3  PRO  26           1HB      PRO  26  -5.450 -14.958   9.833
  201    HG2  PRO  26           2HG      PRO  26  -7.678 -12.994   9.543
  202    HG3  PRO  26           1HG      PRO  26  -6.734 -13.419  10.982
  203    HD2  PRO  26           2HD      PRO  26  -6.280 -11.152   9.636
  204    HD3  PRO  26           1HD      PRO  26  -4.945 -12.079  10.355
  205    H    GLY  27           H        GLY  27  -4.760 -15.302   6.004
  206    HA2  GLY  27           2HA      GLY  27  -6.050 -16.204   4.261
  207    HA3  GLY  27           1HA      GLY  27  -7.373 -15.146   4.716
  208    H    ASP  28           H        ASP  28  -5.009 -12.974   4.685
  209    HA   ASP  28           HA       ASP  28  -4.996 -12.607   1.770
  210    HB2  ASP  28           2HB      ASP  28  -6.392 -11.013   3.667
  211    HB3  ASP  28           1HB      ASP  28  -5.042 -10.055   3.066
  212    H    ASN  29           H        ASN  29  -2.936 -12.724   1.153
  213    HA   ASN  29           HA       ASN  29  -0.815 -11.882   2.974
  214    HB2  ASN  29           2HB      ASN  29  -0.208 -12.949   0.258
  215    HB3  ASN  29           1HB      ASN  29   0.645 -13.197   1.778
  216   HD21  ASN  29          1HD2      ASN  29  -1.903 -14.289  -0.294
  217   HD22  ASN  29          2HD2      ASN  29  -2.264 -15.740   0.570
  218    H    SER  30           H        SER  30  -2.657 -10.077   1.164
  219    HA   SER  30           HA       SER  30  -0.863  -8.748  -0.609
  220    HG   SER  30           HG       SER  30  -4.440  -9.071  -0.255
  221    HB2  SER  30           2HB      SER  30  -3.341  -7.494   0.567
  222    HB3  SER  30           1HB      SER  30  -2.620  -7.221  -1.018
  223    H    ILE  31           H        ILE  31  -0.824  -6.144  -0.232
  224    HA   ILE  31           HA       ILE  31   0.551  -5.860   2.345
  225    HB   ILE  31           HB       ILE  31   0.747  -3.809   0.154
  226   HG12  ILE  31          2HG1      ILE  31   1.512  -5.661  -1.046
  227   HG13  ILE  31          1HG1      ILE  31   2.981  -4.980  -0.370
  228   HG21  ILE  31          1HG2      ILE  31   1.483  -3.251   2.439
  229   HG22  ILE  31          2HG2      ILE  31   2.773  -3.174   1.239
  230   HG23  ILE  31          3HG2      ILE  31   2.668  -4.553   2.334
  231   HD11  ILE  31          3HD1      ILE  31   2.656  -6.684   1.516
  232   HD12  ILE  31          1HD1      ILE  31   3.221  -7.260  -0.050
  233   HD13  ILE  31          2HD1      ILE  31   1.533  -7.474   0.412
  234    H    TYR  32           H        TYR  32  -0.576  -4.991   3.936
  235    HA   TYR  32           HA       TYR  32  -2.639  -2.983   3.302
  236    HD1  TYR  32           2HD      TYR  32  -2.504  -6.624   3.567
  237    HD2  TYR  32           1HD      TYR  32  -5.690  -3.972   4.524
  238    HE1  TYR  32           2HE      TYR  32  -4.053  -8.052   2.305
  239    HE2  TYR  32           1HE      TYR  32  -7.259  -5.388   3.273
  240    HH   TYR  32           HH       TYR  32  -6.608  -7.363   1.080
  241    HB2  TYR  32           2HB      TYR  32  -2.453  -4.979   5.558
  242    HB3  TYR  32           1HB      TYR  32  -3.618  -3.662   5.533
  243    H    VAL  33           H        VAL  33  -2.728  -1.090   4.497
  244    HA   VAL  33           HA       VAL  33  -0.275  -0.265   5.756
  245    HB   VAL  33           HB       VAL  33  -2.869   1.161   5.183
  246   HG11  VAL  33          1HG1      VAL  33  -0.596   2.031   6.926
  247   HG12  VAL  33          2HG1      VAL  33  -2.333   2.220   7.171
  248   HG13  VAL  33          3HG1      VAL  33  -1.498   3.219   5.982
  249   HG21  VAL  33          3HG2      VAL  33  -1.210   2.626   3.896
  250   HG22  VAL  33          1HG2      VAL  33  -1.549   1.019   3.251
  251   HG23  VAL  33          2HG2      VAL  33  -0.056   1.316   4.141
  252    H    THR  34           H        THR  34   0.178  -0.395   7.856
  253    HA   THR  34           HA       THR  34  -1.946  -1.200   9.695
  254    HB   THR  34           HB       THR  34  -0.013  -2.631   9.665
  255    HG1  THR  34           1HG      THR  34  -0.510  -2.763  11.696
  256   HG21  THR  34          3HG2      THR  34   1.920  -0.926  10.941
  257   HG22  THR  34          1HG2      THR  34   1.504  -0.333   9.334
  258   HG23  THR  34          2HG2      THR  34   2.094  -1.982   9.538
  259    H    LYS  35           H        LYS  35   0.179   1.549   9.166
  260    HA   LYS  35           HA       LYS  35  -1.296   3.069  11.129
  261    HB2  LYS  35           2HB      LYS  35   1.626   2.455  11.577
  262    HB3  LYS  35           1HB      LYS  35   0.799   3.799  12.345
  263    HG2  LYS  35           2HG      LYS  35  -0.862   1.932  13.130
  264    HG3  LYS  35           1HG      LYS  35   0.519   0.877  12.827
  265    HD2  LYS  35           2HD      LYS  35   0.979   1.404  14.988
  266    HD3  LYS  35           1HD      LYS  35   1.758   2.789  14.221
  267    HE2  LYS  35           2HE      LYS  35  -0.465   3.994  14.489
  268    HE3  LYS  35           1HE      LYS  35  -0.940   2.663  15.544
  269    HZ1  LYS  35           3HZ      LYS  35  -0.066   4.503  16.821
  270    HZ2  LYS  35           1HZ      LYS  35   1.386   4.466  15.953
  271    HZ3  LYS  35           2HZ      LYS  35   0.967   3.172  16.958
  272    H    ILE  36           H        ILE  36  -1.589   5.036  10.296
  273    HA   ILE  36           HA       ILE  36   0.356   6.021   8.329
  274    HB   ILE  36           HB       ILE  36  -2.482   6.933   8.818
  275   HG12  ILE  36          2HG1      ILE  36  -1.256   5.269   6.606
  276   HG13  ILE  36          1HG1      ILE  36  -2.392   4.706   7.828
  277   HG21  ILE  36          1HG2      ILE  36  -0.527   7.731   6.662
  278   HG22  ILE  36          2HG2      ILE  36  -1.054   8.744   8.006
  279   HG23  ILE  36          3HG2      ILE  36  -2.211   8.243   6.772
  280   HD11  ILE  36          3HD1      ILE  36  -3.792   5.008   6.065
  281   HD12  ILE  36          1HD1      ILE  36  -2.864   6.358   5.412
  282   HD13  ILE  36          2HD1      ILE  36  -3.902   6.602   6.818
  283    H    ILE  37           H        ILE  37   1.673   7.659   8.843
  284    HA   ILE  37           HA       ILE  37   1.452   8.957  11.407
  285    HB   ILE  37           HB       ILE  37   3.487   8.894   9.222
  286   HG12  ILE  37          2HG1      ILE  37   4.911   8.648  11.416
  287   HG13  ILE  37          1HG1      ILE  37   3.350   8.302  12.152
  288   HG21  ILE  37          1HG2      ILE  37   3.451  11.229   9.520
  289   HG22  ILE  37          2HG2      ILE  37   4.806  10.640  10.481
  290   HG23  ILE  37          3HG2      ILE  37   3.291  11.083  11.271
  291   HD11  ILE  37          3HD1      ILE  37   4.360   6.832   9.740
  292   HD12  ILE  37          1HD1      ILE  37   3.036   6.389  10.818
  293   HD13  ILE  37          2HD1      ILE  37   4.702   6.319  11.393
  294    H    GLU  38           H        GLU  38   1.173  11.176  11.784
  295    HA   GLU  38           HA       GLU  38  -0.754  12.486  10.244
  296    HB2  GLU  38           2HB      GLU  38   1.070  13.329  12.457
  297    HB3  GLU  38           1HB      GLU  38   0.161  14.560  11.592
  298    HG2  GLU  38           2HG      GLU  38  -1.897  13.691  12.278
  299    HG3  GLU  38           1HG      GLU  38  -1.184  12.153  12.764
  300    H    GLY  39           H        GLY  39  -0.676  14.338   8.927
  301    HA2  GLY  39           2HA      GLY  39   0.113  15.604   7.190
  302    HA3  GLY  39           1HA      GLY  39   1.597  15.726   8.116
  303    H    GLY  40           H        GLY  40   0.520  12.568   7.126
  304    HA2  GLY  40           2HA      GLY  40   2.876  12.330   5.426
  305    HA3  GLY  40           1HA      GLY  40   1.856  11.014   5.987
  306    H    ALA  41           H        ALA  41   2.642  10.937   3.436
  307    HA   ALA  41           HA       ALA  41   1.231  12.223   1.454
  308    HB1  ALA  41           3HB      ALA  41   2.070   9.326   1.483
  309    HB2  ALA  41           1HB      ALA  41   3.086  10.695   1.027
  310    HB3  ALA  41           2HB      ALA  41   1.679  10.279   0.049
  311    H    ALA  42           H        ALA  42   0.261   9.226   3.152
  312    HA   ALA  42           HA       ALA  42  -2.215   9.006   1.757
  313    HB1  ALA  42           3HB      ALA  42  -2.716   7.359   3.663
  314    HB2  ALA  42           1HB      ALA  42  -1.049   7.649   4.160
  315    HB3  ALA  42           2HB      ALA  42  -1.390   6.983   2.562
  316    H    HIS  43           H        HIS  43  -1.421   9.880   5.117
  317    HA   HIS  43           HA       HIS  43  -3.941  10.488   6.053
  318    HD1  HIS  43           1HD      HIS  43  -2.356  14.051   7.559
  319    HD2  HIS  43           2HD      HIS  43  -4.000  10.683   9.354
  320    HE1  HIS  43           1HE      HIS  43  -3.681  14.913   9.512
  321    HE2  HIS  43           2HE      HIS  43  -4.608  12.851  10.629
  322    HB2  HIS  43           2HB      HIS  43  -1.945  10.354   7.470
  323    HB3  HIS  43           1HB      HIS  43  -1.331  11.840   6.759
  324    H    LYS  44           H        LYS  44  -1.674  12.671   4.392
  325    HA   LYS  44           HA       LYS  44  -3.343  14.966   4.584
  326    HB2  LYS  44           2HB      LYS  44  -0.930  14.291   2.921
  327    HB3  LYS  44           1HB      LYS  44  -1.801  15.801   2.693
  328    HG2  LYS  44           2HG      LYS  44  -1.410  16.361   5.055
  329    HG3  LYS  44           1HG      LYS  44  -0.481  14.872   5.234
  330    HD2  LYS  44           2HD      LYS  44   1.265  15.647   3.935
  331    HD3  LYS  44           1HD      LYS  44   0.250  16.812   3.082
  332    HE2  LYS  44           2HE      LYS  44   0.070  17.753   5.611
  333    HE3  LYS  44           1HE      LYS  44   1.692  17.062   5.639
  334    HZ1  LYS  44           3HZ      LYS  44   1.840  19.329   4.961
  335    HZ2  LYS  44           1HZ      LYS  44   0.662  19.121   3.764
  336    HZ3  LYS  44           2HZ      LYS  44   2.171  18.370   3.608
  337    H    ASP  45           H        ASP  45  -2.887  12.494   2.084
  338    HA   ASP  45           HA       ASP  45  -4.412  13.785   0.083
  339    HB2  ASP  45           2HB      ASP  45  -2.784  11.827  -0.195
  340    HB3  ASP  45           1HB      ASP  45  -4.114  10.795   0.322
  341    H    GLY  46           H        GLY  46  -5.310  11.039   2.210
  342    HA2  GLY  46           2HA      GLY  46  -7.418  11.042   3.380
  343    HA3  GLY  46           1HA      GLY  46  -8.096  11.993   2.068
  344    H    LYS  47           H        LYS  47  -6.757  10.225   0.041
  345    HA   LYS  47           HA       LYS  47  -8.901   8.423  -0.352
  346    HB2  LYS  47           2HB      LYS  47  -6.228   8.774  -1.679
  347    HB3  LYS  47           1HB      LYS  47  -7.295   7.452  -2.128
  348    HG2  LYS  47           2HG      LYS  47  -8.385  10.220  -2.098
  349    HG3  LYS  47           1HG      LYS  47  -7.329   9.730  -3.424
  350    HD2  LYS  47           2HD      LYS  47  -8.982   8.600  -4.392
  351    HD3  LYS  47           1HD      LYS  47  -9.273   7.678  -2.915
  352    HE2  LYS  47           2HE      LYS  47 -10.260  10.454  -2.898
  353    HE3  LYS  47           1HE      LYS  47 -11.060   9.372  -4.036
  354    HZ1  LYS  47           3HZ      LYS  47 -11.507   7.848  -2.204
  355    HZ2  LYS  47           1HZ      LYS  47 -12.181   9.372  -1.907
  356    HZ3  LYS  47           2HZ      LYS  47 -10.761   8.908  -1.117
  357    H    LEU  48           H        LEU  48  -5.597   7.967   0.902
  358    HA   LEU  48           HA       LEU  48  -6.045   5.114   1.225
  359    HG   LEU  48           HG       LEU  48  -4.147   3.814   1.379
  360    HB2  LEU  48           2HB      LEU  48  -3.861   6.289   0.470
  361    HB3  LEU  48           1HB      LEU  48  -3.639   6.641   2.171
  362   HD11  LEU  48          1HD1      LEU  48  -2.487   4.501  -0.242
  363   HD12  LEU  48          2HD1      LEU  48  -1.738   3.485   0.990
  364   HD13  LEU  48          3HD1      LEU  48  -1.510   5.233   1.030
  365   HD21  LEU  48          3HD2      LEU  48  -3.974   4.549   3.739
  366   HD22  LEU  48          1HD2      LEU  48  -2.310   5.048   3.423
  367   HD23  LEU  48          2HD2      LEU  48  -2.766   3.350   3.277
  368    H    GLN  49           H        GLN  49  -6.785   4.224   3.063
  369    HA   GLN  49           HA       GLN  49  -6.376   5.560   5.620
  370    HB2  GLN  49           2HB      GLN  49  -8.651   5.530   6.212
  371    HB3  GLN  49           1HB      GLN  49  -8.610   6.211   4.599
  372    HG2  GLN  49           2HG      GLN  49  -9.179   3.308   5.125
  373    HG3  GLN  49           1HG      GLN  49 -10.439   4.539   5.082
  374   HE21  GLN  49          1HE2      GLN  49  -8.195   2.661   3.230
  375   HE22  GLN  49          2HE2      GLN  49  -8.785   3.111   1.670
  376    H    ILE  50           H        ILE  50  -6.394   4.144   7.419
  377    HA   ILE  50           HA       ILE  50  -5.267   1.723   7.340
  378    HB   ILE  50           HB       ILE  50  -7.545   2.391   9.214
  379   HG12  ILE  50          2HG1      ILE  50  -5.853   4.111   9.328
  380   HG13  ILE  50          1HG1      ILE  50  -5.711   3.094  10.757
  381   HG21  ILE  50          1HG2      ILE  50  -7.157   0.085   9.445
  382   HG22  ILE  50          2HG2      ILE  50  -6.250   0.838  10.758
  383   HG23  ILE  50          3HG2      ILE  50  -5.409   0.283   9.311
  384   HD11  ILE  50          3HD1      ILE  50  -3.847   1.890   9.631
  385   HD12  ILE  50          1HD1      ILE  50  -3.523   3.593   9.956
  386   HD13  ILE  50          2HD1      ILE  50  -3.943   3.071   8.325
  387    H    GLY  51           H        GLY  51  -5.770  -0.443   7.023
  388    HA2  GLY  51           2HA      GLY  51  -7.141  -2.281   6.626
  389    HA3  GLY  51           1HA      GLY  51  -8.518  -1.212   6.469
  390    H    ASP  52           H        ASP  52  -6.353   0.244   4.494
  391    HA   ASP  52           HA       ASP  52  -7.605  -0.769   2.169
  392    HB2  ASP  52           2HB      ASP  52  -5.939   0.687   0.940
  393    HB3  ASP  52           1HB      ASP  52  -6.977   1.519   2.087
  394    H    LYS  53           H        LYS  53  -6.778  -1.971   0.487
  395    HA   LYS  53           HA       LYS  53  -4.413  -3.576   1.184
  396    HB2  LYS  53           2HB      LYS  53  -5.483  -5.164  -0.610
  397    HB3  LYS  53           1HB      LYS  53  -6.088  -5.151   1.036
  398    HG2  LYS  53           2HG      LYS  53  -7.353  -3.410  -1.033
  399    HG3  LYS  53           1HG      LYS  53  -7.749  -5.128  -0.944
  400    HD2  LYS  53           2HD      LYS  53  -7.815  -3.637   1.608
  401    HD3  LYS  53           1HD      LYS  53  -9.061  -3.221   0.431
  402    HE2  LYS  53           2HE      LYS  53  -9.876  -5.441   0.373
  403    HE3  LYS  53           1HE      LYS  53  -8.471  -6.058   1.240
  404    HZ1  LYS  53           3HZ      LYS  53 -10.548  -4.253   2.362
  405    HZ2  LYS  53           1HZ      LYS  53  -9.198  -4.836   3.201
  406    HZ3  LYS  53           2HZ      LYS  53 -10.399  -5.908   2.681
  407    H    LEU  54           H        LEU  54  -2.922  -4.051  -0.364
  408    HA   LEU  54           HA       LEU  54  -2.817  -2.159  -2.598
  409    HG   LEU  54           HG       LEU  54  -1.306  -1.897   0.238
  410    HB2  LEU  54           2HB      LEU  54  -0.607  -3.668  -1.233
  411    HB3  LEU  54           1HB      LEU  54  -0.393  -2.552  -2.554
  412   HD11  LEU  54          1HD1      LEU  54   0.876  -1.668   0.569
  413   HD12  LEU  54          2HD1      LEU  54   0.797  -0.259  -0.490
  414   HD13  LEU  54          3HD1      LEU  54   1.231  -1.836  -1.150
  415   HD21  LEU  54          3HD2      LEU  54  -2.353  -0.104  -0.528
  416   HD22  LEU  54          1HD2      LEU  54  -1.970  -0.560  -2.187
  417   HD23  LEU  54          2HD2      LEU  54  -0.852   0.449  -1.268
  418    H    LEU  55           H        LEU  55  -2.899  -2.792  -4.618
  419    HA   LEU  55           HA       LEU  55  -2.927  -5.632  -5.263
  420    HG   LEU  55           HG       LEU  55  -3.699  -6.188  -7.493
  421    HB2  LEU  55           2HB      LEU  55  -4.679  -4.110  -6.156
  422    HB3  LEU  55           1HB      LEU  55  -3.445  -3.255  -7.053
  423   HD11  LEU  55          1HD1      LEU  55  -5.385  -5.398  -9.370
  424   HD12  LEU  55          2HD1      LEU  55  -5.773  -4.171  -8.164
  425   HD13  LEU  55          3HD1      LEU  55  -5.939  -5.882  -7.768
  426   HD21  LEU  55          3HD2      LEU  55  -2.186  -5.599  -9.015
  427   HD22  LEU  55          1HD2      LEU  55  -2.505  -3.881  -8.774
  428   HD23  LEU  55          2HD2      LEU  55  -3.498  -4.814  -9.895
  429    H    ALA  56           H        ALA  56  -1.274  -2.640  -6.359
  430    HA   ALA  56           HA       ALA  56   1.237  -4.004  -6.572
  431    HB1  ALA  56           3HB      ALA  56   1.538  -3.855  -9.010
  432    HB2  ALA  56           1HB      ALA  56  -0.115  -3.265  -9.183
  433    HB3  ALA  56           2HB      ALA  56   0.178  -4.906  -8.607
  434    H    VAL  57           H        VAL  57   2.986  -2.570  -7.397
  435    HA   VAL  57           HA       VAL  57   2.362   0.226  -7.770
  436    HB   VAL  57           HB       VAL  57   2.291   0.061  -5.319
  437   HG11  VAL  57          1HG1      VAL  57   5.213  -0.549  -5.250
  438   HG12  VAL  57          2HG1      VAL  57   4.038  -1.861  -5.342
  439   HG13  VAL  57          3HG1      VAL  57   3.997  -0.734  -3.987
  440   HG21  VAL  57          3HG2      VAL  57   4.100   1.757  -6.827
  441   HG22  VAL  57          1HG2      VAL  57   4.580   1.599  -5.137
  442   HG23  VAL  57          2HG2      VAL  57   2.963   2.172  -5.545
  443    H    ASN  58           H        ASN  58   3.734   1.009  -9.206
  444    HA   ASN  58           HA       ASN  58   5.527   1.227 -10.607
  445    HB2  ASN  58           2HB      ASN  58   6.994   0.382  -8.096
  446    HB3  ASN  58           1HB      ASN  58   7.792   0.982  -9.547
  447   HD21  ASN  58          1HD2      ASN  58   7.070   3.150 -10.302
  448   HD22  ASN  58          2HD2      ASN  58   6.716   4.338  -9.098
  449    H    ASN  59           H        ASN  59   4.407  -0.728 -11.554
  450    HA   ASN  59           HA       ASN  59   4.531  -2.632 -12.768
  451    HB2  ASN  59           2HB      ASN  59   6.983  -1.504 -12.975
  452    HB3  ASN  59           1HB      ASN  59   7.410  -3.090 -12.337
  453   HD21  ASN  59          1HD2      ASN  59   5.819  -1.393 -14.963
  454   HD22  ASN  59          2HD2      ASN  59   5.931  -2.680 -16.109
  455    H    VAL  60           H        VAL  60   5.821  -2.818  -9.503
  456    HA   VAL  60           HA       VAL  60   5.780  -5.735  -9.601
  457    HB   VAL  60           HB       VAL  60   6.545  -5.542  -7.183
  458   HG11  VAL  60          1HG1      VAL  60   8.889  -4.800  -7.924
  459   HG12  VAL  60          2HG1      VAL  60   8.171  -4.635  -9.528
  460   HG13  VAL  60          3HG1      VAL  60   8.164  -6.201  -8.716
  461   HG21  VAL  60          3HG2      VAL  60   7.114  -2.689  -7.965
  462   HG22  VAL  60          1HG2      VAL  60   7.519  -3.477  -6.441
  463   HG23  VAL  60          2HG2      VAL  60   5.831  -3.193  -6.864
  464    H    CYS  61           H        CYS  61   4.267  -6.992  -8.690
  465    HA   CYS  61           HA       CYS  61   1.816  -5.793  -7.856
  466    HG   CYS  61           HG       CYS  61   3.418  -9.642  -8.415
  467    HB2  CYS  61           2HB      CYS  61   0.998  -8.061  -7.559
  468    HB3  CYS  61           1HB      CYS  61   1.834  -7.898  -9.097
  469    H    LEU  62           H        LEU  62   0.841  -5.770  -5.886
  470    HA   LEU  62           HA       LEU  62   2.609  -6.063  -3.576
  471    HG   LEU  62           HG       LEU  62   2.663  -3.622  -4.587
  472    HB2  LEU  62           2HB      LEU  62   0.191  -4.380  -4.150
  473    HB3  LEU  62           1HB      LEU  62   0.757  -4.623  -2.518
  474   HD11  LEU  62          1HD1      LEU  62   1.358  -1.535  -3.024
  475   HD12  LEU  62          2HD1      LEU  62   0.286  -2.326  -4.182
  476   HD13  LEU  62          3HD1      LEU  62   1.784  -1.578  -4.734
  477   HD21  LEU  62          3HD2      LEU  62   3.592  -4.227  -2.452
  478   HD22  LEU  62          1HD2      LEU  62   2.387  -3.256  -1.607
  479   HD23  LEU  62          2HD2      LEU  62   3.610  -2.471  -2.605
  480    H    GLU  63           H        GLU  63   0.623  -8.057  -5.073
  481    HA   GLU  63           HA       GLU  63  -0.798  -8.946  -2.654
  482    HB2  GLU  63           2HB      GLU  63  -1.894  -8.370  -5.045
  483    HB3  GLU  63           1HB      GLU  63  -1.537 -10.073  -5.291
  484    HG2  GLU  63           2HG      GLU  63  -3.399 -10.582  -4.223
  485    HG3  GLU  63           1HG      GLU  63  -2.719  -9.884  -2.754
  486    H    GLU  64           H        GLU  64   1.646  -9.852  -4.940
  487    HA   GLU  64           HA       GLU  64   1.750 -12.524  -3.714
  488    HB2  GLU  64           2HB      GLU  64   1.566 -11.789  -6.489
  489    HB3  GLU  64           1HB      GLU  64   3.032 -12.709  -6.197
  490    HG2  GLU  64           2HG      GLU  64   1.805 -14.542  -6.338
  491    HG3  GLU  64           1HG      GLU  64   1.049 -14.079  -4.814
  492    H    VAL  65           H        VAL  65   3.088 -10.665  -2.394
  493    HA   VAL  65           HA       VAL  65   5.868 -11.367  -2.913
  494    HB   VAL  65           HB       VAL  65   6.633  -9.022  -2.567
  495   HG11  VAL  65          1HG1      VAL  65   6.342  -8.342  -4.849
  496   HG12  VAL  65          2HG1      VAL  65   4.902  -9.346  -5.016
  497   HG13  VAL  65          3HG1      VAL  65   6.484 -10.099  -4.807
  498   HG21  VAL  65          3HG2      VAL  65   3.698  -8.420  -2.897
  499   HG22  VAL  65          1HG2      VAL  65   4.971  -7.216  -3.102
  500   HG23  VAL  65          2HG2      VAL  65   4.744  -8.002  -1.540
  501    H    THR  66           H        THR  66   7.255 -11.110  -1.163
  502    HA   THR  66           HA       THR  66   6.098 -11.583   1.388
  503    HB   THR  66           HB       THR  66   8.899 -10.702   1.428
  504    HG1  THR  66           1HG      THR  66   8.155 -12.869  -0.244
  505   HG21  THR  66          3HG2      THR  66   7.614 -12.181   3.107
  506   HG22  THR  66          1HG2      THR  66   9.284 -12.578   2.703
  507   HG23  THR  66          2HG2      THR  66   7.960 -13.480   1.965
  508    H    HIS  67           H        HIS  67   7.464 -10.124   3.260
  509    HA   HIS  67           HA       HIS  67   6.081  -7.624   3.110
  510    HD1  HIS  67           1HD      HIS  67   4.901  -7.090   6.243
  511    HD2  HIS  67           2HD      HIS  67   8.643  -5.564   5.300
  512    HE1  HIS  67           1HE      HIS  67   4.889  -4.719   7.057
  513    HE2  HIS  67           2HE      HIS  67   7.108  -3.782   6.360
  514    HB2  HIS  67           2HB      HIS  67   6.392  -8.821   5.260
  515    HB3  HIS  67           1HB      HIS  67   8.111  -8.458   5.198
  516    H    GLU  68           H        GLU  68   9.441  -8.642   2.775
  517    HA   GLU  68           HA       GLU  68  10.701  -6.182   2.743
  518    HB2  GLU  68           2HB      GLU  68  12.329  -7.324   1.109
  519    HB3  GLU  68           1HB      GLU  68  12.133  -8.027   2.707
  520    HG2  GLU  68           2HG      GLU  68  10.275  -9.153   0.786
  521    HG3  GLU  68           1HG      GLU  68  11.953  -9.343   0.285
  522    H    GLU  69           H        GLU  69   9.103  -7.868   0.037
  523    HA   GLU  69           HA       GLU  69   9.733  -5.888  -1.903
  524    HB2  GLU  69           2HB      GLU  69   8.468  -8.405  -1.892
  525    HB3  GLU  69           1HB      GLU  69   7.285  -7.271  -2.531
  526    HG2  GLU  69           2HG      GLU  69  10.098  -7.544  -3.565
  527    HG3  GLU  69           1HG      GLU  69   8.698  -8.362  -4.253
  528    H    ALA  70           H        ALA  70   7.047  -6.353   0.326
  529    HA   ALA  70           HA       ALA  70   5.232  -4.449  -0.683
  530    HB1  ALA  70           3HB      ALA  70   4.051  -4.841   1.211
  531    HB2  ALA  70           1HB      ALA  70   5.467  -4.756   2.254
  532    HB3  ALA  70           2HB      ALA  70   5.145  -6.217   1.321
  533    H    VAL  71           H        VAL  71   7.940  -4.163   1.572
  534    HA   VAL  71           HA       VAL  71   7.528  -1.340   2.013
  535    HB   VAL  71           HB       VAL  71   9.678  -3.266   2.888
  536   HG11  VAL  71          1HG1      VAL  71  10.222  -1.136   4.405
  537   HG12  VAL  71          2HG1      VAL  71   9.693  -0.308   2.942
  538   HG13  VAL  71          3HG1      VAL  71  11.033  -1.450   2.872
  539   HG21  VAL  71          3HG2      VAL  71   7.909  -1.647   4.672
  540   HG22  VAL  71          1HG2      VAL  71   8.706  -3.188   4.984
  541   HG23  VAL  71          2HG2      VAL  71   7.302  -3.121   3.920
  542    H    THR  72           H        THR  72   9.672  -3.364   0.078
  543    HA   THR  72           HA       THR  72  11.481  -1.358  -0.707
  544    HB   THR  72           HB       THR  72  10.703  -3.984  -1.970
  545    HG1  THR  72           1HG      THR  72  12.959  -3.105  -0.493
  546   HG21  THR  72          3HG2      THR  72  12.814  -3.794  -3.280
  547   HG22  THR  72          1HG2      THR  72  12.868  -2.085  -2.844
  548   HG23  THR  72          2HG2      THR  72  11.529  -2.708  -3.808
  549    H    ALA  73           H        ALA  73   8.348  -2.341  -1.990
  550    HA   ALA  73           HA       ALA  73   8.601  -0.748  -4.364
  551    HB1  ALA  73           3HB      ALA  73   5.975  -1.789  -3.419
  552    HB2  ALA  73           1HB      ALA  73   7.214  -2.937  -3.928
  553    HB3  ALA  73           2HB      ALA  73   6.640  -1.705  -5.050
  554    H    LEU  74           H        LEU  74   7.070  -0.419  -1.171
  555    HA   LEU  74           HA       LEU  74   5.603   1.950  -1.817
  556    HG   LEU  74           HG       LEU  74   4.212   0.134   1.122
  557    HB2  LEU  74           2HB      LEU  74   6.419   0.573   0.719
  558    HB3  LEU  74           1HB      LEU  74   5.748   2.188   0.785
  559   HD11  LEU  74          1HD1      LEU  74   3.636   2.616   0.786
  560   HD12  LEU  74          2HD1      LEU  74   2.370   1.417   0.526
  561   HD13  LEU  74          3HD1      LEU  74   3.198   2.139  -0.854
  562   HD21  LEU  74          3HD2      LEU  74   3.372  -0.971  -0.721
  563   HD22  LEU  74          1HD2      LEU  74   5.082  -0.821  -1.124
  564   HD23  LEU  74          2HD2      LEU  74   3.907   0.278  -1.846
  565    H    LYS  75           H        LYS  75   8.816   1.210  -0.722
  566    HA   LYS  75           HA       LYS  75   9.419   4.020  -0.185
  567    HB2  LYS  75           2HB      LYS  75  11.434   3.329   0.801
  568    HB3  LYS  75           1HB      LYS  75  10.247   2.128   1.279
  569    HG2  LYS  75           2HG      LYS  75  11.183   0.880  -0.858
  570    HG3  LYS  75           1HG      LYS  75  12.601   1.870  -0.505
  571    HD2  LYS  75           2HD      LYS  75  11.302   0.385   1.729
  572    HD3  LYS  75           1HD      LYS  75  12.287  -0.517   0.580
  573    HE2  LYS  75           2HE      LYS  75  13.565   0.210   2.548
  574    HE3  LYS  75           1HE      LYS  75  14.195   0.893   1.050
  575    HZ1  LYS  75           3HZ      LYS  75  13.358   2.989   1.576
  576    HZ2  LYS  75           1HZ      LYS  75  13.956   2.423   3.055
  577    HZ3  LYS  75           2HZ      LYS  75  12.294   2.393   2.749
  578    H    ASN  76           H        ASN  76   9.703   1.839  -2.828
  579    HA   ASN  76           HA       ASN  76  11.971   3.110  -4.039
  580    HB2  ASN  76           2HB      ASN  76  11.565   0.797  -4.571
  581    HB3  ASN  76           1HB      ASN  76   9.945   1.165  -5.156
  582   HD21  ASN  76          1HD2      ASN  76  12.839   3.072  -5.785
  583   HD22  ASN  76          2HD2      ASN  76  12.868   2.793  -7.484
  584    H    THR  77           H        THR  77  11.031   5.312  -3.759
  585    HA   THR  77           HA       THR  77   9.572   6.077  -6.200
  586    HB   THR  77           HB       THR  77   7.919   6.165  -4.487
  587    HG1  THR  77           1HG      THR  77   7.628   7.973  -5.614
  588   HG21  THR  77          3HG2      THR  77   8.371   7.782  -2.504
  589   HG22  THR  77          1HG2      THR  77  10.061   7.394  -2.830
  590   HG23  THR  77          2HG2      THR  77   8.923   6.107  -2.434
  591    H    SER  78           H        SER  78   9.887   8.343  -6.844
  592    HA   SER  78           HA       SER  78  12.328   9.561  -5.745
  593    HG   SER  78           HG       SER  78  12.113   8.707  -9.714
  594    HB2  SER  78           2HB      SER  78  12.922  10.165  -8.172
  595    HB3  SER  78           1HB      SER  78  13.188   8.497  -7.665
  596    H    ASP  79           H        ASP  79  10.192  10.386  -8.489
  597    HA   ASP  79           HA       ASP  79   9.782  13.029  -7.255
  598    HB2  ASP  79           2HB      ASP  79  10.847  13.073  -9.470
  599    HB3  ASP  79           1HB      ASP  79   9.487  12.183 -10.149
  600    H    PHE  80           H        PHE  80   8.034  10.660  -9.264
  601    HA   PHE  80           HA       PHE  80   5.553  11.423  -7.867
  602    HD1  PHE  80           1HD      PHE  80   5.542  13.768  -9.999
  603    HD2  PHE  80           2HD      PHE  80   2.714  10.594  -9.809
  604    HE1  PHE  80           1HE      PHE  80   3.714  15.408  -9.891
  605    HE2  PHE  80           2HE      PHE  80   0.879  12.231  -9.705
  606    HZ   PHE  80           HZ       PHE  80   1.380  14.642  -9.742
  607    HB2  PHE  80           2HB      PHE  80   6.118  11.452 -10.655
  608    HB3  PHE  80           1HB      PHE  80   4.973  10.147 -10.364
  609    H    VAL  81           H        VAL  81   3.890   9.599  -7.838
  610    HA   VAL  81           HA       VAL  81   5.120   6.953  -7.896
  611    HB   VAL  81           HB       VAL  81   5.333   7.871  -5.568
  612   HG11  VAL  81          1HG1      VAL  81   3.449   8.211  -4.186
  613   HG12  VAL  81          2HG1      VAL  81   2.348   7.544  -5.392
  614   HG13  VAL  81          3HG1      VAL  81   3.127   9.102  -5.672
  615   HG21  VAL  81          3HG2      VAL  81   4.601   5.845  -4.474
  616   HG22  VAL  81          1HG2      VAL  81   5.269   5.453  -6.060
  617   HG23  VAL  81          2HG2      VAL  81   3.521   5.473  -5.818
  618    H    TYR  82           H        TYR  82   3.672   5.251  -8.162
  619    HA   TYR  82           HA       TYR  82   0.845   5.942  -8.583
  620    HD1  TYR  82           1HD      TYR  82   1.666   2.208 -10.324
  621    HD2  TYR  82           2HD      TYR  82  -0.662   5.629 -11.306
  622    HE1  TYR  82           1HE      TYR  82  -0.118   0.748 -11.153
  623    HE2  TYR  82           2HE      TYR  82  -2.459   4.176 -12.133
  624    HH   TYR  82           HH       TYR  82  -3.131   1.548 -11.533
  625    HB2  TYR  82           2HB      TYR  82   1.717   5.828 -10.811
  626    HB3  TYR  82           1HB      TYR  82   2.674   4.402 -10.433
  627    H    LEU  83           H        LEU  83  -0.535   4.507  -7.552
  628    HA   LEU  83           HA       LEU  83   0.614   1.930  -6.747
  629    HG   LEU  83           HG       LEU  83  -2.112   1.957  -4.857
  630    HB2  LEU  83           2HB      LEU  83   0.707   2.989  -4.719
  631    HB3  LEU  83           1HB      LEU  83  -0.622   4.066  -5.094
  632   HD11  LEU  83          1HD1      LEU  83   0.133   0.579  -4.707
  633   HD12  LEU  83          2HD1      LEU  83  -1.307   0.102  -3.809
  634   HD13  LEU  83          3HD1      LEU  83  -0.013   0.982  -2.997
  635   HD21  LEU  83          3HD2      LEU  83  -2.540   3.500  -3.243
  636   HD22  LEU  83          1HD2      LEU  83  -0.851   3.620  -2.748
  637   HD23  LEU  83          2HD2      LEU  83  -1.823   2.239  -2.239
  638    H    LYS  84           H        LYS  84  -0.791   0.213  -6.596
  639    HA   LYS  84           HA       LYS  84  -3.475   0.605  -7.727
  640    HB2  LYS  84           2HB      LYS  84  -1.321  -1.241  -8.457
  641    HB3  LYS  84           1HB      LYS  84  -2.879  -2.023  -8.233
  642    HG2  LYS  84           2HG      LYS  84  -3.149   0.384  -9.796
  643    HG3  LYS  84           1HG      LYS  84  -1.963  -0.712 -10.507
  644    HD2  LYS  84           2HD      LYS  84  -4.003  -1.363 -11.458
  645    HD3  LYS  84           1HD      LYS  84  -3.723  -2.541 -10.174
  646    HE2  LYS  84           2HE      LYS  84  -5.150  -1.052  -8.696
  647    HE3  LYS  84           1HE      LYS  84  -5.599  -0.187 -10.164
  648    HZ1  LYS  84           3HZ      LYS  84  -7.110  -1.732 -10.577
  649    HZ2  LYS  84           1HZ      LYS  84  -6.699  -2.543  -9.150
  650    HZ3  LYS  84           2HZ      LYS  84  -5.930  -2.943 -10.602
  651    H    VAL  85           H        VAL  85  -5.208  -0.498  -6.750
  652    HA   VAL  85           HA       VAL  85  -4.517  -1.991  -4.312
  653    HB   VAL  85           HB       VAL  85  -6.712   0.044  -4.717
  654   HG11  VAL  85          1HG1      VAL  85  -6.575  -2.244  -2.858
  655   HG12  VAL  85          2HG1      VAL  85  -7.973  -1.371  -3.488
  656   HG13  VAL  85          3HG1      VAL  85  -7.041  -0.697  -2.151
  657   HG21  VAL  85          3HG2      VAL  85  -4.133   0.016  -3.371
  658   HG22  VAL  85          1HG2      VAL  85  -5.451   0.519  -2.311
  659   HG23  VAL  85          2HG2      VAL  85  -5.159   1.377  -3.824
  660    H    ALA  86           H        ALA  86  -5.614  -3.867  -3.953
  661    HA   ALA  86           HA       ALA  86  -7.284  -4.833  -6.146
  662    HB1  ALA  86           3HB      ALA  86  -6.279  -6.437  -3.810
  663    HB2  ALA  86           1HB      ALA  86  -5.314  -6.138  -5.255
  664    HB3  ALA  86           2HB      ALA  86  -6.835  -7.022  -5.378
  665    H    LYS  87           H        LYS  87  -9.325  -5.755  -5.847
  666    HA   LYS  87           HA       LYS  87 -10.678  -4.949  -3.356
  667    HB2  LYS  87           2HB      LYS  87 -11.395  -3.812  -5.487
  668    HB3  LYS  87           1HB      LYS  87 -11.963  -5.375  -6.056
  669    HG2  LYS  87           2HG      LYS  87 -13.087  -5.002  -3.504
  670    HG3  LYS  87           1HG      LYS  87 -13.275  -3.476  -4.370
  671    HD2  LYS  87           2HD      LYS  87 -14.369  -4.602  -6.205
  672    HD3  LYS  87           1HD      LYS  87 -14.070  -6.174  -5.463
  673    HE2  LYS  87           2HE      LYS  87 -16.254  -5.803  -4.845
  674    HE3  LYS  87           1HE      LYS  87 -15.392  -5.148  -3.453
  675    HZ1  LYS  87           3HZ      LYS  87 -17.128  -3.648  -4.168
  676    HZ2  LYS  87           1HZ      LYS  87 -16.478  -3.575  -5.728
  677    HZ3  LYS  87           2HZ      LYS  87 -15.617  -2.931  -4.423
  678    HA   PRO  88           HA       PRO  88 -10.634  -9.551  -3.093
  679    HB2  PRO  88           2HB      PRO  88 -11.460  -8.805  -0.336
  680    HB3  PRO  88           1HB      PRO  88 -10.208  -9.932  -0.870
  681    HG2  PRO  88           2HG      PRO  88  -9.570  -7.549   0.138
  682    HG3  PRO  88           1HG      PRO  88  -8.652  -8.252  -1.207
  683    HD2  PRO  88           2HD      PRO  88 -10.711  -6.083  -1.239
  684    HD3  PRO  88           1HD      PRO  88  -9.215  -6.238  -2.183
  685    H    THR  89           H        THR  89 -12.378 -10.781  -3.578
  686    HA   THR  89           HA       THR  89 -14.993 -10.079  -2.486
  687    HB   THR  89           HB       THR  89 -15.912 -10.550  -4.891
  688    HG1  THR  89           1HG      THR  89 -14.516 -10.493  -6.447
  689   HG21  THR  89          3HG2      THR  89 -16.159  -8.396  -3.752
  690   HG22  THR  89          1HG2      THR  89 -15.860  -8.214  -5.481
  691   HG23  THR  89          2HG2      THR  89 -14.558  -7.925  -4.325
  692    H    GLY  90           H        GLY  90 -15.678 -11.857  -1.521
  693    HA2  GLY  90           2HA      GLY  90 -16.159 -14.057  -1.087
  694    HA3  GLY  90           1HA      GLY  90 -16.241 -14.258  -2.829
  695    H    SER  91           H        SER  91 -13.332 -13.289  -1.082
  696    HA   SER  91           HA       SER  91 -11.739 -15.257  -2.327
  697    HG   SER  91           HG       SER  91 -10.301 -13.014  -2.427
  698    HB2  SER  91           2HB      SER  91 -11.122 -13.682   0.185
  699    HB3  SER  91           1HB      SER  91  -9.951 -14.496  -0.851
  700    H    HIS  92           H        HIS  92 -13.355 -15.143   0.806
  701    HA   HIS  92           HA       HIS  92 -12.127 -17.357   2.011
  702    HD1  HIS  92           1HD      HIS  92 -16.412 -18.016   2.961
  703    HD2  HIS  92           2HD      HIS  92 -15.337 -14.288   1.472
  704    HE1  HIS  92           1HE      HIS  92 -18.542 -16.997   2.097
  705    HE2  HIS  92           2HE      HIS  92 -17.844 -14.793   1.094
  706    HB2  HIS  92           2HB      HIS  92 -14.039 -17.395   3.520
  707    HB3  HIS  92           1HB      HIS  92 -13.547 -15.732   3.224
  708    HA   ARG 301           HA       ARG 301   2.966 -10.978  10.390
  709    HE   ARG 301           HE       ARG 301  -0.846 -12.644  13.703
  710    H1   ARG 301           1HT      ARG 301   4.650 -12.288  11.555
  711    H2   ARG 301           2HT      ARG 301   3.043 -12.853  11.748
  712    H3   ARG 301           3HT      ARG 301   3.810 -11.993  13.019
  713    HB2  ARG 301           2HB      ARG 301   2.159 -10.356  13.241
  714    HB3  ARG 301           1HB      ARG 301   1.591  -9.476  11.829
  715    HG2  ARG 301           2HG      ARG 301   0.673 -11.648  10.968
  716    HG3  ARG 301           1HG      ARG 301   1.058 -12.347  12.541
  717    HD2  ARG 301           2HD      ARG 301  -0.296 -10.159  13.325
  718    HD3  ARG 301           1HD      ARG 301  -1.070 -10.453  11.768
  719   HH11  ARG 301          1HH1      ARG 301  -2.877 -10.406  11.921
  720   HH12  ARG 301          2HH1      ARG 301  -4.334 -11.269  12.272
  721   HH21  ARG 301          1HH2      ARG 301  -2.769 -13.766  14.153
  722   HH22  ARG 301          2HH2      ARG 301  -4.275 -13.174  13.535
  723    H    ARG 302           H        ARG 302   3.915  -9.167   9.643
  724    HA   ARG 302           HA       ARG 302   5.769  -7.724  11.417
  725    HE   ARG 302           HE       ARG 302   9.649  -8.891  10.003
  726    HB2  ARG 302           2HB      ARG 302   7.011  -9.191   9.856
  727    HB3  ARG 302           1HB      ARG 302   6.237  -8.381   8.503
  728    HG2  ARG 302           2HG      ARG 302   8.349  -7.404   8.647
  729    HG3  ARG 302           1HG      ARG 302   7.270  -6.233   9.407
  730    HD2  ARG 302           2HD      ARG 302   9.216  -6.424  10.775
  731    HD3  ARG 302           1HD      ARG 302   7.887  -7.218  11.617
  732   HH11  ARG 302          1HH1      ARG 302   8.714  -7.783  13.194
  733   HH12  ARG 302          2HH1      ARG 302   9.494  -9.095  14.009
  734   HH21  ARG 302          1HH2      ARG 302  10.674 -10.612  11.085
  735   HH22  ARG 302          2HH2      ARG 302  10.611 -10.698  12.815
  736    H    GLU 303           H        GLU 303   5.519  -5.590  11.468
  737    HA   GLU 303           HA       GLU 303   4.052  -4.274   9.284
  738    HB2  GLU 303           2HB      GLU 303   3.598  -4.002  12.255
  739    HB3  GLU 303           1HB      GLU 303   3.049  -2.790  11.106
  740    HG2  GLU 303           2HG      GLU 303   1.157  -3.999  11.174
  741    HG3  GLU 303           1HG      GLU 303   1.997  -4.974   9.971
  742    H    THR 304           H        THR 304   5.847  -3.341   8.381
  743    HA   THR 304           HA       THR 304   7.520  -1.666  10.108
  744    HB   THR 304           HB       THR 304   8.109  -3.432   7.938
  745    HG1  THR 304           1HG      THR 304   9.524  -3.531   9.508
  746   HG21  THR 304          3HG2      THR 304   9.223  -0.677   7.504
  747   HG22  THR 304          1HG2      THR 304   7.993  -1.438   6.495
  748   HG23  THR 304          2HG2      THR 304   9.607  -2.141   6.600
  749    H    GLN 305           H        GLN 305   8.066   0.464   9.513
  750    HA   GLN 305           HA       GLN 305   5.934   1.864   8.147
  751    HB2  GLN 305           2HB      GLN 305   8.356   2.748   9.697
  752    HB3  GLN 305           1HB      GLN 305   7.393   3.894   8.772
  753    HG2  GLN 305           2HG      GLN 305   5.654   3.815  10.213
  754    HG3  GLN 305           1HG      GLN 305   5.927   2.124  10.628
  755   HE21  GLN 305          1HE2      GLN 305   7.670   1.635  12.104
  756   HE22  GLN 305          2HE2      GLN 305   8.145   2.806  13.282
  757    H    VAL 306           H        VAL 306   6.205   3.246   6.356
  758    HA   VAL 306           HA       VAL 306   8.700   3.038   4.847
  759    HB   VAL 306           HB       VAL 306   7.413   2.520   2.756
  760   HG11  VAL 306          1HG1      VAL 306   8.724   0.838   4.026
  761   HG12  VAL 306          2HG1      VAL 306   7.366   0.146   3.138
  762   HG13  VAL 306          3HG1      VAL 306   7.247   0.386   4.882
  763   HG21  VAL 306          3HG2      VAL 306   5.187   3.019   3.204
  764   HG22  VAL 306          1HG2      VAL 306   5.210   2.194   4.763
  765   HG23  VAL 306          2HG2      VAL 306   5.210   1.258   3.266
  Start of MODEL   14
    1    HA   MET   1           HA       MET   1  -8.789   1.137  -9.528
    2    H1   MET   1           1HT      MET   1  -7.856  -1.050  -9.391
    3    H2   MET   1           2HT      MET   1  -9.454  -1.002  -8.770
    4    H3   MET   1           3HT      MET   1  -8.115  -1.071  -7.697
    5    HB2  MET   1           2HB      MET   1 -10.181   0.649  -7.393
    6    HB3  MET   1           1HB      MET   1  -8.755   1.189  -6.519
    7    HG2  MET   1           2HG      MET   1 -10.257   3.024  -6.717
    8    HG3  MET   1           1HG      MET   1  -8.869   3.331  -7.759
    9    HE1  MET   1           3HE      MET   1  -9.419   4.569 -10.004
   10    HE2  MET   1           1HE      MET   1 -10.376   5.252  -8.690
   11    HE3  MET   1           2HE      MET   1 -11.120   4.956 -10.261
   12    H    GLU   2           H        GLU   2  -7.384   2.921  -9.450
   13    HA   GLU   2           HA       GLU   2  -4.733   2.354  -8.293
   14    HB2  GLU   2           2HB      GLU   2  -3.798   3.731 -10.144
   15    HB3  GLU   2           1HB      GLU   2  -4.579   2.255 -10.688
   16    HG2  GLU   2           2HG      GLU   2  -6.194   4.744 -10.622
   17    HG3  GLU   2           1HG      GLU   2  -4.975   4.572 -11.883
   18    H    ILE   3           H        ILE   3  -3.533   4.111  -7.456
   19    HA   ILE   3           HA       ILE   3  -4.906   6.661  -7.129
   20    HB   ILE   3           HB       ILE   3  -3.916   4.975  -4.822
   21   HG12  ILE   3          2HG1      ILE   3  -6.658   6.171  -5.250
   22   HG13  ILE   3          1HG1      ILE   3  -6.236   4.544  -5.774
   23   HG21  ILE   3          1HG2      ILE   3  -3.362   6.913  -3.871
   24   HG22  ILE   3          2HG2      ILE   3  -5.096   7.204  -3.737
   25   HG23  ILE   3          3HG2      ILE   3  -4.195   7.858  -5.105
   26   HD11  ILE   3          3HD1      ILE   3  -6.697   5.604  -3.056
   27   HD12  ILE   3          1HD1      ILE   3  -5.470   4.351  -3.239
   28   HD13  ILE   3          2HD1      ILE   3  -7.128   4.045  -3.760
   29    H    LYS   4           H        LYS   4  -3.371   7.714  -8.326
   30    HA   LYS   4           HA       LYS   4  -0.549   7.436  -7.589
   31    HB2  LYS   4           2HB      LYS   4  -0.094   8.797  -9.595
   32    HB3  LYS   4           1HB      LYS   4  -1.037   7.364  -9.971
   33    HG2  LYS   4           2HG      LYS   4  -2.617   8.602 -10.903
   34    HG3  LYS   4           1HG      LYS   4  -2.812   9.535  -9.417
   35    HD2  LYS   4           2HD      LYS   4  -1.014  11.022 -10.085
   36    HD3  LYS   4           1HD      LYS   4  -0.720  10.054 -11.531
   37    HE2  LYS   4           2HE      LYS   4  -2.093  11.499 -12.551
   38    HE3  LYS   4           1HE      LYS   4  -3.387  10.614 -11.748
   39    HZ1  LYS   4           3HZ      LYS   4  -3.236  12.209  -9.904
   40    HZ2  LYS   4           1HZ      LYS   4  -3.643  12.957 -11.367
   41    HZ3  LYS   4           2HZ      LYS   4  -2.069  13.085 -10.760
   42    H    LEU   5           H        LEU   5   0.742   9.228  -6.901
   43    HA   LEU   5           HA       LEU   5  -0.568  11.758  -6.386
   44    HG   LEU   5           HG       LEU   5   0.427  12.700  -3.693
   45    HB2  LEU   5           2HB      LEU   5  -0.931  10.102  -4.420
   46    HB3  LEU   5           1HB      LEU   5   0.776  10.334  -4.101
   47   HD11  LEU   5          1HD1      LEU   5  -2.425  12.124  -4.467
   48   HD12  LEU   5          2HD1      LEU   5  -1.301  13.247  -5.234
   49   HD13  LEU   5          3HD1      LEU   5  -1.915  13.582  -3.615
   50   HD21  LEU   5          3HD2      LEU   5   0.119  11.145  -1.830
   51   HD22  LEU   5          1HD2      LEU   5  -1.595  11.017  -2.220
   52   HD23  LEU   5          2HD2      LEU   5  -0.928  12.555  -1.675
   53    H    ILE   6           H        ILE   6   1.148  13.299  -5.343
   54    HA   ILE   6           HA       ILE   6   3.617  12.916  -6.842
   55    HB   ILE   6           HB       ILE   6   2.384  15.088  -6.952
   56   HG12  ILE   6          2HG1      ILE   6   5.124  15.483  -5.760
   57   HG13  ILE   6          1HG1      ILE   6   4.896  14.750  -7.345
   58   HG21  ILE   6          1HG2      ILE   6   1.836  15.035  -4.457
   59   HG22  ILE   6          2HG2      ILE   6   2.284  16.588  -5.162
   60   HG23  ILE   6          3HG2      ILE   6   3.460  15.676  -4.215
   61   HD11  ILE   6          3HD1      ILE   6   4.429  17.551  -6.465
   62   HD12  ILE   6          1HD1      ILE   6   3.490  16.899  -7.808
   63   HD13  ILE   6          2HD1      ILE   6   5.251  16.939  -7.899
   64    H    LYS   7           H        LYS   7   5.411  12.158  -5.936
   65    HA   LYS   7           HA       LYS   7   5.531  11.626  -3.125
   66    HB2  LYS   7           2HB      LYS   7   6.483  10.082  -4.794
   67    HB3  LYS   7           1HB      LYS   7   7.665  11.301  -5.238
   68    HG2  LYS   7           2HG      LYS   7   8.662   9.651  -3.786
   69    HG3  LYS   7           1HG      LYS   7   8.599  11.218  -2.977
   70    HD2  LYS   7           2HD      LYS   7   6.497  10.460  -1.852
   71    HD3  LYS   7           1HD      LYS   7   6.772   8.860  -2.544
   72    HE2  LYS   7           2HE      LYS   7   9.144   9.169  -1.434
   73    HE3  LYS   7           1HE      LYS   7   8.262  10.295  -0.403
   74    HZ1  LYS   7           3HZ      LYS   7   7.670   7.413  -0.801
   75    HZ2  LYS   7           1HZ      LYS   7   6.683   8.475   0.072
   76    HZ3  LYS   7           2HZ      LYS   7   8.253   8.146   0.606
   77    H    GLY   8           H        GLY   8   6.218  12.936  -1.590
   78    HA2  GLY   8           2HA      GLY   8   7.699  15.355  -2.312
   79    HA3  GLY   8           1HA      GLY   8   6.891  15.052  -0.783
   80    HA   PRO   9           HA       PRO   9  11.646  14.368  -0.625
   81    HB2  PRO   9           2HB      PRO   9  11.445  16.576   1.342
   82    HB3  PRO   9           1HB      PRO   9  12.636  16.310   0.064
   83    HG2  PRO   9           2HG      PRO   9  10.770  18.205  -0.168
   84    HG3  PRO   9           1HG      PRO   9  11.287  17.249  -1.569
   85    HD2  PRO   9           2HD      PRO   9   8.810  16.990   0.093
   86    HD3  PRO   9           1HD      PRO   9   9.009  16.847  -1.667
   87    H    LYS  10           H        LYS  10   9.304  15.228   1.911
   88    HA   LYS  10           HA       LYS  10  10.523  14.079   4.108
   89    HB2  LYS  10           2HB      LYS  10   8.181  15.351   3.737
   90    HB3  LYS  10           1HB      LYS  10   7.584  13.705   3.903
   91    HG2  LYS  10           2HG      LYS  10   9.001  13.612   6.036
   92    HG3  LYS  10           1HG      LYS  10   9.075  15.370   5.895
   93    HD2  LYS  10           2HD      LYS  10   6.698  15.555   6.043
   94    HD3  LYS  10           1HD      LYS  10   6.498  13.807   5.911
   95    HE2  LYS  10           2HE      LYS  10   7.823  13.620   8.053
   96    HE3  LYS  10           1HE      LYS  10   7.668  15.370   8.202
   97    HZ1  LYS  10           3HZ      LYS  10   5.954  14.276   9.465
   98    HZ2  LYS  10           1HZ      LYS  10   5.436  13.411   8.105
   99    HZ3  LYS  10           2HZ      LYS  10   5.245  15.091   8.162
  100    H    GLY  11           H        GLY  11   7.900  12.473   2.264
  101    HA2  GLY  11           2HA      GLY  11   8.916  10.137   1.513
  102    HA3  GLY  11           1HA      GLY  11   8.824   9.887   3.249
  103    H    LEU  12           H        LEU  12   7.282   8.265   3.184
  104    HA   LEU  12           HA       LEU  12   4.763   8.732   1.811
  105    HG   LEU  12           HG       LEU  12   6.420   6.610   0.880
  106    HB2  LEU  12           2HB      LEU  12   5.940   6.423   3.318
  107    HB3  LEU  12           1HB      LEU  12   4.229   6.458   2.950
  108   HD11  LEU  12          1HD1      LEU  12   5.420   4.253   0.384
  109   HD12  LEU  12          2HD1      LEU  12   4.951   4.313   2.082
  110   HD13  LEU  12          3HD1      LEU  12   6.649   4.454   1.633
  111   HD21  LEU  12          3HD2      LEU  12   3.657   7.203   0.756
  112   HD22  LEU  12          1HD2      LEU  12   3.909   5.681  -0.097
  113   HD23  LEU  12          2HD2      LEU  12   4.818   7.116  -0.569
  114    H    GLY  13           H        GLY  13   5.802   8.037   5.162
  115    HA2  GLY  13           2HA      GLY  13   5.046   9.117   7.090
  116    HA3  GLY  13           1HA      GLY  13   3.767   9.866   6.154
  117    H    PHE  14           H        PHE  14   4.405   6.395   6.155
  118    HA   PHE  14           HA       PHE  14   2.416   5.815   8.131
  119    HD1  PHE  14           2HD      PHE  14   2.256   3.142   5.114
  120    HD2  PHE  14           1HD      PHE  14   1.244   7.163   4.146
  121    HE1  PHE  14           2HE      PHE  14   2.683   2.670   2.743
  122    HE2  PHE  14           1HE      PHE  14   1.669   6.695   1.766
  123    HZ   PHE  14           HZ       PHE  14   2.390   4.447   1.063
  124    HB2  PHE  14           2HB      PHE  14   0.835   4.656   6.624
  125    HB3  PHE  14           1HB      PHE  14   0.906   6.386   6.315
  126    H    SER  15           H        SER  15   1.798   3.239   7.684
  127    HA   SER  15           HA       SER  15   4.344   1.881   7.172
  128    HG   SER  15           HG       SER  15   2.080   1.065  10.412
  129    HB2  SER  15           2HB      SER  15   3.495   0.279   9.042
  130    HB3  SER  15           1HB      SER  15   4.296   1.777   9.495
  131    H    ILE  16           H        ILE  16   3.826  -0.647   7.165
  132    HA   ILE  16           HA       ILE  16   1.247  -1.320   6.025
  133    HB   ILE  16           HB       ILE  16   1.894  -1.952   3.887
  134   HG12  ILE  16          2HG1      ILE  16   4.076  -3.028   4.696
  135   HG13  ILE  16          1HG1      ILE  16   4.032  -2.397   3.058
  136   HG21  ILE  16          1HG2      ILE  16   2.956  -0.004   2.829
  137   HG22  ILE  16          2HG2      ILE  16   3.397   0.590   4.429
  138   HG23  ILE  16          3HG2      ILE  16   1.697   0.436   3.984
  139   HD11  ILE  16          3HD1      ILE  16   5.628  -0.917   3.468
  140   HD12  ILE  16          1HD1      ILE  16   5.966  -1.898   4.896
  141   HD13  ILE  16          2HD1      ILE  16   4.942  -0.465   5.028
  142    H    ALA  17           H        ALA  17   1.255  -3.647   5.316
  143    HA   ALA  17           HA       ALA  17   3.202  -5.368   6.662
  144    HB1  ALA  17           3HB      ALA  17   1.696  -5.704   8.320
  145    HB2  ALA  17           1HB      ALA  17   0.915  -6.755   7.138
  146    HB3  ALA  17           2HB      ALA  17   0.347  -5.097   7.360
  147    H    GLY  18           H        GLY  18   2.851  -7.755   5.712
  148    HA2  GLY  18           2HA      GLY  18   1.241  -8.256   3.580
  149    HA3  GLY  18           1HA      GLY  18   2.536  -7.346   2.858
  150    H    GLY  19           H        GLY  19   1.471 -10.307   2.774
  151    HA2  GLY  19           2HA      GLY  19   2.815 -11.993   1.775
  152    HA3  GLY  19           1HA      GLY  19   4.193 -11.404   2.685
  153    H    VAL  20           H        VAL  20   3.419 -14.104   2.499
  154    HA   VAL  20           HA       VAL  20   1.901 -14.991   4.705
  155    HB   VAL  20           HB       VAL  20   4.148 -16.492   3.336
  156   HG11  VAL  20          1HG1      VAL  20   1.833 -17.391   5.039
  157   HG12  VAL  20          2HG1      VAL  20   3.555 -17.603   5.353
  158   HG13  VAL  20          3HG1      VAL  20   2.785 -18.485   4.035
  159   HG21  VAL  20          3HG2      VAL  20   1.374 -15.874   2.501
  160   HG22  VAL  20          1HG2      VAL  20   1.941 -17.521   2.228
  161   HG23  VAL  20          2HG2      VAL  20   2.816 -16.160   1.527
  162    H    GLY  21           H        GLY  21   2.455 -15.541   6.797
  163    HA2  GLY  21           2HA      GLY  21   3.831 -15.863   8.666
  164    HA3  GLY  21           1HA      GLY  21   5.229 -15.479   7.675
  165    H    ASN  22           H        ASN  22   3.699 -12.994   6.789
  166    HA   ASN  22           HA       ASN  22   3.870 -11.349   9.199
  167    HB2  ASN  22           2HB      ASN  22   4.936  -9.607   7.457
  168    HB3  ASN  22           1HB      ASN  22   5.932 -10.683   8.415
  169   HD21  ASN  22          1HD2      ASN  22   4.080 -10.906   5.390
  170   HD22  ASN  22          2HD2      ASN  22   5.353 -11.636   4.479
  171    H    GLN  23           H        GLN  23   1.735 -12.443   7.235
  172    HA   GLN  23           HA       GLN  23   0.658 -10.438   5.675
  173    HB2  GLN  23           2HB      GLN  23  -0.502 -12.839   7.043
  174    HB3  GLN  23           1HB      GLN  23  -1.552 -11.727   6.179
  175    HG2  GLN  23           2HG      GLN  23   0.048 -12.076   4.200
  176    HG3  GLN  23           1HG      GLN  23   0.626 -13.473   5.105
  177   HE21  GLN  23          1HE2      GLN  23  -0.147 -15.160   4.008
  178   HE22  GLN  23          2HE2      GLN  23  -1.809 -15.418   3.617
  179    H    HIS  24           H        HIS  24  -0.963  -8.959   5.908
  180    HA   HIS  24           HA       HIS  24  -1.297  -7.846   8.577
  181    HD1  HIS  24           1HD      HIS  24  -0.820  -5.023   8.886
  182    HD2  HIS  24           2HD      HIS  24  -4.405  -5.330   6.824
  183    HE1  HIS  24           1HE      HIS  24  -2.268  -3.210   9.806
  184    HE2  HIS  24           2HE      HIS  24  -4.402  -3.327   8.472
  185    HB2  HIS  24           2HB      HIS  24  -0.757  -6.390   6.611
  186    HB3  HIS  24           1HB      HIS  24  -2.320  -6.796   5.931
  187    H    ILE  25           H        ILE  25  -3.146  -9.505   6.121
  188    HA   ILE  25           HA       ILE  25  -5.418  -9.606   7.962
  189    HB   ILE  25           HB       ILE  25  -5.517  -7.927   5.865
  190   HG12  ILE  25          2HG1      ILE  25  -7.850  -9.563   6.875
  191   HG13  ILE  25          1HG1      ILE  25  -7.160  -8.157   7.682
  192   HG21  ILE  25          1HG2      ILE  25  -6.760  -8.853   4.029
  193   HG22  ILE  25          2HG2      ILE  25  -6.767 -10.445   4.788
  194   HG23  ILE  25          3HG2      ILE  25  -5.251  -9.743   4.224
  195   HD11  ILE  25          3HD1      ILE  25  -9.299  -7.987   6.148
  196   HD12  ILE  25          1HD1      ILE  25  -8.079  -7.823   4.885
  197   HD13  ILE  25          2HD1      ILE  25  -8.108  -6.689   6.236
  198    HA   PRO  26           HA       PRO  26  -5.028 -13.990   7.288
  199    HB2  PRO  26           2HB      PRO  26  -7.948 -13.961   7.875
  200    HB3  PRO  26           1HB      PRO  26  -6.661 -14.924   8.609
  201    HG2  PRO  26           2HG      PRO  26  -7.722 -12.855   9.905
  202    HG3  PRO  26           1HG      PRO  26  -5.986 -13.202  10.004
  203    HD2  PRO  26           2HD      PRO  26  -7.414 -11.085   8.458
  204    HD3  PRO  26           1HD      PRO  26  -5.839 -11.025   9.273
  205    H    GLY  27           H        GLY  27  -4.958 -14.935   5.355
  206    HA2  GLY  27           2HA      GLY  27  -6.004 -16.006   3.516
  207    HA3  GLY  27           1HA      GLY  27  -7.336 -14.870   3.641
  208    H    ASP  28           H        ASP  28  -6.011 -12.439   3.598
  209    HA   ASP  28           HA       ASP  28  -5.037 -12.426   0.835
  210    HB2  ASP  28           2HB      ASP  28  -6.961 -10.903   1.980
  211    HB3  ASP  28           1HB      ASP  28  -5.563  -9.852   2.192
  212    H    ASN  29           H        ASN  29  -2.909 -12.601   0.679
  213    HA   ASN  29           HA       ASN  29  -1.155 -11.498   2.707
  214    HB2  ASN  29           2HB      ASN  29   0.609 -12.686   1.663
  215    HB3  ASN  29           1HB      ASN  29  -0.792 -13.747   1.638
  216   HD21  ASN  29          1HD2      ASN  29  -1.892 -14.076  -0.353
  217   HD22  ASN  29          2HD2      ASN  29  -1.090 -13.809  -1.859
  218    H    SER  30           H        SER  30  -2.728  -9.727   0.771
  219    HA   SER  30           HA       SER  30  -0.659  -8.423  -0.782
  220    HG   SER  30           HG       SER  30  -2.406  -9.288  -2.119
  221    HB2  SER  30           2HB      SER  30  -3.506  -7.523  -0.243
  222    HB3  SER  30           1HB      SER  30  -2.419  -6.875  -1.471
  223    H    ILE  31           H        ILE  31  -0.062  -6.154  -0.443
  224    HA   ILE  31           HA       ILE  31   0.527  -5.690   2.287
  225    HB   ILE  31           HB       ILE  31   0.911  -3.598   0.172
  226   HG12  ILE  31          2HG1      ILE  31   1.806  -5.426  -0.973
  227   HG13  ILE  31          1HG1      ILE  31   3.198  -4.740  -0.150
  228   HG21  ILE  31          1HG2      ILE  31   1.412  -3.150   2.584
  229   HG22  ILE  31          2HG2      ILE  31   2.761  -2.912   1.472
  230   HG23  ILE  31          3HG2      ILE  31   2.685  -4.365   2.468
  231   HD11  ILE  31          3HD1      ILE  31   2.943  -6.459   1.606
  232   HD12  ILE  31          1HD1      ILE  31   3.276  -7.125   0.010
  233   HD13  ILE  31          2HD1      ILE  31   1.641  -7.181   0.666
  234    H    TYR  32           H        TYR  32  -0.624  -4.746   3.792
  235    HA   TYR  32           HA       TYR  32  -2.662  -2.747   3.060
  236    HD1  TYR  32           2HD      TYR  32  -2.565  -6.374   3.406
  237    HD2  TYR  32           1HD      TYR  32  -5.790  -3.746   4.222
  238    HE1  TYR  32           2HE      TYR  32  -4.064  -7.849   2.138
  239    HE2  TYR  32           1HE      TYR  32  -7.320  -5.199   2.980
  240    HH   TYR  32           HH       TYR  32  -6.304  -7.553   0.886
  241    HB2  TYR  32           2HB      TYR  32  -2.596  -4.694   5.370
  242    HB3  TYR  32           1HB      TYR  32  -3.747  -3.373   5.247
  243    H    VAL  33           H        VAL  33  -2.777  -0.865   4.310
  244    HA   VAL  33           HA       VAL  33  -0.338  -0.052   5.582
  245    HB   VAL  33           HB       VAL  33  -2.983   1.368   5.226
  246   HG11  VAL  33          1HG1      VAL  33  -2.310   2.542   7.048
  247   HG12  VAL  33          2HG1      VAL  33  -1.316   3.370   5.850
  248   HG13  VAL  33          3HG1      VAL  33  -0.616   2.095   6.848
  249   HG21  VAL  33          3HG2      VAL  33  -0.415   1.260   3.759
  250   HG22  VAL  33          1HG2      VAL  33  -1.197   2.836   3.882
  251   HG23  VAL  33          2HG2      VAL  33  -2.058   1.479   3.158
  252    H    THR  34           H        THR  34   0.160  -0.216   7.673
  253    HA   THR  34           HA       THR  34  -1.875  -1.212   9.516
  254    HB   THR  34           HB       THR  34  -0.071  -1.919  10.927
  255    HG1  THR  34           1HG      THR  34   1.756  -0.667   9.169
  256   HG21  THR  34          3HG2      THR  34   1.473  -2.725   8.701
  257   HG22  THR  34          1HG2      THR  34  -0.225  -2.754   8.225
  258   HG23  THR  34          2HG2      THR  34   0.311  -3.664   9.637
  259    H    LYS  35           H        LYS  35   0.094   1.664   9.060
  260    HA   LYS  35           HA       LYS  35  -1.444   3.068  11.055
  261    HB2  LYS  35           2HB      LYS  35   1.469   2.447  11.529
  262    HB3  LYS  35           1HB      LYS  35   0.691   3.841  12.258
  263    HG2  LYS  35           2HG      LYS  35  -1.045   2.007  13.047
  264    HG3  LYS  35           1HG      LYS  35   0.356   0.955  12.843
  265    HD2  LYS  35           2HD      LYS  35   0.458   1.650  15.081
  266    HD3  LYS  35           1HD      LYS  35   1.630   2.669  14.245
  267    HE2  LYS  35           2HE      LYS  35   0.544   4.279  15.432
  268    HE3  LYS  35           1HE      LYS  35  -0.489   4.250  14.004
  269    HZ1  LYS  35           3HZ      LYS  35  -0.998   2.842  16.569
  270    HZ2  LYS  35           1HZ      LYS  35  -1.972   2.721  15.191
  271    HZ3  LYS  35           2HZ      LYS  35  -1.821   4.203  15.992
  272    H    ILE  36           H        ILE  36  -1.789   5.054  10.266
  273    HA   ILE  36           HA       ILE  36   0.132   6.122   8.321
  274    HB   ILE  36           HB       ILE  36  -2.733   6.922   8.850
  275   HG12  ILE  36          2HG1      ILE  36  -1.363   5.425   6.610
  276   HG13  ILE  36          1HG1      ILE  36  -2.648   4.844   7.662
  277   HG21  ILE  36          1HG2      ILE  36  -2.505   8.433   6.947
  278   HG22  ILE  36          2HG2      ILE  36  -0.803   8.001   6.795
  279   HG23  ILE  36          3HG2      ILE  36  -1.370   8.861   8.225
  280   HD11  ILE  36          3HD1      ILE  36  -4.105   6.639   6.636
  281   HD12  ILE  36          1HD1      ILE  36  -3.654   5.289   5.592
  282   HD13  ILE  36          2HD1      ILE  36  -2.830   6.840   5.434
  283    H    ILE  37           H        ILE  37   1.465   7.711   8.903
  284    HA   ILE  37           HA       ILE  37   1.298   8.927  11.502
  285    HB   ILE  37           HB       ILE  37   3.234   9.183   9.207
  286   HG12  ILE  37          2HG1      ILE  37   4.755   8.438  11.223
  287   HG13  ILE  37          1HG1      ILE  37   3.226   7.900  11.907
  288   HG21  ILE  37          1HG2      ILE  37   3.269  11.372  10.035
  289   HG22  ILE  37          2HG2      ILE  37   4.624  10.568  10.824
  290   HG23  ILE  37          3HG2      ILE  37   3.122  10.835  11.709
  291   HD11  ILE  37          3HD1      ILE  37   2.883   6.354  10.172
  292   HD12  ILE  37          1HD1      ILE  37   4.575   6.188  10.639
  293   HD13  ILE  37          2HD1      ILE  37   4.149   7.075   9.177
  294    H    GLU  38           H        GLU  38   0.968  11.114  11.984
  295    HA   GLU  38           HA       GLU  38  -0.965  12.489  10.514
  296    HB2  GLU  38           2HB      GLU  38   0.880  13.245  12.744
  297    HB3  GLU  38           1HB      GLU  38  -0.046  14.505  11.941
  298    HG2  GLU  38           2HG      GLU  38  -2.101  13.549  12.583
  299    HG3  GLU  38           1HG      GLU  38  -1.330  12.041  13.075
  300    H    GLY  39           H        GLY  39  -0.894  14.372   9.248
  301    HA2  GLY  39           2HA      GLY  39  -0.115  15.668   7.526
  302    HA3  GLY  39           1HA      GLY  39   1.339  15.829   8.492
  303    H    GLY  40           H        GLY  40   0.429  12.643   7.436
  304    HA2  GLY  40           2HA      GLY  40   2.838  12.505   5.817
  305    HA3  GLY  40           1HA      GLY  40   1.808  11.157   6.275
  306    H    ALA  41           H        ALA  41   2.705  11.172   3.761
  307    HA   ALA  41           HA       ALA  41   1.365  12.549   1.782
  308    HB1  ALA  41           3HB      ALA  41   1.969  10.775   0.280
  309    HB2  ALA  41           1HB      ALA  41   2.169   9.647   1.622
  310    HB3  ALA  41           2HB      ALA  41   3.280  11.006   1.438
  311    H    ALA  42           H        ALA  42   0.377   9.468   3.302
  312    HA   ALA  42           HA       ALA  42  -2.050   9.274   1.812
  313    HB1  ALA  42           3HB      ALA  42  -2.616   7.523   3.551
  314    HB2  ALA  42           1HB      ALA  42  -1.040   7.859   4.267
  315    HB3  ALA  42           2HB      ALA  42  -1.146   7.244   2.617
  316    H    HIS  43           H        HIS  43  -1.371  10.053   5.226
  317    HA   HIS  43           HA       HIS  43  -3.908  10.622   6.116
  318    HD1  HIS  43           1HD      HIS  43  -2.562  14.189   7.743
  319    HD2  HIS  43           2HD      HIS  43  -3.968  10.653   9.408
  320    HE1  HIS  43           1HE      HIS  43  -3.960  14.886   9.711
  321    HE2  HIS  43           2HE      HIS  43  -4.887  12.735  10.642
  322    HB2  HIS  43           2HB      HIS  43  -1.880  10.537   7.532
  323    HB3  HIS  43           1HB      HIS  43  -1.372  12.087   6.876
  324    H    LYS  44           H        LYS  44  -1.688  12.809   4.415
  325    HA   LYS  44           HA       LYS  44  -3.435  15.074   4.583
  326    HB2  LYS  44           2HB      LYS  44  -0.919  14.495   3.037
  327    HB3  LYS  44           1HB      LYS  44  -1.828  15.980   2.791
  328    HG2  LYS  44           2HG      LYS  44  -1.513  16.604   5.101
  329    HG3  LYS  44           1HG      LYS  44  -0.705  15.070   5.433
  330    HD2  LYS  44           2HD      LYS  44   1.198  15.671   4.259
  331    HD3  LYS  44           1HD      LYS  44   0.345  16.874   3.291
  332    HE2  LYS  44           2HE      LYS  44   0.350  17.404   6.178
  333    HE3  LYS  44           1HE      LYS  44   1.943  17.433   5.425
  334    HZ1  LYS  44           3HZ      LYS  44   0.885  19.615   5.417
  335    HZ2  LYS  44           1HZ      LYS  44  -0.409  19.003   4.515
  336    HZ3  LYS  44           2HZ      LYS  44   1.143  19.057   3.841
  337    H    ASP  45           H        ASP  45  -2.769  12.601   2.141
  338    HA   ASP  45           HA       ASP  45  -4.211  13.815   0.033
  339    HB2  ASP  45           2HB      ASP  45  -2.525  11.895  -0.118
  340    HB3  ASP  45           1HB      ASP  45  -3.846  10.838   0.368
  341    H    GLY  46           H        GLY  46  -5.150  11.209   2.306
  342    HA2  GLY  46           2HA      GLY  46  -7.297  11.099   3.318
  343    HA3  GLY  46           1HA      GLY  46  -7.939  12.075   2.008
  344    H    LYS  47           H        LYS  47  -6.543  10.364  -0.022
  345    HA   LYS  47           HA       LYS  47  -8.666   8.581  -0.530
  346    HB2  LYS  47           2HB      LYS  47  -5.905   8.773  -1.732
  347    HB3  LYS  47           1HB      LYS  47  -7.149   7.685  -2.328
  348    HG2  LYS  47           2HG      LYS  47  -8.603   9.653  -2.735
  349    HG3  LYS  47           1HG      LYS  47  -7.253  10.693  -2.272
  350    HD2  LYS  47           2HD      LYS  47  -5.903   9.639  -4.078
  351    HD3  LYS  47           1HD      LYS  47  -7.344   8.755  -4.583
  352    HE2  LYS  47           2HE      LYS  47  -7.994  10.495  -5.796
  353    HE3  LYS  47           1HE      LYS  47  -8.038  11.497  -4.346
  354    HZ1  LYS  47           3HZ      LYS  47  -5.643  11.030  -6.042
  355    HZ2  LYS  47           1HZ      LYS  47  -5.705  12.013  -4.665
  356    HZ3  LYS  47           2HZ      LYS  47  -6.590  12.432  -6.044
  357    H    LEU  48           H        LEU  48  -5.386   8.023   0.783
  358    HA   LEU  48           HA       LEU  48  -5.933   5.181   1.030
  359    HG   LEU  48           HG       LEU  48  -4.059   3.829   0.909
  360    HB2  LEU  48           2HB      LEU  48  -3.683   6.346   0.371
  361    HB3  LEU  48           1HB      LEU  48  -3.484   6.522   2.103
  362   HD11  LEU  48          1HD1      LEU  48  -1.635   3.431   0.809
  363   HD12  LEU  48          2HD1      LEU  48  -1.355   5.137   1.159
  364   HD13  LEU  48          3HD1      LEU  48  -2.160   4.665  -0.336
  365   HD21  LEU  48          3HD2      LEU  48  -4.007   4.558   3.456
  366   HD22  LEU  48          1HD2      LEU  48  -2.275   4.308   3.231
  367   HD23  LEU  48          2HD2      LEU  48  -3.408   2.991   2.916
  368    H    GLN  49           H        GLN  49  -6.758   4.283   2.785
  369    HA   GLN  49           HA       GLN  49  -6.412   5.591   5.389
  370    HB2  GLN  49           2HB      GLN  49  -8.703   4.977   5.992
  371    HB3  GLN  49           1HB      GLN  49  -8.686   6.045   4.599
  372    HG2  GLN  49           2HG      GLN  49  -8.819   3.080   4.234
  373    HG3  GLN  49           1HG      GLN  49 -10.266   4.004   4.626
  374   HE21  GLN  49          1HE2      GLN  49  -8.296   2.888   2.165
  375   HE22  GLN  49          2HE2      GLN  49  -8.908   3.863   0.877
  376    H    ILE  50           H        ILE  50  -6.014   4.207   7.108
  377    HA   ILE  50           HA       ILE  50  -4.721   1.828   6.726
  378    HB   ILE  50           HB       ILE  50  -5.383   1.242   9.114
  379   HG12  ILE  50          2HG1      ILE  50  -6.289   3.966   9.653
  380   HG13  ILE  50          1HG1      ILE  50  -7.424   3.067   8.651
  381   HG21  ILE  50          1HG2      ILE  50  -4.036   3.102  10.062
  382   HG22  ILE  50          2HG2      ILE  50  -4.115   3.902   8.493
  383   HG23  ILE  50          3HG2      ILE  50  -3.308   2.341   8.646
  384   HD11  ILE  50          3HD1      ILE  50  -7.268   3.009  11.391
  385   HD12  ILE  50          1HD1      ILE  50  -6.462   1.517  10.908
  386   HD13  ILE  50          2HD1      ILE  50  -8.111   1.843  10.371
  387    H    GLY  51           H        GLY  51  -5.286  -0.145   6.029
  388    HA2  GLY  51           2HA      GLY  51  -6.783  -2.075   6.494
  389    HA3  GLY  51           1HA      GLY  51  -8.118  -0.960   6.283
  390    H    ASP  52           H        ASP  52  -6.376   0.281   3.990
  391    HA   ASP  52           HA       ASP  52  -7.619  -1.209   1.926
  392    HB2  ASP  52           2HB      ASP  52  -6.193   0.327   0.431
  393    HB3  ASP  52           1HB      ASP  52  -7.420   1.067   1.448
  394    H    LYS  53           H        LYS  53  -6.481  -2.186   0.093
  395    HA   LYS  53           HA       LYS  53  -4.021  -3.537   0.981
  396    HB2  LYS  53           2HB      LYS  53  -4.676  -5.316  -0.699
  397    HB3  LYS  53           1HB      LYS  53  -5.678  -5.191   0.734
  398    HG2  LYS  53           2HG      LYS  53  -6.893  -3.523  -1.139
  399    HG3  LYS  53           1HG      LYS  53  -6.405  -4.962  -2.036
  400    HD2  LYS  53           2HD      LYS  53  -7.542  -5.674   0.520
  401    HD3  LYS  53           1HD      LYS  53  -8.654  -4.665  -0.404
  402    HE2  LYS  53           2HE      LYS  53  -9.073  -6.291  -1.887
  403    HE3  LYS  53           1HE      LYS  53  -7.371  -6.722  -2.023
  404    HZ1  LYS  53           3HZ      LYS  53  -7.575  -8.349  -0.512
  405    HZ2  LYS  53           1HZ      LYS  53  -9.211  -8.298  -0.932
  406    HZ3  LYS  53           2HZ      LYS  53  -8.669  -7.498   0.456
  407    H    LEU  54           H        LEU  54  -2.422  -3.988  -0.505
  408    HA   LEU  54           HA       LEU  54  -2.295  -2.060  -2.724
  409    HG   LEU  54           HG       LEU  54  -0.775  -0.492  -2.277
  410    HB2  LEU  54           2HB      LEU  54  -0.528  -2.504  -0.647
  411    HB3  LEU  54           1HB      LEU  54   0.236  -3.302  -2.009
  412   HD11  LEU  54          1HD1      LEU  54   1.552  -1.428  -0.716
  413   HD12  LEU  54          2HD1      LEU  54   0.586   0.038  -0.553
  414   HD13  LEU  54          3HD1      LEU  54   1.823  -0.067  -1.804
  415   HD21  LEU  54          3HD2      LEU  54   0.223  -0.567  -4.262
  416   HD22  LEU  54          1HD2      LEU  54   0.413  -2.303  -4.015
  417   HD23  LEU  54          2HD2      LEU  54   1.713  -1.201  -3.566
  418    H    LEU  55           H        LEU  55  -2.971  -3.010  -4.513
  419    HA   LEU  55           HA       LEU  55  -2.464  -5.749  -5.164
  420    HG   LEU  55           HG       LEU  55  -2.871  -6.112  -7.726
  421    HB2  LEU  55           2HB      LEU  55  -4.479  -4.761  -5.981
  422    HB3  LEU  55           1HB      LEU  55  -3.607  -3.442  -6.732
  423   HD11  LEU  55          1HD1      LEU  55  -5.644  -5.008  -8.125
  424   HD12  LEU  55          2HD1      LEU  55  -5.197  -6.570  -7.438
  425   HD13  LEU  55          3HD1      LEU  55  -4.913  -6.246  -9.148
  426   HD21  LEU  55          3HD2      LEU  55  -3.863  -3.929  -9.462
  427   HD22  LEU  55          1HD2      LEU  55  -2.464  -4.987  -9.653
  428   HD23  LEU  55          2HD2      LEU  55  -2.389  -3.618  -8.545
  429    H    ALA  56           H        ALA  56  -1.272  -2.604  -6.411
  430    HA   ALA  56           HA       ALA  56   1.270  -3.876  -7.065
  431    HB1  ALA  56           3HB      ALA  56   0.016  -4.361  -9.084
  432    HB2  ALA  56           1HB      ALA  56   1.224  -3.121  -9.439
  433    HB3  ALA  56           2HB      ALA  56  -0.468  -2.672  -9.228
  434    H    VAL  57           H        VAL  57   2.988  -2.382  -7.503
  435    HA   VAL  57           HA       VAL  57   2.367   0.465  -7.189
  436    HB   VAL  57           HB       VAL  57   4.671   0.287  -5.712
  437   HG11  VAL  57          1HG1      VAL  57   3.044   1.779  -5.024
  438   HG12  VAL  57          2HG1      VAL  57   3.033   0.577  -3.733
  439   HG13  VAL  57          3HG1      VAL  57   1.785   0.546  -4.978
  440   HG21  VAL  57          3HG2      VAL  57   4.299  -1.391  -3.983
  441   HG22  VAL  57          1HG2      VAL  57   4.504  -2.143  -5.564
  442   HG23  VAL  57          2HG2      VAL  57   2.894  -1.996  -4.860
  443    H    ASN  58           H        ASN  58   3.389   1.596  -8.711
  444    HA   ASN  58           HA       ASN  58   4.855   2.210 -10.333
  445    HB2  ASN  58           2HB      ASN  58   6.542   0.996  -8.238
  446    HB3  ASN  58           1HB      ASN  58   7.290   1.078  -9.829
  447   HD21  ASN  58          1HD2      ASN  58   8.550   2.784  -9.977
  448   HD22  ASN  58          2HD2      ASN  58   8.212   4.358  -9.349
  449    H    ASN  59           H        ASN  59   3.263  -0.157 -10.730
  450    HA   ASN  59           HA       ASN  59   2.964  -1.482 -12.596
  451    HB2  ASN  59           2HB      ASN  59   5.043  -0.225 -13.549
  452    HB3  ASN  59           1HB      ASN  59   5.909  -1.695 -13.112
  453   HD21  ASN  59          1HD2      ASN  59   3.244  -0.421 -15.026
  454   HD22  ASN  59          2HD2      ASN  59   3.243  -1.689 -16.198
  455    H    VAL  60           H        VAL  60   5.088  -2.149  -9.961
  456    HA   VAL  60           HA       VAL  60   5.195  -5.004 -10.526
  457    HB   VAL  60           HB       VAL  60   6.523  -5.251  -8.554
  458   HG11  VAL  60          1HG1      VAL  60   8.282  -3.379  -8.961
  459   HG12  VAL  60          2HG1      VAL  60   7.229  -2.940 -10.307
  460   HG13  VAL  60          3HG1      VAL  60   7.939  -4.554 -10.234
  461   HG21  VAL  60          3HG2      VAL  60   6.800  -2.563  -7.619
  462   HG22  VAL  60          1HG2      VAL  60   6.301  -4.006  -6.738
  463   HG23  VAL  60          2HG2      VAL  60   5.102  -3.032  -7.584
  464    H    CYS  61           H        CYS  61   4.129  -6.611  -9.316
  465    HA   CYS  61           HA       CYS  61   1.681  -5.691  -8.063
  466    HG   CYS  61           HG       CYS  61   3.083  -9.484  -7.652
  467    HB2  CYS  61           2HB      CYS  61   1.029  -8.034  -7.988
  468    HB3  CYS  61           1HB      CYS  61   1.584  -7.595  -9.598
  469    H    LEU  62           H        LEU  62   1.351  -5.475  -5.970
  470    HA   LEU  62           HA       LEU  62   3.382  -6.456  -4.107
  471    HG   LEU  62           HG       LEU  62   3.663  -5.088  -2.015
  472    HB2  LEU  62           2HB      LEU  62   2.287  -3.942  -4.443
  473    HB3  LEU  62           1HB      LEU  62   1.418  -4.571  -3.060
  474   HD11  LEU  62          1HD1      LEU  62   4.546  -3.686  -4.501
  475   HD12  LEU  62          2HD1      LEU  62   5.204  -5.131  -3.732
  476   HD13  LEU  62          3HD1      LEU  62   5.490  -3.544  -3.018
  477   HD21  LEU  62          3HD2      LEU  62   4.025  -2.823  -1.266
  478   HD22  LEU  62          1HD2      LEU  62   2.294  -3.114  -1.424
  479   HD23  LEU  62          2HD2      LEU  62   3.147  -2.187  -2.656
  480    H    GLU  63           H        GLU  63   0.881  -7.859  -5.292
  481    HA   GLU  63           HA       GLU  63  -0.530  -8.440  -2.788
  482    HB2  GLU  63           2HB      GLU  63  -2.224  -9.529  -4.238
  483    HB3  GLU  63           1HB      GLU  63  -1.999  -7.822  -4.586
  484    HG2  GLU  63           2HG      GLU  63  -0.828  -8.278  -6.579
  485    HG3  GLU  63           1HG      GLU  63  -0.625  -9.978  -6.159
  486    H    GLU  64           H        GLU  64   1.774  -9.820  -4.941
  487    HA   GLU  64           HA       GLU  64   1.482 -12.401  -3.560
  488    HB2  GLU  64           2HB      GLU  64   1.360 -11.844  -6.366
  489    HB3  GLU  64           1HB      GLU  64   2.732 -12.886  -6.035
  490    HG2  GLU  64           2HG      GLU  64   1.434 -14.648  -5.619
  491    HG3  GLU  64           1HG      GLU  64   0.306 -13.702  -4.649
  492    H    VAL  65           H        VAL  65   3.076 -10.480  -2.486
  493    HA   VAL  65           HA       VAL  65   5.747 -11.618  -2.907
  494    HB   VAL  65           HB       VAL  65   6.734  -9.314  -2.599
  495   HG11  VAL  65          1HG1      VAL  65   6.360  -8.677  -4.999
  496   HG12  VAL  65          2HG1      VAL  65   5.176  -9.981  -5.091
  497   HG13  VAL  65          3HG1      VAL  65   6.865 -10.347  -4.742
  498   HG21  VAL  65          3HG2      VAL  65   5.124  -7.498  -3.533
  499   HG22  VAL  65          1HG2      VAL  65   5.046  -7.937  -1.826
  500   HG23  VAL  65          2HG2      VAL  65   3.855  -8.580  -2.957
  501    H    THR  66           H        THR  66   7.205 -11.354  -1.157
  502    HA   THR  66           HA       THR  66   5.998 -11.656   1.401
  503    HB   THR  66           HB       THR  66   8.844 -11.022   1.496
  504    HG1  THR  66           1HG      THR  66   9.346 -11.918  -0.331
  505   HG21  THR  66          3HG2      THR  66   7.378 -13.591   2.036
  506   HG22  THR  66          1HG2      THR  66   7.701 -12.322   3.218
  507   HG23  THR  66          2HG2      THR  66   9.039 -13.212   2.492
  508    H    HIS  67           H        HIS  67   6.716 -10.342   3.336
  509    HA   HIS  67           HA       HIS  67   5.818  -7.731   3.081
  510    HD1  HIS  67           1HD      HIS  67   4.612  -7.068   6.325
  511    HD2  HIS  67           2HD      HIS  67   8.395  -5.795   5.195
  512    HE1  HIS  67           1HE      HIS  67   4.763  -4.670   7.045
  513    HE2  HIS  67           2HE      HIS  67   6.987  -3.883   6.188
  514    HB2  HIS  67           2HB      HIS  67   5.898  -8.874   5.264
  515    HB3  HIS  67           1HB      HIS  67   7.648  -8.700   5.298
  516    H    GLU  68           H        GLU  68   9.153  -8.908   2.927
  517    HA   GLU  68           HA       GLU  68  10.549  -6.536   2.988
  518    HB2  GLU  68           2HB      GLU  68  12.148  -7.695   1.348
  519    HB3  GLU  68           1HB      GLU  68  11.850  -8.483   2.888
  520    HG2  GLU  68           2HG      GLU  68  11.337 -10.326   1.785
  521    HG3  GLU  68           1HG      GLU  68   9.918  -9.505   1.140
  522    H    GLU  69           H        GLU  69   9.013  -8.042   0.154
  523    HA   GLU  69           HA       GLU  69   9.753  -6.078  -1.722
  524    HB2  GLU  69           2HB      GLU  69   8.203  -8.455  -1.715
  525    HB3  GLU  69           1HB      GLU  69   7.211  -7.189  -2.425
  526    HG2  GLU  69           2HG      GLU  69  10.029  -7.687  -3.323
  527    HG3  GLU  69           1HG      GLU  69   8.659  -8.573  -3.993
  528    H    ALA  70           H        ALA  70   7.021  -6.300   0.493
  529    HA   ALA  70           HA       ALA  70   5.382  -4.257  -0.512
  530    HB1  ALA  70           3HB      ALA  70   5.650  -4.579   2.430
  531    HB2  ALA  70           1HB      ALA  70   5.115  -5.971   1.490
  532    HB3  ALA  70           2HB      ALA  70   4.206  -4.462   1.429
  533    H    VAL  71           H        VAL  71   8.174  -4.151   1.642
  534    HA   VAL  71           HA       VAL  71   7.950  -1.309   2.096
  535    HB   VAL  71           HB       VAL  71  10.149  -3.261   2.812
  536   HG11  VAL  71          1HG1      VAL  71   9.847  -0.332   3.420
  537   HG12  VAL  71          2HG1      VAL  71  11.214  -1.162   2.679
  538   HG13  VAL  71          3HG1      VAL  71  10.856  -1.404   4.389
  539   HG21  VAL  71          3HG2      VAL  71   7.626  -2.550   4.043
  540   HG22  VAL  71          1HG2      VAL  71   8.990  -2.265   5.122
  541   HG23  VAL  71          2HG2      VAL  71   8.739  -3.863   4.425
  542    H    THR  72           H        THR  72   9.841  -3.454   0.035
  543    HA   THR  72           HA       THR  72  11.751  -1.593  -0.842
  544    HB   THR  72           HB       THR  72  10.634  -3.992  -2.307
  545    HG1  THR  72           1HG      THR  72  11.642  -5.024  -0.798
  546   HG21  THR  72          3HG2      THR  72  12.818  -4.066  -3.438
  547   HG22  THR  72          1HG2      THR  72  13.226  -2.513  -2.709
  548   HG23  THR  72          2HG2      THR  72  11.887  -2.625  -3.851
  549    H    ALA  73           H        ALA  73   8.500  -2.351  -2.029
  550    HA   ALA  73           HA       ALA  73   8.715  -0.672  -4.337
  551    HB1  ALA  73           3HB      ALA  73   7.249  -2.740  -4.076
  552    HB2  ALA  73           1HB      ALA  73   6.524  -1.327  -4.844
  553    HB3  ALA  73           2HB      ALA  73   6.152  -1.703  -3.162
  554    H    LEU  74           H        LEU  74   7.393  -0.351  -1.051
  555    HA   LEU  74           HA       LEU  74   6.075   2.138  -1.550
  556    HG   LEU  74           HG       LEU  74   4.699   0.242   1.357
  557    HB2  LEU  74           2HB      LEU  74   6.902   0.627   0.909
  558    HB3  LEU  74           1HB      LEU  74   6.301   2.265   1.040
  559   HD11  LEU  74          1HD1      LEU  74   3.843   2.514  -0.420
  560   HD12  LEU  74          2HD1      LEU  74   4.105   2.659   1.317
  561   HD13  LEU  74          3HD1      LEU  74   2.843   1.593   0.703
  562   HD21  LEU  74          3HD2      LEU  74   5.423  -0.657  -0.943
  563   HD22  LEU  74          1HD2      LEU  74   4.324   0.558  -1.595
  564   HD23  LEU  74          2HD2      LEU  74   3.713  -0.700  -0.519
  565    H    LYS  75           H        LYS  75   9.278   1.112  -0.638
  566    HA   LYS  75           HA       LYS  75  10.140   3.816   0.019
  567    HB2  LYS  75           2HB      LYS  75  12.181   2.885   0.724
  568    HB3  LYS  75           1HB      LYS  75  10.957   1.722   1.207
  569    HG2  LYS  75           2HG      LYS  75  11.822   0.112  -0.074
  570    HG3  LYS  75           1HG      LYS  75  12.063   1.197  -1.442
  571    HD2  LYS  75           2HD      LYS  75  14.217   0.478  -0.788
  572    HD3  LYS  75           1HD      LYS  75  14.052   2.128  -0.185
  573    HE2  LYS  75           2HE      LYS  75  13.120   0.749   1.937
  574    HE3  LYS  75           1HE      LYS  75  14.266  -0.422   1.285
  575    HZ1  LYS  75           3HZ      LYS  75  15.976   1.320   1.349
  576    HZ2  LYS  75           1HZ      LYS  75  15.350   0.984   2.885
  577    HZ3  LYS  75           2HZ      LYS  75  14.869   2.381   2.063
  578    H    ASN  76           H        ASN  76  10.001   1.830  -2.780
  579    HA   ASN  76           HA       ASN  76  12.218   2.724  -4.236
  580    HB2  ASN  76           2HB      ASN  76  10.704   0.808  -4.838
  581    HB3  ASN  76           1HB      ASN  76   9.515   1.989  -5.378
  582   HD21  ASN  76          1HD2      ASN  76   9.686   2.823  -7.373
  583   HD22  ASN  76          2HD2      ASN  76  10.984   2.499  -8.466
  584    H    THR  77           H        THR  77   9.159   4.262  -3.570
  585    HA   THR  77           HA       THR  77   8.674   6.055  -5.488
  586    HB   THR  77           HB       THR  77   8.145   7.723  -3.607
  587    HG1  THR  77           1HG      THR  77   9.468   7.081  -1.991
  588   HG21  THR  77          3HG2      THR  77   6.756   5.536  -4.486
  589   HG22  THR  77          1HG2      THR  77   6.138   6.793  -3.415
  590   HG23  THR  77          2HG2      THR  77   6.793   5.302  -2.738
  591    H    SER  78           H        SER  78   9.428   7.907  -6.333
  592    HA   SER  78           HA       SER  78  11.872   9.102  -5.222
  593    HG   SER  78           HG       SER  78  13.835   7.898  -6.596
  594    HB2  SER  78           2HB      SER  78  11.473   8.158  -8.060
  595    HB3  SER  78           1HB      SER  78  12.679   9.374  -7.641
  596    H    ASP  79           H        ASP  79  10.183   9.768  -8.279
  597    HA   ASP  79           HA       ASP  79   9.765  12.527  -7.393
  598    HB2  ASP  79           2HB      ASP  79   9.583  11.211 -10.113
  599    HB3  ASP  79           1HB      ASP  79   9.135  12.888  -9.821
  600    H    PHE  80           H        PHE  80   7.920  10.044  -9.165
  601    HA   PHE  80           HA       PHE  80   5.491  10.927  -7.753
  602    HD1  PHE  80           1HD      PHE  80   5.573  13.255  -9.818
  603    HD2  PHE  80           2HD      PHE  80   2.572  10.236  -9.739
  604    HE1  PHE  80           1HE      PHE  80   3.837  14.990  -9.692
  605    HE2  PHE  80           2HE      PHE  80   0.829  11.971  -9.611
  606    HZ   PHE  80           HZ       PHE  80   1.464  14.353  -9.586
  607    HB2  PHE  80           2HB      PHE  80   6.002  10.901 -10.564
  608    HB3  PHE  80           1HB      PHE  80   4.800   9.662 -10.219
  609    H    VAL  81           H        VAL  81   3.771   9.118  -7.756
  610    HA   VAL  81           HA       VAL  81   4.962   6.451  -7.789
  611    HB   VAL  81           HB       VAL  81   5.204   7.241  -5.470
  612   HG11  VAL  81          1HG1      VAL  81   2.197   7.461  -5.426
  613   HG12  VAL  81          2HG1      VAL  81   3.308   8.829  -5.489
  614   HG13  VAL  81          3HG1      VAL  81   3.303   7.761  -4.086
  615   HG21  VAL  81          3HG2      VAL  81   4.701   4.848  -6.022
  616   HG22  VAL  81          1HG2      VAL  81   3.015   5.177  -5.621
  617   HG23  VAL  81          2HG2      VAL  81   4.263   5.342  -4.386
  618    H    TYR  82           H        TYR  82   3.482   4.796  -8.216
  619    HA   TYR  82           HA       TYR  82   0.706   5.660  -8.695
  620    HD1  TYR  82           1HD      TYR  82   0.479   2.103 -10.537
  621    HD2  TYR  82           2HD      TYR  82  -0.141   6.175 -11.597
  622    HE1  TYR  82           1HE      TYR  82  -1.594   1.481 -11.682
  623    HE2  TYR  82           2HE      TYR  82  -2.227   5.564 -12.742
  624    HH   TYR  82           HH       TYR  82  -3.589   2.362 -12.517
  625    HB2  TYR  82           2HB      TYR  82   2.030   5.395 -10.808
  626    HB3  TYR  82           1HB      TYR  82   2.272   3.707 -10.380
  627    H    LEU  83           H        LEU  83  -0.172   4.807  -6.924
  628    HA   LEU  83           HA       LEU  83   0.406   2.092  -6.095
  629    HG   LEU  83           HG       LEU  83  -1.016   1.381  -4.167
  630    HB2  LEU  83           2HB      LEU  83   0.115   4.037  -4.517
  631    HB3  LEU  83           1HB      LEU  83  -1.593   4.004  -4.905
  632   HD11  LEU  83          1HD1      LEU  83   0.590   3.345  -2.585
  633   HD12  LEU  83          2HD1      LEU  83   1.033   1.739  -3.161
  634   HD13  LEU  83          3HD1      LEU  83  -0.083   1.912  -1.807
  635   HD21  LEU  83          3HD2      LEU  83  -2.441   3.710  -3.019
  636   HD22  LEU  83          1HD2      LEU  83  -2.147   2.336  -1.953
  637   HD23  LEU  83          2HD2      LEU  83  -3.044   2.112  -3.454
  638    H    LYS  84           H        LYS  84  -0.870   0.363  -6.274
  639    HA   LYS  84           HA       LYS  84  -3.505   0.678  -7.543
  640    HB2  LYS  84           2HB      LYS  84  -1.320  -1.293  -8.098
  641    HB3  LYS  84           1HB      LYS  84  -2.994  -1.732  -8.396
  642    HG2  LYS  84           2HG      LYS  84  -1.798   0.761  -9.553
  643    HG3  LYS  84           1HG      LYS  84  -1.630  -0.807 -10.344
  644    HD2  LYS  84           2HD      LYS  84  -4.302   0.313  -9.530
  645    HD3  LYS  84           1HD      LYS  84  -3.568   0.659 -11.098
  646    HE2  LYS  84           2HE      LYS  84  -3.352  -2.088 -10.859
  647    HE3  LYS  84           1HE      LYS  84  -4.931  -1.732 -10.161
  648    HZ1  LYS  84           3HZ      LYS  84  -5.071  -2.148 -12.540
  649    HZ2  LYS  84           1HZ      LYS  84  -4.004  -0.870 -12.849
  650    HZ3  LYS  84           2HZ      LYS  84  -5.527  -0.559 -12.181
  651    H    VAL  85           H        VAL  85  -5.212  -0.444  -6.626
  652    HA   VAL  85           HA       VAL  85  -4.524  -2.097  -4.292
  653    HB   VAL  85           HB       VAL  85  -6.908  -0.261  -4.612
  654   HG11  VAL  85          1HG1      VAL  85  -6.312  -2.445  -2.728
  655   HG12  VAL  85          2HG1      VAL  85  -7.859  -1.759  -3.224
  656   HG13  VAL  85          3HG1      VAL  85  -6.887  -0.945  -1.998
  657   HG21  VAL  85          3HG2      VAL  85  -5.733   0.709  -2.462
  658   HG22  VAL  85          1HG2      VAL  85  -5.231   1.206  -4.078
  659   HG23  VAL  85          2HG2      VAL  85  -4.298  -0.004  -3.200
  660    H    ALA  86           H        ALA  86  -5.562  -4.014  -4.038
  661    HA   ALA  86           HA       ALA  86  -7.033  -5.029  -6.322
  662    HB1  ALA  86           3HB      ALA  86  -6.818  -7.198  -5.263
  663    HB2  ALA  86           1HB      ALA  86  -6.207  -6.445  -3.791
  664    HB3  ALA  86           2HB      ALA  86  -5.258  -6.375  -5.276
  665    H    LYS  87           H        LYS  87  -9.143  -5.746  -6.320
  666    HA   LYS  87           HA       LYS  87 -10.854  -4.590  -4.284
  667    HB2  LYS  87           2HB      LYS  87 -11.264  -5.754  -7.002
  668    HB3  LYS  87           1HB      LYS  87 -12.631  -5.721  -5.897
  669    HG2  LYS  87           2HG      LYS  87 -11.029  -3.248  -6.413
  670    HG3  LYS  87           1HG      LYS  87 -12.294  -3.761  -7.532
  671    HD2  LYS  87           2HD      LYS  87 -13.971  -3.570  -5.877
  672    HD3  LYS  87           1HD      LYS  87 -12.781  -3.442  -4.581
  673    HE2  LYS  87           2HE      LYS  87 -13.251  -1.238  -4.771
  674    HE3  LYS  87           1HE      LYS  87 -12.046  -1.330  -6.054
  675    HZ1  LYS  87           3HZ      LYS  87 -14.991  -1.499  -6.421
  676    HZ2  LYS  87           1HZ      LYS  87 -13.841  -1.612  -7.659
  677    HZ3  LYS  87           2HZ      LYS  87 -14.018  -0.167  -6.798
  678    HA   PRO  88           HA       PRO  88 -10.886  -8.519  -2.092
  679    HB2  PRO  88           2HB      PRO  88 -12.610  -7.700  -0.125
  680    HB3  PRO  88           1HB      PRO  88 -10.873  -7.389  -0.109
  681    HG2  PRO  88           2HG      PRO  88 -13.116  -5.579  -0.876
  682    HG3  PRO  88           1HG      PRO  88 -11.620  -5.210   0.003
  683    HD2  PRO  88           2HD      PRO  88 -11.981  -4.614  -2.622
  684    HD3  PRO  88           1HD      PRO  88 -10.393  -4.994  -1.926
  685    H    THR  89           H        THR  89 -12.407 -10.191  -1.679
  686    HA   THR  89           HA       THR  89 -15.116  -9.782  -2.727
  687    HB   THR  89           HB       THR  89 -13.815 -10.691  -4.583
  688    HG1  THR  89           1HG      THR  89 -15.790 -11.518  -4.706
  689   HG21  THR  89          3HG2      THR  89 -13.206 -13.036  -2.799
  690   HG22  THR  89          1HG2      THR  89 -12.043 -11.833  -3.356
  691   HG23  THR  89          2HG2      THR  89 -12.830 -12.901  -4.517
  692    H    GLY  90           H        GLY  90 -16.704 -11.106  -1.850
  693    HA2  GLY  90           2HA      GLY  90 -15.846 -12.665   0.510
  694    HA3  GLY  90           1HA      GLY  90 -17.365 -11.790   0.404
  695    H    SER  91           H        SER  91 -16.222 -14.778   0.524
  696    HA   SER  91           HA       SER  91 -17.600 -16.038  -1.655
  697    HG   SER  91           HG       SER  91 -16.922 -17.795   1.664
  698    HB2  SER  91           2HB      SER  91 -17.072 -18.153  -0.428
  699    HB3  SER  91           1HB      SER  91 -15.659 -17.141  -0.719
  700    H    HIS  92           H        HIS  92 -18.272 -15.499   1.782
  701    HA   HIS  92           HA       HIS  92 -20.714 -16.986   1.790
  702    HD1  HIS  92           1HD      HIS  92 -22.890 -16.089   3.835
  703    HD2  HIS  92           2HD      HIS  92 -19.636 -18.159   5.382
  704    HE1  HIS  92           1HE      HIS  92 -23.868 -17.850   5.340
  705    HE2  HIS  92           2HE      HIS  92 -21.877 -19.035   6.330
  706    HB2  HIS  92           2HB      HIS  92 -19.077 -16.091   3.752
  707    HB3  HIS  92           1HB      HIS  92 -20.334 -14.861   3.818
  708    HA   ARG 301           HA       ARG 301   2.235 -10.784  10.169
  709    HE   ARG 301           HE       ARG 301  -2.251 -11.909  12.515
  710    H1   ARG 301           1HT      ARG 301   3.884 -12.159  11.276
  711    H2   ARG 301           2HT      ARG 301   2.357 -12.919  11.098
  712    H3   ARG 301           3HT      ARG 301   2.833 -12.295  12.624
  713    HB2  ARG 301           2HB      ARG 301   0.894 -11.056  12.866
  714    HB3  ARG 301           1HB      ARG 301   0.467  -9.820  11.692
  715    HG2  ARG 301           2HG      ARG 301  -1.001 -11.258  10.863
  716    HG3  ARG 301           1HG      ARG 301   0.368 -12.189  10.251
  717    HD2  ARG 301           2HD      ARG 301  -0.453 -13.862  11.491
  718    HD3  ARG 301           1HD      ARG 301   0.245 -12.999  12.860
  719   HH11  ARG 301          1HH1      ARG 301  -0.993 -15.119  13.129
  720   HH12  ARG 301          2HH1      ARG 301  -2.403 -15.640  13.987
  721   HH21  ARG 301          1HH2      ARG 301  -4.106 -12.603  13.645
  722   HH22  ARG 301          2HH2      ARG 301  -4.171 -14.212  14.280
  723    H    ARG 302           H        ARG 302   3.955  -9.420  10.001
  724    HA   ARG 302           HA       ARG 302   4.549  -7.745  12.351
  725    HE   ARG 302           HE       ARG 302   9.436  -9.491  10.415
  726    HB2  ARG 302           2HB      ARG 302   6.852  -7.507  11.526
  727    HB3  ARG 302           1HB      ARG 302   6.456  -9.181  11.884
  728    HG2  ARG 302           2HG      ARG 302   6.744  -9.836   9.761
  729    HG3  ARG 302           1HG      ARG 302   5.983  -8.390   9.099
  730    HD2  ARG 302           2HD      ARG 302   8.369  -8.578   8.504
  731    HD3  ARG 302           1HD      ARG 302   8.008  -7.122   9.426
  732   HH11  ARG 302          1HH1      ARG 302   8.441  -6.156  10.872
  733   HH12  ARG 302          2HH1      ARG 302   9.511  -5.898  12.207
  734   HH21  ARG 302          1HH2      ARG 302  10.837  -9.134  12.172
  735   HH22  ARG 302          2HH2      ARG 302  10.867  -7.584  12.944
  736    H    GLU 303           H        GLU 303   4.784  -5.562  12.054
  737    HA   GLU 303           HA       GLU 303   4.004  -4.534   9.401
  738    HB2  GLU 303           2HB      GLU 303   3.562  -3.131  12.040
  739    HB3  GLU 303           1HB      GLU 303   2.873  -2.721  10.476
  740    HG2  GLU 303           2HG      GLU 303   1.079  -3.751  11.398
  741    HG3  GLU 303           1HG      GLU 303   1.864  -5.159  10.682
  742    H    THR 304           H        THR 304   5.003  -2.616   8.645
  743    HA   THR 304           HA       THR 304   7.246  -1.569  10.168
  744    HB   THR 304           HB       THR 304   7.525  -3.358   7.878
  745    HG1  THR 304           1HG      THR 304   9.332  -2.335   9.807
  746   HG21  THR 304          3HG2      THR 304   9.055  -0.776   7.845
  747   HG22  THR 304          1HG2      THR 304   8.016  -1.432   6.578
  748   HG23  THR 304          2HG2      THR 304   9.535  -2.235   6.977
  749    H    GLN 305           H        GLN 305   7.737   0.532   9.732
  750    HA   GLN 305           HA       GLN 305   5.818   2.042   8.239
  751    HB2  GLN 305           2HB      GLN 305   8.196   2.695   9.920
  752    HB3  GLN 305           1HB      GLN 305   7.571   3.925   8.832
  753    HG2  GLN 305           2HG      GLN 305   5.558   4.087   9.956
  754    HG3  GLN 305           1HG      GLN 305   5.734   2.499  10.704
  755   HE21  GLN 305          1HE2      GLN 305   7.446   2.283  12.338
  756   HE22  GLN 305          2HE2      GLN 305   7.808   3.643  13.339
  757    H    VAL 306           H        VAL 306   6.254   3.475   6.510
  758    HA   VAL 306           HA       VAL 306   8.699   3.023   4.976
  759    HB   VAL 306           HB       VAL 306   7.287   2.797   2.873
  760   HG11  VAL 306          1HG1      VAL 306   8.556   0.947   3.933
  761   HG12  VAL 306          2HG1      VAL 306   7.109   0.405   3.085
  762   HG13  VAL 306          3HG1      VAL 306   7.108   0.518   4.847
  763   HG21  VAL 306          3HG2      VAL 306   5.036   1.931   3.109
  764   HG22  VAL 306          1HG2      VAL 306   5.155   3.504   3.898
  765   HG23  VAL 306          2HG2      VAL 306   5.154   2.028   4.865
  Start of MODEL   15
    1    HA   MET   1           HA       MET   1  -8.762   1.614  -7.998
    2    H1   MET   1           1HT      MET   1  -7.339  -0.909  -7.473
    3    H2   MET   1           2HT      MET   1  -7.647  -0.209  -9.009
    4    H3   MET   1           3HT      MET   1  -8.951  -0.754  -8.036
    5    HB2  MET   1           2HB      MET   1  -9.524   0.200  -6.042
    6    HB3  MET   1           1HB      MET   1  -7.914   0.390  -5.366
    7    HG2  MET   1           2HG      MET   1  -8.204   2.734  -5.124
    8    HG3  MET   1           1HG      MET   1  -9.695   2.709  -6.060
    9    HE1  MET   1           3HE      MET   1 -11.998   2.998  -4.642
   10    HE2  MET   1           1HE      MET   1 -12.379   1.523  -3.754
   11    HE3  MET   1           2HE      MET   1 -11.758   1.425  -5.402
   12    H    GLU   2           H        GLU   2  -6.897   2.193  -9.291
   13    HA   GLU   2           HA       GLU   2  -4.313   2.383  -8.008
   14    HB2  GLU   2           2HB      GLU   2  -3.614   3.539 -10.104
   15    HB3  GLU   2           1HB      GLU   2  -4.292   1.940 -10.360
   16    HG2  GLU   2           2HG      GLU   2  -6.294   4.042 -10.514
   17    HG3  GLU   2           1HG      GLU   2  -4.994   4.242 -11.687
   18    H    ILE   3           H        ILE   3  -3.266   4.209  -7.298
   19    HA   ILE   3           HA       ILE   3  -4.641   6.775  -7.405
   20    HB   ILE   3           HB       ILE   3  -3.925   5.352  -4.842
   21   HG12  ILE   3          2HG1      ILE   3  -6.342   6.568  -4.478
   22   HG13  ILE   3          1HG1      ILE   3  -6.402   6.208  -6.200
   23   HG21  ILE   3          1HG2      ILE   3  -4.282   8.290  -5.342
   24   HG22  ILE   3          2HG2      ILE   3  -2.982   7.464  -4.484
   25   HG23  ILE   3          3HG2      ILE   3  -4.586   7.573  -3.760
   26   HD11  ILE   3          3HD1      ILE   3  -6.871   4.482  -4.008
   27   HD12  ILE   3          1HD1      ILE   3  -5.444   3.902  -4.868
   28   HD13  ILE   3          2HD1      ILE   3  -6.964   4.126  -5.733
   29    H    LYS   4           H        LYS   4  -3.160   8.057  -8.270
   30    HA   LYS   4           HA       LYS   4  -0.332   7.710  -7.543
   31    HB2  LYS   4           2HB      LYS   4   0.166   9.050  -9.559
   32    HB3  LYS   4           1HB      LYS   4  -0.754   7.601  -9.935
   33    HG2  LYS   4           2HG      LYS   4  -2.725   8.824 -10.320
   34    HG3  LYS   4           1HG      LYS   4  -2.061  10.276  -9.570
   35    HD2  LYS   4           2HD      LYS   4  -0.917  10.873 -11.429
   36    HD3  LYS   4           1HD      LYS   4  -0.552   9.205 -11.870
   37    HE2  LYS   4           2HE      LYS   4  -2.807   8.907 -12.712
   38    HE3  LYS   4           1HE      LYS   4  -3.239  10.535 -12.192
   39    HZ1  LYS   4           3HZ      LYS   4  -2.750  10.433 -14.564
   40    HZ2  LYS   4           1HZ      LYS   4  -1.185   9.879 -14.235
   41    HZ3  LYS   4           2HZ      LYS   4  -1.651  11.435 -13.758
   42    H    LEU   5           H        LEU   5   0.943   9.540  -6.895
   43    HA   LEU   5           HA       LEU   5  -0.412  12.051  -6.418
   44    HG   LEU   5           HG       LEU   5  -2.049  11.480  -4.553
   45    HB2  LEU   5           2HB      LEU   5  -0.001  10.078  -4.348
   46    HB3  LEU   5           1HB      LEU   5   0.919  11.528  -3.997
   47   HD11  LEU   5          1HD1      LEU   5  -1.963  10.466  -2.501
   48   HD12  LEU   5          2HD1      LEU   5  -1.969  12.164  -2.019
   49   HD13  LEU   5          3HD1      LEU   5  -0.455  11.261  -2.047
   50   HD21  LEU   5          3HD2      LEU   5  -1.073  13.605  -5.135
   51   HD22  LEU   5          1HD2      LEU   5  -0.195  13.663  -3.606
   52   HD23  LEU   5          2HD2      LEU   5  -1.955  13.773  -3.617
   53    H    ILE   6           H        ILE   6   1.252  13.634  -5.364
   54    HA   ILE   6           HA       ILE   6   3.782  13.243  -6.782
   55    HB   ILE   6           HB       ILE   6   2.826  15.323  -7.349
   56   HG12  ILE   6          2HG1      ILE   6   5.326  15.175  -6.317
   57   HG13  ILE   6          1HG1      ILE   6   4.663  16.616  -7.077
   58   HG21  ILE   6          1HG2      ILE   6   2.175  15.553  -4.459
   59   HG22  ILE   6          2HG2      ILE   6   1.166  15.833  -5.878
   60   HG23  ILE   6          3HG2      ILE   6   2.380  17.023  -5.413
   61   HD11  ILE   6          3HD1      ILE   6   4.234  17.631  -4.998
   62   HD12  ILE   6          1HD1      ILE   6   5.852  16.942  -4.883
   63   HD13  ILE   6          2HD1      ILE   6   4.489  16.123  -4.122
   64    H    LYS   7           H        LYS   7   5.520  12.600  -5.713
   65    HA   LYS   7           HA       LYS   7   5.613  11.964  -3.022
   66    HB2  LYS   7           2HB      LYS   7   7.169  11.168  -4.840
   67    HB3  LYS   7           1HB      LYS   7   8.023  12.696  -4.681
   68    HG2  LYS   7           2HG      LYS   7   9.284  11.703  -3.154
   69    HG3  LYS   7           1HG      LYS   7   7.879  11.747  -2.089
   70    HD2  LYS   7           2HD      LYS   7   7.255   9.539  -3.397
   71    HD3  LYS   7           1HD      LYS   7   8.997   9.489  -3.673
   72    HE2  LYS   7           2HE      LYS   7   7.811   9.869  -0.939
   73    HE3  LYS   7           1HE      LYS   7   8.113   8.271  -1.617
   74    HZ1  LYS   7           3HZ      LYS   7  10.001   8.795  -0.360
   75    HZ2  LYS   7           1HZ      LYS   7  10.088  10.375  -0.960
   76    HZ3  LYS   7           2HZ      LYS   7  10.472   9.066  -1.961
   77    H    GLY   8           H        GLY   8   6.163  12.969  -1.166
   78    HA2  GLY   8           2HA      GLY   8   6.519  15.874  -1.284
   79    HA3  GLY   8           1HA      GLY   8   6.069  14.939   0.134
   80    HA   PRO   9           HA       PRO   9  10.507  16.035   0.682
   81    HB2  PRO   9           2HB      PRO   9   9.824  16.235   3.518
   82    HB3  PRO   9           1HB      PRO   9  10.481  17.466   2.439
   83    HG2  PRO   9           2HG      PRO   9   7.955  17.570   3.404
   84    HG3  PRO   9           1HG      PRO   9   8.405  18.222   1.817
   85    HD2  PRO   9           2HD      PRO   9   7.069  15.624   2.489
   86    HD3  PRO   9           1HD      PRO   9   6.714  16.766   1.175
   87    H    LYS  10           H        LYS  10   9.159  14.489   3.606
   88    HA   LYS  10           HA       LYS  10  11.276  12.728   3.963
   89    HB2  LYS  10           2HB      LYS  10   8.434  12.220   4.865
   90    HB3  LYS  10           1HB      LYS  10   9.905  11.587   5.585
   91    HG2  LYS  10           2HG      LYS  10   9.072  14.482   5.549
   92    HG3  LYS  10           1HG      LYS  10   8.945  13.381   6.920
   93    HD2  LYS  10           2HD      LYS  10  11.035  13.851   7.512
   94    HD3  LYS  10           1HD      LYS  10  11.619  13.291   5.944
   95    HE2  LYS  10           2HE      LYS  10  12.247  15.389   5.545
   96    HE3  LYS  10           1HE      LYS  10  10.534  15.790   5.416
   97    HZ1  LYS  10           3HZ      LYS  10  12.221  15.972   7.856
   98    HZ2  LYS  10           1HZ      LYS  10  10.547  16.225   7.834
   99    HZ3  LYS  10           2HZ      LYS  10  11.570  17.260   6.973
  100    H    GLY  11           H        GLY  11   8.012  11.497   3.182
  101    HA2  GLY  11           2HA      GLY  11   8.772  10.154   0.819
  102    HA3  GLY  11           1HA      GLY  11   8.919   9.051   2.177
  103    H    LEU  12           H        LEU  12   7.184   7.864   2.624
  104    HA   LEU  12           HA       LEU  12   4.654   8.515   1.349
  105    HG   LEU  12           HG       LEU  12   4.956   4.887   0.780
  106    HB2  LEU  12           2HB      LEU  12   5.760   6.105   2.737
  107    HB3  LEU  12           1HB      LEU  12   4.028   6.266   2.554
  108   HD11  LEU  12          1HD1      LEU  12   3.359   7.199   0.403
  109   HD12  LEU  12          2HD1      LEU  12   3.345   5.689  -0.509
  110   HD13  LEU  12          3HD1      LEU  12   4.395   7.014  -1.013
  111   HD21  LEU  12          3HD2      LEU  12   6.501   5.786  -0.864
  112   HD22  LEU  12          1HD2      LEU  12   7.212   5.851   0.749
  113   HD23  LEU  12          2HD2      LEU  12   6.568   7.316   0.009
  114    H    GLY  13           H        GLY  13   5.816   7.847   4.657
  115    HA2  GLY  13           2HA      GLY  13   5.169   8.938   6.607
  116    HA3  GLY  13           1HA      GLY  13   3.899   9.753   5.716
  117    H    PHE  14           H        PHE  14   4.421   6.252   5.827
  118    HA   PHE  14           HA       PHE  14   2.419   5.809   7.823
  119    HD1  PHE  14           2HD      PHE  14   2.307   3.031   4.920
  120    HD2  PHE  14           1HD      PHE  14   1.120   6.963   3.799
  121    HE1  PHE  14           2HE      PHE  14   2.675   2.463   2.557
  122    HE2  PHE  14           1HE      PHE  14   1.488   6.402   1.431
  123    HZ   PHE  14           HZ       PHE  14   2.267   4.149   0.808
  124    HB2  PHE  14           2HB      PHE  14   0.813   4.608   6.378
  125    HB3  PHE  14           1HB      PHE  14   0.909   6.319   5.994
  126    H    SER  15           H        SER  15   1.751   3.225   7.477
  127    HA   SER  15           HA       SER  15   4.295   1.823   7.054
  128    HG   SER  15           HG       SER  15   2.514   2.839   9.877
  129    HB2  SER  15           2HB      SER  15   3.250   0.286   8.970
  130    HB3  SER  15           1HB      SER  15   4.275   1.667   9.340
  131    H    ILE  16           H        ILE  16   3.823  -0.669   7.083
  132    HA   ILE  16           HA       ILE  16   1.267  -1.434   5.964
  133    HB   ILE  16           HB       ILE  16   1.928  -2.091   3.831
  134   HG12  ILE  16          2HG1      ILE  16   4.162  -3.050   4.685
  135   HG13  ILE  16          1HG1      ILE  16   4.065  -2.503   3.018
  136   HG21  ILE  16          1HG2      ILE  16   1.653   0.299   3.896
  137   HG22  ILE  16          2HG2      ILE  16   2.905  -0.127   2.730
  138   HG23  ILE  16          3HG2      ILE  16   3.354   0.509   4.312
  139   HD11  ILE  16          3HD1      ILE  16   6.006  -1.831   4.785
  140   HD12  ILE  16          1HD1      ILE  16   4.922  -0.442   4.884
  141   HD13  ILE  16          2HD1      ILE  16   5.593  -0.927   3.326
  142    H    ALA  17           H        ALA  17   1.386  -3.799   5.273
  143    HA   ALA  17           HA       ALA  17   3.395  -5.379   6.681
  144    HB1  ALA  17           3HB      ALA  17   1.956  -5.793   8.354
  145    HB2  ALA  17           1HB      ALA  17   1.112  -6.814   7.193
  146    HB3  ALA  17           2HB      ALA  17   0.580  -5.149   7.455
  147    H    GLY  18           H        GLY  18   3.110  -7.820   5.884
  148    HA2  GLY  18           2HA      GLY  18   1.577  -8.487   3.728
  149    HA3  GLY  18           1HA      GLY  18   2.895  -7.603   3.008
  150    H    GLY  19           H        GLY  19   1.842 -10.594   3.163
  151    HA2  GLY  19           2HA      GLY  19   3.202 -12.357   2.328
  152    HA3  GLY  19           1HA      GLY  19   4.577 -11.655   3.159
  153    H    VAL  20           H        VAL  20   3.890 -14.370   3.240
  154    HA   VAL  20           HA       VAL  20   2.434 -15.069   5.561
  155    HB   VAL  20           HB       VAL  20   4.649 -16.676   4.261
  156   HG11  VAL  20          1HG1      VAL  20   2.396 -17.428   6.114
  157   HG12  VAL  20          2HG1      VAL  20   4.130 -17.588   6.397
  158   HG13  VAL  20          3HG1      VAL  20   3.336 -18.603   5.193
  159   HG21  VAL  20          3HG2      VAL  20   3.153 -16.303   2.511
  160   HG22  VAL  20          1HG2      VAL  20   1.746 -16.366   3.572
  161   HG23  VAL  20          2HG2      VAL  20   2.623 -17.845   3.181
  162    H    GLY  21           H        GLY  21   3.117 -15.507   7.656
  163    HA2  GLY  21           2HA      GLY  21   4.579 -15.621   9.484
  164    HA3  GLY  21           1HA      GLY  21   5.917 -15.292   8.394
  165    H    ASN  22           H        ASN  22   4.383 -12.908   7.346
  166    HA   ASN  22           HA       ASN  22   4.643 -11.075   9.618
  167    HB2  ASN  22           2HB      ASN  22   5.497  -9.458   7.647
  168    HB3  ASN  22           1HB      ASN  22   6.608 -10.408   8.611
  169   HD21  ASN  22          1HD2      ASN  22   4.530 -10.987   5.784
  170   HD22  ASN  22          2HD2      ASN  22   5.765 -11.735   4.837
  171    H    GLN  23           H        GLN  23   2.404 -12.392   7.914
  172    HA   GLN  23           HA       GLN  23   1.114 -10.581   6.310
  173    HB2  GLN  23           2HB      GLN  23   0.676 -13.093   6.874
  174    HB3  GLN  23           1HB      GLN  23  -0.427 -12.442   8.077
  175    HG2  GLN  23           2HG      GLN  23  -1.784 -11.441   6.438
  176    HG3  GLN  23           1HG      GLN  23  -0.569 -11.670   5.184
  177   HE21  GLN  23          1HE2      GLN  23  -2.586 -13.505   7.453
  178   HE22  GLN  23          2HE2      GLN  23  -2.869 -14.840   6.395
  179    H    HIS  24           H        HIS  24  -0.546  -9.161   6.535
  180    HA   HIS  24           HA       HIS  24  -0.678  -7.713   9.040
  181    HD1  HIS  24           1HD      HIS  24  -0.527  -4.819   8.915
  182    HD2  HIS  24           2HD      HIS  24  -4.178  -5.766   7.182
  183    HE1  HIS  24           1HE      HIS  24  -2.091  -3.028   9.652
  184    HE2  HIS  24           2HE      HIS  24  -4.268  -3.527   8.490
  185    HB2  HIS  24           2HB      HIS  24  -0.470  -6.525   6.872
  186    HB3  HIS  24           1HB      HIS  24  -2.024  -7.167   6.386
  187    H    ILE  25           H        ILE  25  -2.696  -9.914   7.251
  188    HA   ILE  25           HA       ILE  25  -4.622  -9.957   9.385
  189    HB   ILE  25           HB       ILE  25  -6.558  -9.638   7.718
  190   HG12  ILE  25          2HG1      ILE  25  -5.008  -7.678   6.216
  191   HG13  ILE  25          1HG1      ILE  25  -4.480  -9.330   5.914
  192   HG21  ILE  25          1HG2      ILE  25  -5.735  -8.084   9.594
  193   HG22  ILE  25          2HG2      ILE  25  -6.825  -7.435   8.368
  194   HG23  ILE  25          3HG2      ILE  25  -5.096  -7.098   8.279
  195   HD11  ILE  25          3HD1      ILE  25  -6.083  -9.228   4.343
  196   HD12  ILE  25          1HD1      ILE  25  -6.995  -7.982   5.196
  197   HD13  ILE  25          2HD1      ILE  25  -7.123  -9.669   5.697
  198    HA   PRO  26           HA       PRO  26  -4.746 -14.179   8.028
  199    HB2  PRO  26           2HB      PRO  26  -7.430 -14.439   9.178
  200    HB3  PRO  26           1HB      PRO  26  -5.923 -15.216   9.668
  201    HG2  PRO  26           2HG      PRO  26  -7.109 -13.303  11.155
  202    HG3  PRO  26           1HG      PRO  26  -5.349 -13.507  11.095
  203    HD2  PRO  26           2HD      PRO  26  -7.074 -11.498   9.698
  204    HD3  PRO  26           1HD      PRO  26  -5.487 -11.290  10.463
  205    H    GLY  27           H        GLY  27  -5.239 -15.017   6.097
  206    HA2  GLY  27           2HA      GLY  27  -6.925 -15.822   4.566
  207    HA3  GLY  27           1HA      GLY  27  -7.865 -14.384   4.919
  208    H    ASP  28           H        ASP  28  -5.484 -12.595   4.678
  209    HA   ASP  28           HA       ASP  28  -5.028 -12.824   1.780
  210    HB2  ASP  28           2HB      ASP  28  -6.643 -10.906   3.014
  211    HB3  ASP  28           1HB      ASP  28  -5.138 -10.062   2.669
  212    H    ASN  29           H        ASN  29  -2.956 -13.011   1.382
  213    HA   ASN  29           HA       ASN  29  -0.966 -12.061   3.282
  214    HB2  ASN  29           2HB      ASN  29   0.652 -13.190   1.761
  215    HB3  ASN  29           1HB      ASN  29  -0.587 -14.247   2.423
  216   HD21  ASN  29          1HD2      ASN  29  -1.875 -15.355   1.069
  217   HD22  ASN  29          2HD2      ASN  29  -1.836 -15.218  -0.653
  218    H    SER  30           H        SER  30  -2.614 -10.285   1.345
  219    HA   SER  30           HA       SER  30  -0.705  -9.100  -0.417
  220    HG   SER  30           HG       SER  30  -3.879  -9.786  -0.516
  221    HB2  SER  30           2HB      SER  30  -3.344  -7.993   0.574
  222    HB3  SER  30           1HB      SER  30  -2.423  -7.406  -0.811
  223    H    ILE  31           H        ILE  31  -0.678  -6.487  -0.175
  224    HA   ILE  31           HA       ILE  31   0.632  -6.077   2.416
  225    HB   ILE  31           HB       ILE  31   0.833  -4.272   0.008
  226   HG12  ILE  31          2HG1      ILE  31   2.012  -5.983  -0.892
  227   HG13  ILE  31          1HG1      ILE  31   3.281  -5.394   0.162
  228   HG21  ILE  31          1HG2      ILE  31   2.656  -4.435   2.387
  229   HG22  ILE  31          2HG2      ILE  31   1.301  -3.313   2.274
  230   HG23  ILE  31          3HG2      ILE  31   2.629  -3.210   1.120
  231   HD11  ILE  31          3HD1      ILE  31   3.411  -7.466   0.946
  232   HD12  ILE  31          1HD1      ILE  31   1.911  -7.934   0.149
  233   HD13  ILE  31          2HD1      ILE  31   1.866  -7.178   1.740
  234    H    TYR  32           H        TYR  32  -0.536  -5.182   3.966
  235    HA   TYR  32           HA       TYR  32  -2.639  -3.250   3.247
  236    HD1  TYR  32           2HD      TYR  32  -2.408  -6.766   3.523
  237    HD2  TYR  32           1HD      TYR  32  -5.628  -4.284   4.756
  238    HE1  TYR  32           2HE      TYR  32  -3.972  -8.263   2.371
  239    HE2  TYR  32           1HE      TYR  32  -7.221  -5.750   3.622
  240    HH   TYR  32           HH       TYR  32  -7.346  -7.434   1.975
  241    HB2  TYR  32           2HB      TYR  32  -2.338  -5.126   5.576
  242    HB3  TYR  32           1HB      TYR  32  -3.531  -3.834   5.549
  243    H    VAL  33           H        VAL  33  -2.756  -1.277   4.244
  244    HA   VAL  33           HA       VAL  33  -0.378  -0.278   5.520
  245    HB   VAL  33           HB       VAL  33  -3.019   1.044   4.872
  246   HG11  VAL  33          1HG1      VAL  33  -1.399   3.131   5.353
  247   HG12  VAL  33          2HG1      VAL  33  -0.763   1.984   6.532
  248   HG13  VAL  33          3HG1      VAL  33  -2.467   2.434   6.573
  249   HG21  VAL  33          3HG2      VAL  33  -2.110   1.343   2.867
  250   HG22  VAL  33          1HG2      VAL  33  -0.628   0.542   3.390
  251   HG23  VAL  33          2HG2      VAL  33  -0.817   2.283   3.611
  252    H    THR  34           H        THR  34   0.013  -0.407   7.629
  253    HA   THR  34           HA       THR  34  -2.162  -1.092   9.448
  254    HB   THR  34           HB       THR  34  -0.127  -2.470   9.404
  255    HG1  THR  34           1HG      THR  34  -0.423  -1.122  11.881
  256   HG21  THR  34          3HG2      THR  34   1.936  -1.704   9.580
  257   HG22  THR  34          1HG2      THR  34   1.537  -0.765  11.020
  258   HG23  THR  34          2HG2      THR  34   1.273  -0.077   9.416
  259    H    LYS  35           H        LYS  35  -0.039   1.654   8.882
  260    HA   LYS  35           HA       LYS  35  -1.547   3.204  10.792
  261    HB2  LYS  35           2HB      LYS  35   1.344   2.548  11.336
  262    HB3  LYS  35           1HB      LYS  35   0.558   3.959  12.018
  263    HG2  LYS  35           2HG      LYS  35  -1.195   2.088  12.770
  264    HG3  LYS  35           1HG      LYS  35   0.271   1.106  12.699
  265    HD2  LYS  35           2HD      LYS  35   0.996   3.497  13.982
  266    HD3  LYS  35           1HD      LYS  35  -0.552   3.020  14.684
  267    HE2  LYS  35           2HE      LYS  35   0.284   1.028  15.504
  268    HE3  LYS  35           1HE      LYS  35   1.609   0.986  14.342
  269    HZ1  LYS  35           3HZ      LYS  35   2.362   1.495  16.596
  270    HZ2  LYS  35           1HZ      LYS  35   1.399   2.885  16.618
  271    HZ3  LYS  35           2HZ      LYS  35   2.691   2.768  15.532
  272    H    ILE  36           H        ILE  36  -1.795   5.188   9.967
  273    HA   ILE  36           HA       ILE  36   0.157   6.112   7.980
  274    HB   ILE  36           HB       ILE  36  -2.634   7.147   8.506
  275   HG12  ILE  36          2HG1      ILE  36  -1.511   5.290   6.399
  276   HG13  ILE  36          1HG1      ILE  36  -2.784   4.944   7.564
  277   HG21  ILE  36          1HG2      ILE  36  -1.015   8.815   7.605
  278   HG22  ILE  36          2HG2      ILE  36  -2.362   8.472   6.522
  279   HG23  ILE  36          3HG2      ILE  36  -0.779   7.763   6.209
  280   HD11  ILE  36          3HD1      ILE  36  -4.167   6.694   6.421
  281   HD12  ILE  36          1HD1      ILE  36  -3.815   5.256   5.460
  282   HD13  ILE  36          2HD1      ILE  36  -2.924   6.750   5.171
  283    H    ILE  37           H        ILE  37   1.586   7.633   8.538
  284    HA   ILE  37           HA       ILE  37   1.517   8.921  11.087
  285    HB   ILE  37           HB       ILE  37   3.338   9.170   8.699
  286   HG12  ILE  37          2HG1      ILE  37   4.721   8.557  11.080
  287   HG13  ILE  37          1HG1      ILE  37   3.267   7.567  11.087
  288   HG21  ILE  37          1HG2      ILE  37   4.796  10.575  10.240
  289   HG22  ILE  37          2HG2      ILE  37   3.333  10.843  11.188
  290   HG23  ILE  37          3HG2      ILE  37   3.401  11.364   9.505
  291   HD11  ILE  37          3HD1      ILE  37   3.859   6.671   8.908
  292   HD12  ILE  37          1HD1      ILE  37   5.153   6.408  10.076
  293   HD13  ILE  37          2HD1      ILE  37   5.298   7.689   8.872
  294    H    GLU  38           H        GLU  38   1.135  11.083  11.587
  295    HA   GLU  38           HA       GLU  38  -0.852  12.449  10.211
  296    HB2  GLU  38           2HB      GLU  38   0.079  12.790  12.628
  297    HB3  GLU  38           1HB      GLU  38   1.150  13.956  11.863
  298    HG2  GLU  38           2HG      GLU  38  -1.725  14.191  11.230
  299    HG3  GLU  38           1HG      GLU  38  -1.242  14.584  12.878
  300    H    GLY  39           H        GLY  39  -0.889  14.236   8.847
  301    HA2  GLY  39           2HA      GLY  39  -0.232  15.479   7.035
  302    HA3  GLY  39           1HA      GLY  39   1.250  15.738   7.935
  303    H    GLY  40           H        GLY  40   0.394  12.485   7.016
  304    HA2  GLY  40           2HA      GLY  40   2.772  12.350   5.354
  305    HA3  GLY  40           1HA      GLY  40   1.771  10.998   5.859
  306    H    ALA  41           H        ALA  41   2.594  10.911   3.342
  307    HA   ALA  41           HA       ALA  41   1.222  12.235   1.346
  308    HB1  ALA  41           3HB      ALA  41   1.979   9.322   1.234
  309    HB2  ALA  41           1HB      ALA  41   3.125  10.648   1.033
  310    HB3  ALA  41           2HB      ALA  41   1.804  10.440  -0.118
  311    H    ALA  42           H        ALA  42   0.231   9.241   3.029
  312    HA   ALA  42           HA       ALA  42  -2.232   9.028   1.584
  313    HB1  ALA  42           3HB      ALA  42  -1.291   7.012   2.429
  314    HB2  ALA  42           1HB      ALA  42  -2.774   7.306   3.336
  315    HB3  ALA  42           2HB      ALA  42  -1.209   7.661   4.066
  316    H    HIS  43           H        HIS  43  -1.441   9.885   4.959
  317    HA   HIS  43           HA       HIS  43  -3.926  10.504   5.933
  318    HD1  HIS  43           1HD      HIS  43  -2.689  14.136   7.324
  319    HD2  HIS  43           2HD      HIS  43  -3.727  10.610   9.264
  320    HE1  HIS  43           1HE      HIS  43  -4.005  14.845   9.343
  321    HE2  HIS  43           2HE      HIS  43  -4.558  12.700  10.546
  322    HB2  HIS  43           2HB      HIS  43  -1.805  10.508   7.237
  323    HB3  HIS  43           1HB      HIS  43  -1.393  12.053   6.508
  324    H    LYS  44           H        LYS  44  -1.794  12.623   4.044
  325    HA   LYS  44           HA       LYS  44  -3.568  14.873   4.164
  326    HB2  LYS  44           2HB      LYS  44  -1.198  14.307   2.375
  327    HB3  LYS  44           1HB      LYS  44  -2.058  15.839   2.430
  328    HG2  LYS  44           2HG      LYS  44  -1.160  14.909   5.049
  329    HG3  LYS  44           1HG      LYS  44   0.150  15.197   3.903
  330    HD2  LYS  44           2HD      LYS  44  -1.286  17.411   3.467
  331    HD3  LYS  44           1HD      LYS  44  -1.753  17.102   5.140
  332    HE2  LYS  44           2HE      LYS  44   0.856  16.780   5.432
  333    HE3  LYS  44           1HE      LYS  44   0.904  17.809   4.000
  334    HZ1  LYS  44           3HZ      LYS  44  -0.426  19.450   5.201
  335    HZ2  LYS  44           1HZ      LYS  44   1.029  19.129   6.004
  336    HZ3  LYS  44           2HZ      LYS  44  -0.418  18.467   6.579
  337    H    ASP  45           H        ASP  45  -3.013  12.222   1.921
  338    HA   ASP  45           HA       ASP  45  -4.483  13.240  -0.262
  339    HB2  ASP  45           2HB      ASP  45  -2.867  11.285  -0.285
  340    HB3  ASP  45           1HB      ASP  45  -4.148  10.320   0.434
  341    H    GLY  46           H        GLY  46  -5.432  10.840   2.229
  342    HA2  GLY  46           2HA      GLY  46  -7.535  10.866   3.329
  343    HA3  GLY  46           1HA      GLY  46  -8.192  11.805   2.000
  344    H    LYS  47           H        LYS  47  -6.928   9.926   0.011
  345    HA   LYS  47           HA       LYS  47  -9.150   8.175  -0.249
  346    HB2  LYS  47           2HB      LYS  47  -6.530   8.146  -1.753
  347    HB3  LYS  47           1HB      LYS  47  -7.999   7.310  -2.227
  348    HG2  LYS  47           2HG      LYS  47  -8.982   9.780  -2.078
  349    HG3  LYS  47           1HG      LYS  47  -7.297  10.177  -2.422
  350    HD2  LYS  47           2HD      LYS  47  -7.824   9.867  -4.576
  351    HD3  LYS  47           1HD      LYS  47  -7.832   8.143  -4.202
  352    HE2  LYS  47           2HE      LYS  47 -10.336   9.126  -3.398
  353    HE3  LYS  47           1HE      LYS  47 -10.011   9.852  -4.971
  354    HZ1  LYS  47           3HZ      LYS  47  -9.923   6.947  -4.349
  355    HZ2  LYS  47           1HZ      LYS  47  -9.595   7.637  -5.859
  356    HZ3  LYS  47           2HZ      LYS  47 -11.149   7.740  -5.202
  357    H    LEU  48           H        LEU  48  -5.778   7.678   0.820
  358    HA   LEU  48           HA       LEU  48  -6.238   4.823   1.114
  359    HG   LEU  48           HG       LEU  48  -4.364   3.526   0.890
  360    HB2  LEU  48           2HB      LEU  48  -4.063   6.070   0.321
  361    HB3  LEU  48           1HB      LEU  48  -3.762   6.223   2.040
  362   HD11  LEU  48          1HD1      LEU  48  -1.714   4.953   0.771
  363   HD12  LEU  48          2HD1      LEU  48  -2.655   4.327  -0.584
  364   HD13  LEU  48          3HD1      LEU  48  -1.919   3.213   0.568
  365   HD21  LEU  48          3HD2      LEU  48  -2.337   4.064   2.988
  366   HD22  LEU  48          1HD2      LEU  48  -3.464   2.719   2.813
  367   HD23  LEU  48          2HD2      LEU  48  -4.035   4.276   3.412
  368    H    GLN  49           H        GLN  49  -7.048   3.980   2.912
  369    HA   GLN  49           HA       GLN  49  -6.547   5.325   5.477
  370    HB2  GLN  49           2HB      GLN  49  -8.753   4.877   6.214
  371    HB3  GLN  49           1HB      GLN  49  -8.912   5.580   4.615
  372    HG2  GLN  49           2HG      GLN  49  -8.937   2.612   5.061
  373    HG3  GLN  49           1HG      GLN  49 -10.392   3.594   5.187
  374   HE21  GLN  49          1HE2      GLN  49  -8.301   1.937   3.110
  375   HE22  GLN  49          2HE2      GLN  49  -8.991   2.446   1.611
  376    H    ILE  50           H        ILE  50  -5.947   4.032   7.175
  377    HA   ILE  50           HA       ILE  50  -4.597   1.698   6.815
  378    HB   ILE  50           HB       ILE  50  -5.059   1.171   9.244
  379   HG12  ILE  50          2HG1      ILE  50  -6.081   3.668  10.063
  380   HG13  ILE  50          1HG1      ILE  50  -7.156   3.102   8.789
  381   HG21  ILE  50          1HG2      ILE  50  -3.169   2.558   8.424
  382   HG22  ILE  50          2HG2      ILE  50  -3.699   2.966  10.056
  383   HG23  ILE  50          3HG2      ILE  50  -4.160   3.992   8.697
  384   HD11  ILE  50          3HD1      ILE  50  -8.172   1.848  10.296
  385   HD12  ILE  50          1HD1      ILE  50  -6.969   2.263  11.516
  386   HD13  ILE  50          2HD1      ILE  50  -6.698   0.892  10.441
  387    H    GLY  51           H        GLY  51  -5.111  -0.291   6.171
  388    HA2  GLY  51           2HA      GLY  51  -6.432  -2.304   6.765
  389    HA3  GLY  51           1HA      GLY  51  -7.853  -1.285   6.682
  390    H    ASP  52           H        ASP  52  -6.376   0.015   4.208
  391    HA   ASP  52           HA       ASP  52  -7.784  -1.491   2.285
  392    HB2  ASP  52           2HB      ASP  52  -6.394  -0.047   0.648
  393    HB3  ASP  52           1HB      ASP  52  -7.548   0.751   1.705
  394    H    LYS  53           H        LYS  53  -6.791  -2.504   0.357
  395    HA   LYS  53           HA       LYS  53  -4.385  -4.006   1.145
  396    HB2  LYS  53           2HB      LYS  53  -6.449  -5.330   0.825
  397    HB3  LYS  53           1HB      LYS  53  -6.555  -4.746  -0.827
  398    HG2  LYS  53           2HG      LYS  53  -4.717  -5.992  -1.516
  399    HG3  LYS  53           1HG      LYS  53  -4.139  -6.224   0.135
  400    HD2  LYS  53           2HD      LYS  53  -5.176  -8.194   0.132
  401    HD3  LYS  53           1HD      LYS  53  -6.701  -7.310   0.113
  402    HE2  LYS  53           2HE      LYS  53  -5.704  -7.363  -2.540
  403    HE3  LYS  53           1HE      LYS  53  -5.588  -9.000  -1.892
  404    HZ1  LYS  53           3HZ      LYS  53  -8.064  -8.072  -1.116
  405    HZ2  LYS  53           1HZ      LYS  53  -7.742  -9.198  -2.337
  406    HZ3  LYS  53           2HZ      LYS  53  -7.895  -7.556  -2.719
  407    H    LEU  54           H        LEU  54  -2.764  -4.298  -0.278
  408    HA   LEU  54           HA       LEU  54  -2.621  -2.343  -2.453
  409    HG   LEU  54           HG       LEU  54  -1.266  -0.890  -1.302
  410    HB2  LEU  54           2HB      LEU  54  -0.751  -3.310  -0.520
  411    HB3  LEU  54           1HB      LEU  54  -0.095  -3.520  -2.128
  412   HD11  LEU  54          1HD1      LEU  54   0.791  -2.055   0.119
  413   HD12  LEU  54          2HD1      LEU  54   0.424  -0.333   0.033
  414   HD13  LEU  54          3HD1      LEU  54   1.623  -1.034  -1.054
  415   HD21  LEU  54          3HD2      LEU  54  -0.789  -0.651  -3.492
  416   HD22  LEU  54          1HD2      LEU  54   0.394  -1.959  -3.492
  417   HD23  LEU  54          2HD2      LEU  54   0.841  -0.364  -2.887
  418    H    LEU  55           H        LEU  55  -3.025  -2.952  -4.405
  419    HA   LEU  55           HA       LEU  55  -2.899  -5.712  -5.223
  420    HG   LEU  55           HG       LEU  55  -2.877  -5.014  -8.263
  421    HB2  LEU  55           2HB      LEU  55  -4.745  -4.351  -5.991
  422    HB3  LEU  55           1HB      LEU  55  -3.644  -3.184  -6.692
  423   HD11  LEU  55          1HD1      LEU  55  -3.813  -6.853  -6.814
  424   HD12  LEU  55          2HD1      LEU  55  -4.192  -6.964  -8.534
  425   HD13  LEU  55          3HD1      LEU  55  -5.411  -6.385  -7.397
  426   HD21  LEU  55          3HD2      LEU  55  -4.461  -4.418  -9.811
  427   HD22  LEU  55          1HD2      LEU  55  -4.709  -3.160  -8.600
  428   HD23  LEU  55          2HD2      LEU  55  -5.793  -4.550  -8.663
  429    H    ALA  56           H        ALA  56  -1.356  -2.647  -6.280
  430    HA   ALA  56           HA       ALA  56   1.099  -4.100  -6.844
  431    HB1  ALA  56           3HB      ALA  56   0.080  -4.541  -8.935
  432    HB2  ALA  56           1HB      ALA  56   1.152  -3.169  -9.233
  433    HB3  ALA  56           2HB      ALA  56  -0.582  -2.910  -9.046
  434    H    VAL  57           H        VAL  57   2.937  -2.736  -7.217
  435    HA   VAL  57           HA       VAL  57   2.501   0.150  -6.834
  436    HB   VAL  57           HB       VAL  57   4.681  -1.300  -5.339
  437   HG11  VAL  57          1HG1      VAL  57   4.813   1.181  -5.833
  438   HG12  VAL  57          2HG1      VAL  57   4.948   0.716  -4.138
  439   HG13  VAL  57          3HG1      VAL  57   3.431   1.373  -4.755
  440   HG21  VAL  57          3HG2      VAL  57   3.211  -0.934  -3.311
  441   HG22  VAL  57          1HG2      VAL  57   2.716  -2.225  -4.406
  442   HG23  VAL  57          2HG2      VAL  57   1.882  -0.673  -4.441
  443    H    ASN  58           H        ASN  58   3.463   1.191  -8.454
  444    HA   ASN  58           HA       ASN  58   4.913   1.767 -10.106
  445    HB2  ASN  58           2HB      ASN  58   6.880   0.137  -8.479
  446    HB3  ASN  58           1HB      ASN  58   7.309   1.232  -9.788
  447   HD21  ASN  58          1HD2      ASN  58   7.076   0.947  -6.525
  448   HD22  ASN  58          2HD2      ASN  58   6.961   2.617  -6.097
  449    H    ASN  59           H        ASN  59   3.243  -0.383 -10.606
  450    HA   ASN  59           HA       ASN  59   2.865  -1.743 -12.409
  451    HB2  ASN  59           2HB      ASN  59   5.855  -1.683 -12.851
  452    HB3  ASN  59           1HB      ASN  59   4.690  -2.468 -13.909
  453   HD21  ASN  59          1HD2      ASN  59   3.387  -1.235 -15.234
  454   HD22  ASN  59          2HD2      ASN  59   3.652   0.452 -15.494
  455    H    VAL  60           H        VAL  60   4.991  -2.550  -9.802
  456    HA   VAL  60           HA       VAL  60   4.913  -5.400 -10.396
  457    HB   VAL  60           HB       VAL  60   6.272  -5.753  -8.469
  458   HG11  VAL  60          1HG1      VAL  60   7.119  -4.341 -10.606
  459   HG12  VAL  60          2HG1      VAL  60   8.178  -4.901  -9.311
  460   HG13  VAL  60          3HG1      VAL  60   7.568  -3.246  -9.297
  461   HG21  VAL  60          3HG2      VAL  60   4.982  -3.492  -7.419
  462   HG22  VAL  60          1HG2      VAL  60   6.701  -3.107  -7.474
  463   HG23  VAL  60          2HG2      VAL  60   6.145  -4.545  -6.618
  464    H    CYS  61           H        CYS  61   3.858  -6.961  -9.058
  465    HA   CYS  61           HA       CYS  61   1.431  -5.913  -7.862
  466    HG   CYS  61           HG       CYS  61   2.796  -9.722  -9.191
  467    HB2  CYS  61           2HB      CYS  61   0.712  -8.244  -7.700
  468    HB3  CYS  61           1HB      CYS  61   1.241  -7.847  -9.329
  469    H    LEU  62           H        LEU  62   1.031  -5.700  -5.765
  470    HA   LEU  62           HA       LEU  62   3.038  -6.652  -3.859
  471    HG   LEU  62           HG       LEU  62   3.388  -5.221  -1.860
  472    HB2  LEU  62           2HB      LEU  62   1.886  -4.148  -4.244
  473    HB3  LEU  62           1HB      LEU  62   1.088  -4.771  -2.820
  474   HD11  LEU  62          1HD1      LEU  62   5.232  -3.888  -2.854
  475   HD12  LEU  62          2HD1      LEU  62   4.203  -3.587  -4.255
  476   HD13  LEU  62          3HD1      LEU  62   4.700  -5.233  -3.862
  477   HD21  LEU  62          3HD2      LEU  62   2.123  -2.600  -2.315
  478   HD22  LEU  62          1HD2      LEU  62   3.795  -2.562  -1.756
  479   HD23  LEU  62          2HD2      LEU  62   2.569  -3.403  -0.811
  480    H    GLU  63           H        GLU  63   0.777  -8.219  -5.043
  481    HA   GLU  63           HA       GLU  63  -0.829  -8.744  -2.642
  482    HB2  GLU  63           2HB      GLU  63  -1.686  -8.326  -5.169
  483    HB3  GLU  63           1HB      GLU  63  -1.513 -10.075  -5.196
  484    HG2  GLU  63           2HG      GLU  63  -2.976 -10.239  -3.237
  485    HG3  GLU  63           1HG      GLU  63  -3.169  -8.486  -3.250
  486    H    GLU  64           H        GLU  64   1.612 -10.140  -4.689
  487    HA   GLU  64           HA       GLU  64   1.441 -12.625  -3.127
  488    HB2  GLU  64           2HB      GLU  64   1.027 -12.386  -5.885
  489    HB3  GLU  64           1HB      GLU  64   2.640 -13.055  -5.709
  490    HG2  GLU  64           2HG      GLU  64   0.425 -14.236  -4.120
  491    HG3  GLU  64           1HG      GLU  64   0.534 -14.606  -5.841
  492    H    VAL  65           H        VAL  65   2.980 -10.627  -2.195
  493    HA   VAL  65           HA       VAL  65   5.695 -11.653  -2.662
  494    HB   VAL  65           HB       VAL  65   6.601  -9.329  -2.430
  495   HG11  VAL  65          1HG1      VAL  65   4.896  -9.334  -4.871
  496   HG12  VAL  65          2HG1      VAL  65   6.031 -10.665  -4.636
  497   HG13  VAL  65          3HG1      VAL  65   6.621  -9.003  -4.696
  498   HG21  VAL  65          3HG2      VAL  65   5.073  -7.460  -3.001
  499   HG22  VAL  65          1HG2      VAL  65   4.704  -8.215  -1.451
  500   HG23  VAL  65          2HG2      VAL  65   3.711  -8.573  -2.865
  501    H    THR  66           H        THR  66   7.191 -11.263  -0.951
  502    HA   THR  66           HA       THR  66   6.060 -11.612   1.638
  503    HB   THR  66           HB       THR  66   8.880 -10.816   1.616
  504    HG1  THR  66           1HG      THR  66   9.376 -11.786  -0.170
  505   HG21  THR  66          3HG2      THR  66   7.593 -12.216   3.343
  506   HG22  THR  66          1HG2      THR  66   9.228 -12.706   2.903
  507   HG23  THR  66          2HG2      THR  66   7.840 -13.551   2.218
  508    H    HIS  67           H        HIS  67   7.329 -10.168   3.466
  509    HA   HIS  67           HA       HIS  67   6.089  -7.620   3.224
  510    HD1  HIS  67           1HD      HIS  67   4.906  -6.998   6.343
  511    HD2  HIS  67           2HD      HIS  67   8.649  -5.526   5.329
  512    HE1  HIS  67           1HE      HIS  67   4.903  -4.599   7.060
  513    HE2  HIS  67           2HE      HIS  67   7.126  -3.695   6.315
  514    HB2  HIS  67           2HB      HIS  67   6.367  -8.758   5.414
  515    HB3  HIS  67           1HB      HIS  67   8.092  -8.426   5.352
  516    H    GLU  68           H        GLU  68   9.422  -8.737   2.898
  517    HA   GLU  68           HA       GLU  68  10.776  -6.342   2.790
  518    HB2  GLU  68           2HB      GLU  68  11.243  -8.790   1.073
  519    HB3  GLU  68           1HB      GLU  68  12.395  -7.482   1.303
  520    HG2  GLU  68           2HG      GLU  68  11.375  -9.372   3.411
  521    HG3  GLU  68           1HG      GLU  68  12.986  -9.350   2.695
  522    H    GLU  69           H        GLU  69   9.138  -8.003   0.084
  523    HA   GLU  69           HA       GLU  69   9.725  -6.028  -1.850
  524    HB2  GLU  69           2HB      GLU  69   8.639  -8.515  -1.966
  525    HB3  GLU  69           1HB      GLU  69   7.206  -7.527  -2.208
  526    HG2  GLU  69           2HG      GLU  69   9.712  -7.143  -3.812
  527    HG3  GLU  69           1HG      GLU  69   8.448  -8.280  -4.276
  528    H    ALA  70           H        ALA  70   7.127  -6.352   0.508
  529    HA   ALA  70           HA       ALA  70   5.333  -4.439  -0.518
  530    HB1  ALA  70           3HB      ALA  70   5.840  -5.037   2.392
  531    HB2  ALA  70           1HB      ALA  70   4.867  -6.052   1.331
  532    HB3  ALA  70           2HB      ALA  70   4.367  -4.396   1.672
  533    H    VAL  71           H        VAL  71   8.096  -4.135   1.674
  534    HA   VAL  71           HA       VAL  71   7.770  -1.283   1.983
  535    HB   VAL  71           HB       VAL  71   9.916  -3.204   2.895
  536   HG11  VAL  71          1HG1      VAL  71  11.223  -1.325   2.669
  537   HG12  VAL  71          2HG1      VAL  71  10.600  -1.103   4.302
  538   HG13  VAL  71          3HG1      VAL  71   9.881  -0.221   2.955
  539   HG21  VAL  71          3HG2      VAL  71   7.504  -2.872   3.953
  540   HG22  VAL  71          1HG2      VAL  71   8.315  -1.519   4.739
  541   HG23  VAL  71          2HG2      VAL  71   8.931  -3.157   4.948
  542    H    THR  72           H        THR  72   9.744  -3.471   0.062
  543    HA   THR  72           HA       THR  72  11.612  -1.592  -0.886
  544    HB   THR  72           HB       THR  72  10.632  -4.194  -2.065
  545    HG1  THR  72           1HG      THR  72  12.949  -3.476  -0.597
  546   HG21  THR  72          3HG2      THR  72  12.762  -4.175  -3.366
  547   HG22  THR  72          1HG2      THR  72  12.930  -2.469  -2.954
  548   HG23  THR  72          2HG2      THR  72  11.554  -3.012  -3.915
  549    H    ALA  73           H        ALA  73   8.386  -2.502  -2.028
  550    HA   ALA  73           HA       ALA  73   8.596  -1.004  -4.458
  551    HB1  ALA  73           3HB      ALA  73   6.486  -1.790  -4.972
  552    HB2  ALA  73           1HB      ALA  73   5.987  -1.874  -3.283
  553    HB3  ALA  73           2HB      ALA  73   7.108  -3.070  -3.932
  554    H    LEU  74           H        LEU  74   7.256  -0.451  -1.214
  555    HA   LEU  74           HA       LEU  74   5.928   1.992  -1.889
  556    HG   LEU  74           HG       LEU  74   4.409   0.791   1.245
  557    HB2  LEU  74           2HB      LEU  74   6.664   0.529   0.596
  558    HB3  LEU  74           1HB      LEU  74   6.339   2.243   0.742
  559   HD11  LEU  74          1HD1      LEU  74   4.117   3.120   0.553
  560   HD12  LEU  74          2HD1      LEU  74   2.779   2.104   0.017
  561   HD13  LEU  74          3HD1      LEU  74   4.024   2.602  -1.129
  562   HD21  LEU  74          3HD2      LEU  74   4.924  -0.123  -1.522
  563   HD22  LEU  74          1HD2      LEU  74   3.242   0.048  -1.024
  564   HD23  LEU  74          2HD2      LEU  74   4.325  -1.014  -0.124
  565    H    LYS  75           H        LYS  75   9.103   1.043  -0.803
  566    HA   LYS  75           HA       LYS  75   9.974   3.777  -0.345
  567    HB2  LYS  75           2HB      LYS  75  11.952   2.912   0.514
  568    HB3  LYS  75           1HB      LYS  75  10.766   1.688   0.935
  569    HG2  LYS  75           2HG      LYS  75  11.525   0.559  -1.276
  570    HG3  LYS  75           1HG      LYS  75  12.946   1.588  -1.102
  571    HD2  LYS  75           2HD      LYS  75  11.929  -0.315   1.007
  572    HD3  LYS  75           1HD      LYS  75  13.240  -0.671  -0.118
  573    HE2  LYS  75           2HE      LYS  75  13.439   1.823   1.475
  574    HE3  LYS  75           1HE      LYS  75  13.664   0.298   2.328
  575    HZ1  LYS  75           3HZ      LYS  75  15.409  -0.284   0.757
  576    HZ2  LYS  75           1HZ      LYS  75  15.763   1.182   1.525
  577    HZ3  LYS  75           2HZ      LYS  75  15.190   1.177  -0.066
  578    H    ASN  76           H        ASN  76   9.933   1.607  -3.032
  579    HA   ASN  76           HA       ASN  76  12.100   2.931  -4.429
  580    HB2  ASN  76           2HB      ASN  76  11.582   0.468  -4.657
  581    HB3  ASN  76           1HB      ASN  76  10.138   0.925  -5.555
  582   HD21  ASN  76          1HD2      ASN  76  10.349   0.956  -7.671
  583   HD22  ASN  76          2HD2      ASN  76  11.821   1.170  -8.546
  584    H    THR  77           H        THR  77  10.751   5.020  -4.012
  585    HA   THR  77           HA       THR  77   9.181   5.535  -6.451
  586    HB   THR  77           HB       THR  77   7.824   7.159  -5.052
  587    HG1  THR  77           1HG      THR  77   7.831   6.793  -2.824
  588   HG21  THR  77          3HG2      THR  77   6.714   5.172  -5.663
  589   HG22  THR  77          1HG2      THR  77   6.455   5.374  -3.930
  590   HG23  THR  77          2HG2      THR  77   7.645   4.211  -4.514
  591    H    SER  78           H        SER  78   9.368   7.599  -7.366
  592    HA   SER  78           HA       SER  78  11.684   9.152  -6.407
  593    HG   SER  78           HG       SER  78  11.611   7.260  -9.429
  594    HB2  SER  78           2HB      SER  78  10.590   9.074  -9.229
  595    HB3  SER  78           1HB      SER  78  12.111   9.788  -8.694
  596    H    ASP  79           H        ASP  79  10.976  11.301  -8.395
  597    HA   ASP  79           HA       ASP  79   9.826  13.150  -6.764
  598    HB2  ASP  79           2HB      ASP  79   9.370  14.500  -8.746
  599    HB3  ASP  79           1HB      ASP  79  10.927  13.693  -8.898
  600    H    PHE  80           H        PHE  80   8.073  10.943  -8.942
  601    HA   PHE  80           HA       PHE  80   5.591  11.842  -7.637
  602    HD1  PHE  80           1HD      PHE  80   5.667  14.078  -9.694
  603    HD2  PHE  80           2HD      PHE  80   2.742  10.990  -9.646
  604    HE1  PHE  80           1HE      PHE  80   3.888  15.770  -9.568
  605    HE2  PHE  80           2HE      PHE  80   0.957  12.678  -9.527
  606    HZ   PHE  80           HZ       PHE  80   1.531  15.070  -9.476
  607    HB2  PHE  80           2HB      PHE  80   6.171  11.727 -10.414
  608    HB3  PHE  80           1HB      PHE  80   4.989  10.462 -10.072
  609    H    VAL  81           H        VAL  81   3.842  10.049  -7.628
  610    HA   VAL  81           HA       VAL  81   5.078   7.415  -7.271
  611    HB   VAL  81           HB       VAL  81   3.594   9.039  -5.244
  612   HG11  VAL  81          1HG1      VAL  81   3.498   6.040  -5.450
  613   HG12  VAL  81          2HG1      VAL  81   2.152   7.172  -5.300
  614   HG13  VAL  81          3HG1      VAL  81   3.237   6.905  -3.936
  615   HG21  VAL  81          3HG2      VAL  81   5.416   8.742  -3.967
  616   HG22  VAL  81          1HG2      VAL  81   6.196   8.349  -5.498
  617   HG23  VAL  81          2HG2      VAL  81   5.611   7.058  -4.450
  618    H    TYR  82           H        TYR  82   3.726   5.664  -7.567
  619    HA   TYR  82           HA       TYR  82   0.936   6.125  -8.314
  620    HD1  TYR  82           1HD      TYR  82   1.397   2.556  -9.992
  621    HD2  TYR  82           2HD      TYR  82   0.002   6.349 -11.316
  622    HE1  TYR  82           1HE      TYR  82  -0.524   1.471 -11.056
  623    HE2  TYR  82           2HE      TYR  82  -1.930   5.272 -12.384
  624    HH   TYR  82           HH       TYR  82  -2.228   2.526 -13.306
  625    HB2  TYR  82           2HB      TYR  82   2.228   6.110 -10.439
  626    HB3  TYR  82           1HB      TYR  82   2.866   4.524 -10.020
  627    H    LEU  83           H        LEU  83  -0.350   4.651  -7.300
  628    HA   LEU  83           HA       LEU  83   0.847   2.094  -6.514
  629    HG   LEU  83           HG       LEU  83   0.024   1.096  -4.452
  630    HB2  LEU  83           2HB      LEU  83   0.841   3.696  -4.625
  631    HB3  LEU  83           1HB      LEU  83  -0.897   3.854  -4.788
  632   HD11  LEU  83          1HD1      LEU  83   0.588   3.185  -2.377
  633   HD12  LEU  83          2HD1      LEU  83   1.641   1.902  -2.974
  634   HD13  LEU  83          3HD1      LEU  83   0.272   1.506  -1.936
  635   HD21  LEU  83          3HD2      LEU  83  -2.118   2.865  -3.316
  636   HD22  LEU  83          1HD2      LEU  83  -1.807   1.251  -2.672
  637   HD23  LEU  83          2HD2      LEU  83  -2.286   1.452  -4.358
  638    H    LYS  84           H        LYS  84  -0.590   0.354  -6.330
  639    HA   LYS  84           HA       LYS  84  -3.272   0.784  -7.454
  640    HB2  LYS  84           2HB      LYS  84  -1.184  -1.209  -8.141
  641    HB3  LYS  84           1HB      LYS  84  -2.846  -1.776  -8.114
  642    HG2  LYS  84           2HG      LYS  84  -2.786   0.678  -9.533
  643    HG3  LYS  84           1HG      LYS  84  -1.490  -0.346 -10.152
  644    HD2  LYS  84           2HD      LYS  84  -3.086  -1.278 -11.418
  645    HD3  LYS  84           1HD      LYS  84  -3.566  -2.114  -9.939
  646    HE2  LYS  84           2HE      LYS  84  -4.980   0.023  -9.505
  647    HE3  LYS  84           1HE      LYS  84  -4.776   0.297 -11.234
  648    HZ1  LYS  84           3HZ      LYS  84  -5.644  -2.050 -11.509
  649    HZ2  LYS  84           1HZ      LYS  84  -6.768  -0.884 -11.017
  650    HZ3  LYS  84           2HZ      LYS  84  -6.124  -1.969  -9.890
  651    H    VAL  85           H        VAL  85  -4.936   0.067  -6.258
  652    HA   VAL  85           HA       VAL  85  -4.283  -1.591  -3.917
  653    HB   VAL  85           HB       VAL  85  -6.532   0.405  -4.280
  654   HG11  VAL  85          1HG1      VAL  85  -5.984  -0.587  -1.581
  655   HG12  VAL  85          2HG1      VAL  85  -6.620  -1.810  -2.679
  656   HG13  VAL  85          3HG1      VAL  85  -7.522  -0.319  -2.404
  657   HG21  VAL  85          3HG2      VAL  85  -5.329   1.589  -2.409
  658   HG22  VAL  85          1HG2      VAL  85  -4.499   1.584  -3.965
  659   HG23  VAL  85          2HG2      VAL  85  -3.980   0.487  -2.687
  660    H    ALA  86           H        ALA  86  -5.434  -3.426  -3.503
  661    HA   ALA  86           HA       ALA  86  -7.224  -4.352  -5.627
  662    HB1  ALA  86           3HB      ALA  86  -6.912  -6.562  -4.233
  663    HB2  ALA  86           1HB      ALA  86  -5.499  -5.706  -3.614
  664    HB3  ALA  86           2HB      ALA  86  -5.662  -6.003  -5.345
  665    H    LYS  87           H        LYS  87  -9.263  -5.260  -5.185
  666    HA   LYS  87           HA       LYS  87 -10.454  -4.327  -2.662
  667    HB2  LYS  87           2HB      LYS  87 -11.371  -4.398  -5.441
  668    HB3  LYS  87           1HB      LYS  87 -12.559  -5.018  -4.304
  669    HG2  LYS  87           2HG      LYS  87 -13.016  -2.990  -3.498
  670    HG3  LYS  87           1HG      LYS  87 -11.314  -2.529  -3.434
  671    HD2  LYS  87           2HD      LYS  87 -11.370  -1.543  -5.466
  672    HD3  LYS  87           1HD      LYS  87 -12.473  -2.747  -6.135
  673    HE2  LYS  87           2HE      LYS  87 -14.316  -1.688  -4.849
  674    HE3  LYS  87           1HE      LYS  87 -13.189  -0.432  -4.340
  675    HZ1  LYS  87           3HZ      LYS  87 -14.037  -1.028  -7.123
  676    HZ2  LYS  87           1HZ      LYS  87 -12.845   0.099  -6.708
  677    HZ3  LYS  87           2HZ      LYS  87 -14.445   0.337  -6.212
  678    HA   PRO  88           HA       PRO  88 -10.519  -8.708  -1.588
  679    HB2  PRO  88           2HB      PRO  88 -11.972  -7.691   0.773
  680    HB3  PRO  88           1HB      PRO  88 -10.487  -8.643   0.690
  681    HG2  PRO  88           2HG      PRO  88 -10.445  -6.055   1.379
  682    HG3  PRO  88           1HG      PRO  88  -9.146  -6.779   0.411
  683    HD2  PRO  88           2HD      PRO  88 -11.435  -5.059  -0.468
  684    HD3  PRO  88           1HD      PRO  88  -9.739  -5.038  -0.997
  685    H    THR  89           H        THR  89 -12.243 -10.258  -0.915
  686    HA   THR  89           HA       THR  89 -14.903  -9.400  -1.860
  687    HB   THR  89           HB       THR  89 -15.133 -11.845  -2.619
  688    HG1  THR  89           1HG      THR  89 -12.301 -11.727  -2.574
  689   HG21  THR  89          3HG2      THR  89 -15.027 -10.425  -4.417
  690   HG22  THR  89          1HG2      THR  89 -13.597 -11.428  -4.675
  691   HG23  THR  89          2HG2      THR  89 -13.431  -9.814  -3.981
  692    H    GLY  90           H        GLY  90 -16.195  -9.307  -0.139
  693    HA2  GLY  90           2HA      GLY  90 -15.797 -11.072   2.135
  694    HA3  GLY  90           1HA      GLY  90 -16.958  -9.760   2.019
  695    H    SER  91           H        SER  91 -16.746 -12.983   2.360
  696    HA   SER  91           HA       SER  91 -18.940 -13.733   0.608
  697    HG   SER  91           HG       SER  91 -16.419 -16.195   0.785
  698    HB2  SER  91           2HB      SER  91 -17.276 -15.291   2.593
  699    HB3  SER  91           1HB      SER  91 -18.636 -15.994   1.716
  700    H    HIS  92           H        HIS  92 -18.311 -13.675   4.121
  701    HA   HIS  92           HA       HIS  92 -21.185 -13.919   4.627
  702    HD1  HIS  92           1HD      HIS  92 -20.212 -16.431   8.066
  703    HD2  HIS  92           2HD      HIS  92 -20.116 -16.291   3.913
  704    HE1  HIS  92           1HE      HIS  92 -20.635 -18.789   7.302
  705    HE2  HIS  92           2HE      HIS  92 -20.679 -18.657   4.787
  706    HB2  HIS  92           2HB      HIS  92 -18.735 -14.254   6.339
  707    HB3  HIS  92           1HB      HIS  92 -20.318 -14.033   7.074
  708    HA   ARG 301           HA       ARG 301   2.662 -10.702  11.284
  709    HE   ARG 301           HE       ARG 301  -1.960  -9.937  13.569
  710    H1   ARG 301           1HT      ARG 301   2.647 -12.377  12.818
  711    H2   ARG 301           2HT      ARG 301   3.358 -11.405  14.046
  712    H3   ARG 301           3HT      ARG 301   4.301 -11.935  12.709
  713    HB2  ARG 301           2HB      ARG 301   2.147  -9.393  13.966
  714    HB3  ARG 301           1HB      ARG 301   1.514  -8.857  12.417
  715    HG2  ARG 301           2HG      ARG 301   0.888 -11.641  13.123
  716    HG3  ARG 301           1HG      ARG 301   0.171 -10.414  14.166
  717    HD2  ARG 301           2HD      ARG 301  -0.298  -9.359  11.708
  718    HD3  ARG 301           1HD      ARG 301  -0.396 -11.084  11.367
  719   HH11  ARG 301          1HH1      ARG 301  -1.867 -11.534  10.447
  720   HH12  ARG 301          2HH1      ARG 301  -3.542 -11.959  10.485
  721   HH21  ARG 301          1HH2      ARG 301  -4.162 -10.500  13.604
  722   HH22  ARG 301          2HH2      ARG 301  -4.845 -11.373  12.274
  723    H    ARG 302           H        ARG 302   3.486  -8.796  10.391
  724    HA   ARG 302           HA       ARG 302   5.664  -7.446  11.794
  725    HE   ARG 302           HE       ARG 302  10.598  -7.064   9.332
  726    HB2  ARG 302           2HB      ARG 302   6.453  -9.398  10.233
  727    HB3  ARG 302           1HB      ARG 302   6.124  -8.243   8.947
  728    HG2  ARG 302           2HG      ARG 302   7.619  -6.633  10.276
  729    HG3  ARG 302           1HG      ARG 302   8.144  -8.064  11.161
  730    HD2  ARG 302           2HD      ARG 302   8.583  -9.032   8.765
  731    HD3  ARG 302           1HD      ARG 302   8.579  -7.332   8.291
  732   HH11  ARG 302          1HH1      ARG 302   9.231 -10.129  10.327
  733   HH12  ARG 302          2HH1      ARG 302  10.674 -10.652  11.125
  734   HH21  ARG 302          1HH2      ARG 302  12.497  -7.762  10.387
  735   HH22  ARG 302          2HH2      ARG 302  12.528  -9.312  11.161
  736    H    GLU 303           H        GLU 303   5.187  -5.373  11.745
  737    HA   GLU 303           HA       GLU 303   4.040  -4.225   9.288
  738    HB2  GLU 303           2HB      GLU 303   3.248  -3.824  12.154
  739    HB3  GLU 303           1HB      GLU 303   2.992  -2.534  10.986
  740    HG2  GLU 303           2HG      GLU 303   1.005  -3.528  10.713
  741    HG3  GLU 303           1HG      GLU 303   1.910  -4.604   9.649
  742    H    THR 304           H        THR 304   5.692  -3.144   8.399
  743    HA   THR 304           HA       THR 304   7.375  -1.482  10.143
  744    HB   THR 304           HB       THR 304   7.989  -3.297   7.995
  745    HG1  THR 304           1HG      THR 304   9.379  -3.490   9.555
  746   HG21  THR 304          3HG2      THR 304   9.630  -2.024   6.783
  747   HG22  THR 304          1HG2      THR 304   9.167  -0.555   7.641
  748   HG23  THR 304          2HG2      THR 304   8.026  -1.334   6.542
  749    H    GLN 305           H        GLN 305   7.852   0.653   9.579
  750    HA   GLN 305           HA       GLN 305   5.781   1.979   8.070
  751    HB2  GLN 305           2HB      GLN 305   8.070   2.900   9.769
  752    HB3  GLN 305           1HB      GLN 305   7.283   4.035   8.681
  753    HG2  GLN 305           2HG      GLN 305   5.320   4.023   9.857
  754    HG3  GLN 305           1HG      GLN 305   5.599   2.414  10.521
  755   HE21  GLN 305          1HE2      GLN 305   6.835   2.182  12.371
  756   HE22  GLN 305          2HE2      GLN 305   7.284   3.521  13.365
  757    H    VAL 306           H        VAL 306   6.108   3.344   6.271
  758    HA   VAL 306           HA       VAL 306   8.650   3.086   4.842
  759    HB   VAL 306           HB       VAL 306   7.423   2.560   2.723
  760   HG11  VAL 306          1HG1      VAL 306   8.629   0.853   4.058
  761   HG12  VAL 306          2HG1      VAL 306   7.275   0.193   3.141
  762   HG13  VAL 306          3HG1      VAL 306   7.114   0.469   4.876
  763   HG21  VAL 306          3HG2      VAL 306   5.199   3.183   3.147
  764   HG22  VAL 306          1HG2      VAL 306   5.137   2.266   4.653
  765   HG23  VAL 306          2HG2      VAL 306   5.164   1.420   3.106
  Start of MODEL   16
    1    HA   MET   1           HA       MET   1  -8.585   0.970  -6.484
    2    H1   MET   1           1HT      MET   1  -9.515   3.571  -7.491
    3    H2   MET   1           2HT      MET   1  -9.028   3.295  -5.869
    4    H3   MET   1           3HT      MET   1 -10.362   2.437  -6.523
    5    HB2  MET   1           2HB      MET   1  -9.185   2.172  -9.182
    6    HB3  MET   1           1HB      MET   1  -8.168   0.747  -9.020
    7    HG2  MET   1           2HG      MET   1 -10.061  -0.350  -7.799
    8    HG3  MET   1           1HG      MET   1 -11.057   1.037  -8.239
    9    HE1  MET   1           3HE      MET   1 -12.704  -1.123 -10.814
   10    HE2  MET   1           1HE      MET   1 -12.776   0.544 -10.240
   11    HE3  MET   1           2HE      MET   1 -12.660  -0.783  -9.083
   12    H    GLU   2           H        GLU   2  -7.586   3.814  -8.419
   13    HA   GLU   2           HA       GLU   2  -4.829   3.344  -7.492
   14    HB2  GLU   2           2HB      GLU   2  -4.012   4.235  -9.607
   15    HB3  GLU   2           1HB      GLU   2  -5.068   2.860  -9.890
   16    HG2  GLU   2           2HG      GLU   2  -6.298   5.554  -9.952
   17    HG3  GLU   2           1HG      GLU   2  -5.236   5.110 -11.285
   18    H    ILE   3           H        ILE   3  -3.468   5.266  -7.315
   19    HA   ILE   3           HA       ILE   3  -4.849   7.826  -7.117
   20    HB   ILE   3           HB       ILE   3  -3.357   6.523  -4.829
   21   HG12  ILE   3          2HG1      ILE   3  -5.663   7.511  -3.788
   22   HG13  ILE   3          1HG1      ILE   3  -6.195   7.112  -5.417
   23   HG21  ILE   3          1HG2      ILE   3  -2.587   8.770  -4.926
   24   HG22  ILE   3          2HG2      ILE   3  -3.778   8.678  -3.628
   25   HG23  ILE   3          3HG2      ILE   3  -4.221   9.383  -5.183
   26   HD11  ILE   3          3HD1      ILE   3  -6.655   5.202  -4.184
   27   HD12  ILE   3          1HD1      ILE   3  -5.139   5.300  -3.287
   28   HD13  ILE   3          2HD1      ILE   3  -5.129   4.821  -4.984
   29    H    LYS   4           H        LYS   4  -3.464   9.576  -7.541
   30    HA   LYS   4           HA       LYS   4  -0.771   8.799  -8.409
   31    HB2  LYS   4           2HB      LYS   4  -2.471  11.204  -9.078
   32    HB3  LYS   4           1HB      LYS   4  -0.810  11.004  -9.615
   33    HG2  LYS   4           2HG      LYS   4  -2.220   8.644 -10.295
   34    HG3  LYS   4           1HG      LYS   4  -3.195  10.024 -10.801
   35    HD2  LYS   4           2HD      LYS   4  -1.464  10.875 -12.162
   36    HD3  LYS   4           1HD      LYS   4  -0.260   9.814 -11.427
   37    HE2  LYS   4           2HE      LYS   4  -0.650   8.718 -13.408
   38    HE3  LYS   4           1HE      LYS   4  -1.812   7.918 -12.351
   39    HZ1  LYS   4           3HZ      LYS   4  -2.837   8.507 -14.437
   40    HZ2  LYS   4           1HZ      LYS   4  -2.404  10.131 -14.243
   41    HZ3  LYS   4           2HZ      LYS   4  -3.528   9.422 -13.195
   42    H    LEU   5           H        LEU   5   0.283   8.806  -6.467
   43    HA   LEU   5           HA       LEU   5   0.277  11.186  -4.803
   44    HG   LEU   5           HG       LEU   5  -0.773   8.611  -3.886
   45    HB2  LEU   5           2HB      LEU   5   1.624   8.508  -4.553
   46    HB3  LEU   5           1HB      LEU   5   1.956   9.825  -3.445
   47   HD11  LEU   5          1HD1      LEU   5   1.351   8.092  -1.834
   48   HD12  LEU   5          2HD1      LEU   5   0.459   6.935  -2.821
   49   HD13  LEU   5          3HD1      LEU   5  -0.353   7.784  -1.506
   50   HD21  LEU   5          3HD2      LEU   5   0.272  10.714  -2.006
   51   HD22  LEU   5          1HD2      LEU   5  -1.232   9.838  -1.716
   52   HD23  LEU   5          2HD2      LEU   5  -1.058  10.840  -3.158
   53    H    ILE   6           H        ILE   6   1.652  12.812  -4.968
   54    HA   ILE   6           HA       ILE   6   3.970  12.556  -6.732
   55    HB   ILE   6           HB       ILE   6   2.430  14.435  -7.125
   56   HG12  ILE   6          2HG1      ILE   6   5.152  15.321  -6.142
   57   HG13  ILE   6          1HG1      ILE   6   4.823  14.617  -7.722
   58   HG21  ILE   6          1HG2      ILE   6   1.812  15.977  -5.588
   59   HG22  ILE   6          2HG2      ILE   6   3.354  15.910  -4.735
   60   HG23  ILE   6          3HG2      ILE   6   2.147  14.651  -4.475
   61   HD11  ILE   6          3HD1      ILE   6   4.788  16.797  -8.303
   62   HD12  ILE   6          1HD1      ILE   6   4.281  17.333  -6.700
   63   HD13  ILE   6          2HD1      ILE   6   3.100  16.642  -7.813
   64    H    LYS   7           H        LYS   7   6.032  12.562  -6.010
   65    HA   LYS   7           HA       LYS   7   6.666  12.177  -3.317
   66    HB2  LYS   7           2HB      LYS   7   8.096  11.438  -5.179
   67    HB3  LYS   7           1HB      LYS   7   8.487  13.113  -5.538
   68    HG2  LYS   7           2HG      LYS   7  10.319  12.537  -4.318
   69    HG3  LYS   7           1HG      LYS   7   9.272  13.119  -3.023
   70    HD2  LYS   7           2HD      LYS   7   8.535  10.506  -3.173
   71    HD3  LYS   7           1HD      LYS   7  10.244  10.407  -3.599
   72    HE2  LYS   7           2HE      LYS   7  10.844  11.579  -1.559
   73    HE3  LYS   7           1HE      LYS   7   9.141  11.773  -1.147
   74    HZ1  LYS   7           3HZ      LYS   7   8.964   9.335  -1.059
   75    HZ2  LYS   7           1HZ      LYS   7  10.062   9.945   0.076
   76    HZ3  LYS   7           2HZ      LYS   7  10.628   9.211  -1.339
   77    H    GLY   8           H        GLY   8   6.519  13.580  -1.705
   78    HA2  GLY   8           2HA      GLY   8   6.977  16.442  -2.242
   79    HA3  GLY   8           1HA      GLY   8   6.054  15.795  -0.895
   80    HA   PRO   9           HA       PRO   9  10.142  16.897   0.892
   81    HB2  PRO   9           2HB      PRO   9   8.624  17.497   3.304
   82    HB3  PRO   9           1HB      PRO   9   9.607  18.574   2.312
   83    HG2  PRO   9           2HG      PRO   9   6.905  18.756   2.445
   84    HG3  PRO   9           1HG      PRO   9   7.832  19.203   1.000
   85    HD2  PRO   9           2HD      PRO   9   6.306  16.686   1.573
   86    HD3  PRO   9           1HD      PRO   9   6.382  17.641   0.075
   87    H    LYS  10           H        LYS  10   8.062  14.375   1.328
   88    HA   LYS  10           HA       LYS  10   9.911  12.996   3.078
   89    HB2  LYS  10           2HB      LYS  10   7.197  13.825   3.921
   90    HB3  LYS  10           1HB      LYS  10   7.625  12.156   4.269
   91    HG2  LYS  10           2HG      LYS  10   9.796  13.850   5.021
   92    HG3  LYS  10           1HG      LYS  10   8.301  14.467   5.723
   93    HD2  LYS  10           2HD      LYS  10   8.986  11.553   5.886
   94    HD3  LYS  10           1HD      LYS  10   9.665  12.707   7.037
   95    HE2  LYS  10           2HE      LYS  10   6.953  13.321   6.942
   96    HE3  LYS  10           1HE      LYS  10   7.008  11.559   6.911
   97    HZ1  LYS  10           3HZ      LYS  10   8.407  11.620   8.894
   98    HZ2  LYS  10           1HZ      LYS  10   6.917  12.372   9.169
   99    HZ3  LYS  10           2HZ      LYS  10   8.305  13.307   8.932
  100    H    GLY  11           H        GLY  11   6.549  12.449   2.016
  101    HA2  GLY  11           2HA      GLY  11   6.464  11.051  -0.138
  102    HA3  GLY  11           1HA      GLY  11   7.448   9.925   0.783
  103    H    LEU  12           H        LEU  12   5.996   8.256   0.738
  104    HA   LEU  12           HA       LEU  12   3.311   8.187   1.029
  105    HG   LEU  12           HG       LEU  12   5.151   6.264  -0.364
  106    HB2  LEU  12           2HB      LEU  12   5.406   6.299   2.055
  107    HB3  LEU  12           1HB      LEU  12   3.700   5.960   2.268
  108   HD11  LEU  12          1HD1      LEU  12   3.950   3.828  -0.356
  109   HD12  LEU  12          2HD1      LEU  12   4.429   3.997   1.333
  110   HD13  LEU  12          3HD1      LEU  12   5.637   4.128   0.056
  111   HD21  LEU  12          3HD2      LEU  12   3.211   6.633  -1.371
  112   HD22  LEU  12          1HD2      LEU  12   2.432   6.754   0.206
  113   HD23  LEU  12          2HD2      LEU  12   2.515   5.198  -0.618
  114    H    GLY  13           H        GLY  13   5.518   7.898   3.838
  115    HA2  GLY  13           2HA      GLY  13   5.259   8.580   6.014
  116    HA3  GLY  13           1HA      GLY  13   3.968   9.631   5.460
  117    H    PHE  14           H        PHE  14   4.372   6.083   5.599
  118    HA   PHE  14           HA       PHE  14   2.424   5.793   7.657
  119    HD1  PHE  14           2HD      PHE  14   2.327   2.891   4.960
  120    HD2  PHE  14           1HD      PHE  14   0.800   6.630   3.603
  121    HE1  PHE  14           2HE      PHE  14   2.585   2.149   2.634
  122    HE2  PHE  14           1HE      PHE  14   1.053   5.885   1.274
  123    HZ   PHE  14           HZ       PHE  14   1.947   3.645   0.786
  124    HB2  PHE  14           2HB      PHE  14   0.743   4.535   6.360
  125    HB3  PHE  14           1HB      PHE  14   0.855   6.211   5.851
  126    H    SER  15           H        SER  15   1.709   3.167   7.446
  127    HA   SER  15           HA       SER  15   4.250   1.752   7.083
  128    HG   SER  15           HG       SER  15   2.408   2.884   9.789
  129    HB2  SER  15           2HB      SER  15   3.179   0.279   9.039
  130    HB3  SER  15           1HB      SER  15   4.202   1.669   9.381
  131    H    ILE  16           H        ILE  16   3.851  -0.689   6.985
  132    HA   ILE  16           HA       ILE  16   1.250  -1.511   6.006
  133    HB   ILE  16           HB       ILE  16   1.738  -1.985   3.817
  134   HG12  ILE  16          2HG1      ILE  16   3.817  -3.250   4.248
  135   HG13  ILE  16          1HG1      ILE  16   3.894  -2.270   2.791
  136   HG21  ILE  16          1HG2      ILE  16   2.826  -0.040   2.751
  137   HG22  ILE  16          2HG2      ILE  16   3.348   0.490   4.350
  138   HG23  ILE  16          3HG2      ILE  16   1.629   0.395   3.970
  139   HD11  ILE  16          3HD1      ILE  16   5.679  -1.219   3.529
  140   HD12  ILE  16          1HD1      ILE  16   5.709  -2.336   4.896
  141   HD13  ILE  16          2HD1      ILE  16   4.866  -0.791   5.035
  142    H    ALA  17           H        ALA  17   1.383  -3.822   5.234
  143    HA   ALA  17           HA       ALA  17   3.503  -5.409   6.485
  144    HB1  ALA  17           3HB      ALA  17   0.671  -5.335   7.257
  145    HB2  ALA  17           1HB      ALA  17   2.070  -5.930   8.150
  146    HB3  ALA  17           2HB      ALA  17   1.297  -6.956   6.942
  147    H    GLY  18           H        GLY  18   3.272  -7.809   5.523
  148    HA2  GLY  18           2HA      GLY  18   1.702  -8.349   3.341
  149    HA3  GLY  18           1HA      GLY  18   3.012  -7.407   2.677
  150    H    GLY  19           H        GLY  19   1.943 -10.481   2.905
  151    HA2  GLY  19           2HA      GLY  19   3.363 -12.136   1.869
  152    HA3  GLY  19           1HA      GLY  19   4.706 -11.494   2.797
  153    H    VAL  20           H        VAL  20   3.885 -14.216   2.645
  154    HA   VAL  20           HA       VAL  20   2.378 -15.019   4.892
  155    HB   VAL  20           HB       VAL  20   4.560 -16.593   3.498
  156   HG11  VAL  20          1HG1      VAL  20   2.309 -17.401   5.322
  157   HG12  VAL  20          2HG1      VAL  20   4.036 -17.684   5.529
  158   HG13  VAL  20          3HG1      VAL  20   3.147 -18.544   4.273
  159   HG21  VAL  20          3HG2      VAL  20   2.511 -17.625   2.331
  160   HG22  VAL  20          1HG2      VAL  20   3.078 -16.047   1.782
  161   HG23  VAL  20          2HG2      VAL  20   1.668 -16.161   2.834
  162    H    GLY  21           H        GLY  21   3.016 -15.624   6.985
  163    HA2  GLY  21           2HA      GLY  21   4.452 -15.919   8.806
  164    HA3  GLY  21           1HA      GLY  21   5.814 -15.555   7.760
  165    H    ASN  22           H        ASN  22   4.146 -13.069   6.961
  166    HA   ASN  22           HA       ASN  22   4.434 -11.409   9.342
  167    HB2  ASN  22           2HB      ASN  22   5.472  -9.672   7.601
  168    HB3  ASN  22           1HB      ASN  22   6.501 -10.768   8.501
  169   HD21  ASN  22          1HD2      ASN  22   4.696 -10.555   5.460
  170   HD22  ASN  22          2HD2      ASN  22   5.856 -11.422   4.519
  171    H    GLN  23           H        GLN  23   2.239 -12.517   7.609
  172    HA   GLN  23           HA       GLN  23   1.158 -10.545   5.952
  173    HB2  GLN  23           2HB      GLN  23   0.575 -13.137   6.515
  174    HB3  GLN  23           1HB      GLN  23  -0.754 -12.318   7.322
  175    HG2  GLN  23           2HG      GLN  23  -1.566 -11.418   5.336
  176    HG3  GLN  23           1HG      GLN  23  -0.044 -11.681   4.485
  177   HE21  GLN  23          1HE2      GLN  23   0.591 -13.981   4.190
  178   HE22  GLN  23          2HE2      GLN  23  -0.661 -15.122   3.852
  179    H    HIS  24           H        HIS  24  -0.570  -9.161   6.186
  180    HA   HIS  24           HA       HIS  24  -0.796  -7.921   8.809
  181    HD1  HIS  24           1HD      HIS  24  -0.277  -5.151   8.937
  182    HD2  HIS  24           2HD      HIS  24  -4.013  -5.456   7.160
  183    HE1  HIS  24           1HE      HIS  24  -1.619  -3.273   9.887
  184    HE2  HIS  24           2HE      HIS  24  -3.861  -3.415   8.752
  185    HB2  HIS  24           2HB      HIS  24  -0.439  -6.601   6.681
  186    HB3  HIS  24           1HB      HIS  24  -2.069  -7.046   6.213
  187    H    ILE  25           H        ILE  25  -2.718  -9.812   6.598
  188    HA   ILE  25           HA       ILE  25  -4.821 -10.014   8.606
  189    HB   ILE  25           HB       ILE  25  -5.592  -9.439   5.750
  190   HG12  ILE  25          2HG1      ILE  25  -5.287  -7.496   8.047
  191   HG13  ILE  25          1HG1      ILE  25  -4.468  -7.444   6.490
  192   HG21  ILE  25          1HG2      ILE  25  -7.782  -9.159   6.593
  193   HG22  ILE  25          2HG2      ILE  25  -7.214  -9.129   8.262
  194   HG23  ILE  25          3HG2      ILE  25  -7.157 -10.630   7.338
  195   HD11  ILE  25          3HD1      ILE  25  -6.802  -7.184   5.482
  196   HD12  ILE  25          1HD1      ILE  25  -6.114  -5.807   6.343
  197   HD13  ILE  25          2HD1      ILE  25  -7.324  -6.821   7.128
  198    HA   PRO  26           HA       PRO  26  -4.371 -14.298   7.466
  199    HB2  PRO  26           2HB      PRO  26  -6.835 -15.109   8.459
  200    HB3  PRO  26           1HB      PRO  26  -5.347 -14.985   9.400
  201    HG2  PRO  26           2HG      PRO  26  -7.620 -13.062   9.183
  202    HG3  PRO  26           1HG      PRO  26  -6.651 -13.501  10.601
  203    HD2  PRO  26           2HD      PRO  26  -6.261 -11.194   9.298
  204    HD3  PRO  26           1HD      PRO  26  -4.903 -12.104   9.994
  205    H    GLY  27           H        GLY  27  -4.675 -15.141   5.512
  206    HA2  GLY  27           2HA      GLY  27  -6.181 -16.112   3.890
  207    HA3  GLY  27           1HA      GLY  27  -7.294 -14.788   4.200
  208    H    ASP  28           H        ASP  28  -5.955 -12.545   3.894
  209    HA   ASP  28           HA       ASP  28  -5.141 -12.623   1.089
  210    HB2  ASP  28           2HB      ASP  28  -6.850 -10.953   2.313
  211    HB3  ASP  28           1HB      ASP  28  -5.365 -10.032   2.525
  212    H    ASN  29           H        ASN  29  -3.051 -12.937   0.735
  213    HA   ASN  29           HA       ASN  29  -1.049 -12.073   2.646
  214    HB2  ASN  29           2HB      ASN  29   0.542 -13.258   1.238
  215    HB3  ASN  29           1HB      ASN  29  -0.854 -14.267   1.589
  216   HD21  ASN  29          1HD2      ASN  29   0.919 -12.579  -0.858
  217   HD22  ASN  29          2HD2      ASN  29   0.056 -13.212  -2.214
  218    H    SER  30           H        SER  30  -2.628 -10.143   0.761
  219    HA   SER  30           HA       SER  30  -0.450  -8.922  -0.730
  220    HG   SER  30           HG       SER  30  -3.635  -8.874  -2.373
  221    HB2  SER  30           2HB      SER  30  -3.329  -8.041  -0.356
  222    HB3  SER  30           1HB      SER  30  -2.157  -7.246  -1.405
  223    H    ILE  31           H        ILE  31   0.082  -6.588  -0.383
  224    HA   ILE  31           HA       ILE  31   0.638  -6.174   2.374
  225    HB   ILE  31           HB       ILE  31   1.172  -4.600  -0.118
  226   HG12  ILE  31          2HG1      ILE  31   3.488  -4.990   0.454
  227   HG13  ILE  31          1HG1      ILE  31   3.032  -5.672   2.009
  228   HG21  ILE  31          1HG2      ILE  31   2.430  -2.956   1.290
  229   HG22  ILE  31          2HG2      ILE  31   1.610  -3.629   2.698
  230   HG23  ILE  31          3HG2      ILE  31   0.676  -2.853   1.420
  231   HD11  ILE  31          3HD1      ILE  31   1.942  -7.536   0.840
  232   HD12  ILE  31          1HD1      ILE  31   3.661  -7.416   0.470
  233   HD13  ILE  31          2HD1      ILE  31   2.467  -6.854  -0.696
  234    H    TYR  32           H        TYR  32  -0.378  -5.026   3.900
  235    HA   TYR  32           HA       TYR  32  -2.579  -3.232   3.117
  236    HD1  TYR  32           2HD      TYR  32  -2.404  -6.784   3.430
  237    HD2  TYR  32           1HD      TYR  32  -5.607  -4.203   4.465
  238    HE1  TYR  32           2HE      TYR  32  -3.947  -8.233   2.182
  239    HE2  TYR  32           1HE      TYR  32  -7.177  -5.629   3.238
  240    HH   TYR  32           HH       TYR  32  -7.046  -8.355   2.567
  241    HB2  TYR  32           2HB      TYR  32  -2.353  -5.149   5.432
  242    HB3  TYR  32           1HB      TYR  32  -3.531  -3.842   5.406
  243    H    VAL  33           H        VAL  33  -2.827  -1.327   4.328
  244    HA   VAL  33           HA       VAL  33  -0.422  -0.270   5.480
  245    HB   VAL  33           HB       VAL  33  -3.168   0.933   5.103
  246   HG11  VAL  33          1HG1      VAL  33  -0.720   2.068   6.413
  247   HG12  VAL  33          2HG1      VAL  33  -2.391   2.095   6.971
  248   HG13  VAL  33          3HG1      VAL  33  -1.899   3.111   5.618
  249   HG21  VAL  33          3HG2      VAL  33  -0.679   0.834   3.542
  250   HG22  VAL  33          1HG2      VAL  33  -1.427   2.426   3.654
  251   HG23  VAL  33          2HG2      VAL  33  -2.345   1.065   3.011
  252    H    THR  34           H        THR  34   0.133  -0.301   7.546
  253    HA   THR  34           HA       THR  34  -1.780  -1.287   9.514
  254    HB   THR  34           HB       THR  34   0.007  -2.027  10.779
  255    HG1  THR  34           1HG      THR  34   1.660  -0.815  11.151
  256   HG21  THR  34          3HG2      THR  34   1.760  -2.103   8.456
  257   HG22  THR  34          1HG2      THR  34   0.124  -2.676   8.134
  258   HG23  THR  34          2HG2      THR  34   1.081  -3.417   9.415
  259    H    LYS  35           H        LYS  35  -0.031   1.670   8.811
  260    HA   LYS  35           HA       LYS  35  -1.616   3.151  10.680
  261    HB2  LYS  35           2HB      LYS  35   1.287   2.644  11.325
  262    HB3  LYS  35           1HB      LYS  35   0.447   4.066  11.913
  263    HG2  LYS  35           2HG      LYS  35  -1.270   2.290  12.799
  264    HG3  LYS  35           1HG      LYS  35   0.124   1.215  12.672
  265    HD2  LYS  35           2HD      LYS  35   0.736   1.963  14.683
  266    HD3  LYS  35           1HD      LYS  35   1.137   3.489  13.893
  267    HE2  LYS  35           2HE      LYS  35  -0.336   4.401  15.310
  268    HE3  LYS  35           1HE      LYS  35  -1.567   3.715  14.251
  269    HZ1  LYS  35           3HZ      LYS  35  -1.867   3.195  16.644
  270    HZ2  LYS  35           1HZ      LYS  35  -0.433   2.296  16.600
  271    HZ3  LYS  35           2HZ      LYS  35  -1.759   1.821  15.662
  272    H    ILE  36           H        ILE  36  -1.881   5.161   9.865
  273    HA   ILE  36           HA       ILE  36  -0.003   6.033   7.791
  274    HB   ILE  36           HB       ILE  36  -2.807   6.953   8.415
  275   HG12  ILE  36          2HG1      ILE  36  -1.568   5.455   6.095
  276   HG13  ILE  36          1HG1      ILE  36  -2.733   4.830   7.257
  277   HG21  ILE  36          1HG2      ILE  36  -2.575   8.370   6.382
  278   HG22  ILE  36          2HG2      ILE  36  -0.850   8.002   6.373
  279   HG23  ILE  36          3HG2      ILE  36  -1.556   8.887   7.725
  280   HD11  ILE  36          3HD1      ILE  36  -3.240   6.970   5.206
  281   HD12  ILE  36          1HD1      ILE  36  -4.411   6.387   6.388
  282   HD13  ILE  36          2HD1      ILE  36  -3.800   5.299   5.142
  283    H    ILE  37           H        ILE  37   1.447   7.578   8.206
  284    HA   ILE  37           HA       ILE  37   1.480   8.948  10.726
  285    HB   ILE  37           HB       ILE  37   3.279   8.946   8.319
  286   HG12  ILE  37          2HG1      ILE  37   4.596   8.557  10.820
  287   HG13  ILE  37          1HG1      ILE  37   3.155   7.547  10.789
  288   HG21  ILE  37          1HG2      ILE  37   4.800  10.467   9.642
  289   HG22  ILE  37          2HG2      ILE  37   3.387  10.870  10.618
  290   HG23  ILE  37          3HG2      ILE  37   3.395  11.220   8.889
  291   HD11  ILE  37          3HD1      ILE  37   4.837   7.504   8.368
  292   HD12  ILE  37          1HD1      ILE  37   3.976   6.198   9.182
  293   HD13  ILE  37          2HD1      ILE  37   5.515   6.772   9.822
  294    H    GLU  38           H        GLU  38   1.251  11.166  11.105
  295    HA   GLU  38           HA       GLU  38  -0.753  12.495   9.677
  296    HB2  GLU  38           2HB      GLU  38   1.173  13.294  11.811
  297    HB3  GLU  38           1HB      GLU  38   0.292  14.561  10.969
  298    HG2  GLU  38           2HG      GLU  38  -0.770  13.798  13.080
  299    HG3  GLU  38           1HG      GLU  38  -1.805  13.674  11.659
  300    H    GLY  39           H        GLY  39  -0.761  14.218   8.262
  301    HA2  GLY  39           2HA      GLY  39  -0.071  15.471   6.479
  302    HA3  GLY  39           1HA      GLY  39   1.442  15.661   7.345
  303    H    GLY  40           H        GLY  40   0.453  12.438   6.492
  304    HA2  GLY  40           2HA      GLY  40   2.730  12.255   4.674
  305    HA3  GLY  40           1HA      GLY  40   1.818  10.910   5.342
  306    H    ALA  41           H        ALA  41   2.446  10.761   2.753
  307    HA   ALA  41           HA       ALA  41   0.929  11.894   0.787
  308    HB1  ALA  41           3HB      ALA  41   1.609   8.960   0.895
  309    HB2  ALA  41           1HB      ALA  41   2.750  10.233   0.458
  310    HB3  ALA  41           2HB      ALA  41   1.330   9.940  -0.545
  311    H    ALA  42           H        ALA  42   0.023   8.867   2.489
  312    HA   ALA  42           HA       ALA  42  -2.551   8.709   1.331
  313    HB1  ALA  42           3HB      ALA  42  -1.575   6.723   2.205
  314    HB2  ALA  42           1HB      ALA  42  -3.002   7.075   3.180
  315    HB3  ALA  42           2HB      ALA  42  -1.393   7.441   3.806
  316    H    HIS  43           H        HIS  43  -1.484   9.806   4.548
  317    HA   HIS  43           HA       HIS  43  -3.900  10.455   5.691
  318    HD1  HIS  43           1HD      HIS  43  -2.635  14.137   6.863
  319    HD2  HIS  43           2HD      HIS  43  -3.391  10.634   8.966
  320    HE1  HIS  43           1HE      HIS  43  -3.764  14.861   8.987
  321    HE2  HIS  43           2HE      HIS  43  -4.283  12.720  10.210
  322    HB2  HIS  43           2HB      HIS  43  -1.642  10.544   6.781
  323    HB3  HIS  43           1HB      HIS  43  -1.367  12.080   5.970
  324    H    LYS  44           H        LYS  44  -1.864  12.572   3.672
  325    HA   LYS  44           HA       LYS  44  -3.653  14.781   3.741
  326    HB2  LYS  44           2HB      LYS  44  -1.399  14.116   1.839
  327    HB3  LYS  44           1HB      LYS  44  -2.258  15.650   1.859
  328    HG2  LYS  44           2HG      LYS  44  -1.477  15.340   4.481
  329    HG3  LYS  44           1HG      LYS  44  -0.116  14.683   3.570
  330    HD2  LYS  44           2HD      LYS  44   0.402  16.693   2.629
  331    HD3  LYS  44           1HD      LYS  44  -1.272  17.251   2.635
  332    HE2  LYS  44           2HE      LYS  44   0.307  16.920   5.170
  333    HE3  LYS  44           1HE      LYS  44   0.367  18.404   4.222
  334    HZ1  LYS  44           3HZ      LYS  44  -2.044  17.195   5.466
  335    HZ2  LYS  44           1HZ      LYS  44  -2.071  18.544   4.443
  336    HZ3  LYS  44           2HZ      LYS  44  -1.272  18.627   5.931
  337    H    ASP  45           H        ASP  45  -3.167  12.109   1.471
  338    HA   ASP  45           HA       ASP  45  -4.837  13.062  -0.586
  339    HB2  ASP  45           2HB      ASP  45  -3.155  11.037  -0.509
  340    HB3  ASP  45           1HB      ASP  45  -4.589  10.126  -0.047
  341    H    GLY  46           H        GLY  46  -5.530  10.638   1.952
  342    HA2  GLY  46           2HA      GLY  46  -7.535  10.584   3.221
  343    HA3  GLY  46           1HA      GLY  46  -8.318  11.549   1.981
  344    H    LYS  47           H        LYS  47  -7.187   9.723  -0.146
  345    HA   LYS  47           HA       LYS  47  -9.410   7.973  -0.318
  346    HB2  LYS  47           2HB      LYS  47  -6.897   8.321  -1.920
  347    HB3  LYS  47           1HB      LYS  47  -7.974   6.971  -2.242
  348    HG2  LYS  47           2HG      LYS  47  -9.708   8.358  -2.940
  349    HG3  LYS  47           1HG      LYS  47  -9.007   9.780  -2.166
  350    HD2  LYS  47           2HD      LYS  47  -8.091  10.319  -4.118
  351    HD3  LYS  47           1HD      LYS  47  -7.079   8.879  -3.991
  352    HE2  LYS  47           2HE      LYS  47  -8.552   7.593  -5.285
  353    HE3  LYS  47           1HE      LYS  47  -9.872   8.745  -5.082
  354    HZ1  LYS  47           3HZ      LYS  47  -7.394   9.197  -6.658
  355    HZ2  LYS  47           1HZ      LYS  47  -8.634  10.329  -6.443
  356    HZ3  LYS  47           2HZ      LYS  47  -8.934   8.896  -7.290
  357    H    LEU  48           H        LEU  48  -6.042   7.506   0.669
  358    HA   LEU  48           HA       LEU  48  -6.459   4.647   1.005
  359    HG   LEU  48           HG       LEU  48  -4.580   3.350   0.787
  360    HB2  LEU  48           2HB      LEU  48  -4.302   5.872   0.163
  361    HB3  LEU  48           1HB      LEU  48  -3.981   6.079   1.874
  362   HD11  LEU  48          1HD1      LEU  48  -2.201   2.989   0.413
  363   HD12  LEU  48          2HD1      LEU  48  -1.875   4.682   0.784
  364   HD13  LEU  48          3HD1      LEU  48  -2.819   4.258  -0.644
  365   HD21  LEU  48          3HD2      LEU  48  -3.860   2.604   2.771
  366   HD22  LEU  48          1HD2      LEU  48  -4.201   4.247   3.312
  367   HD23  LEU  48          2HD2      LEU  48  -2.558   3.790   2.868
  368    H    GLN  49           H        GLN  49  -7.151   3.772   2.822
  369    HA   GLN  49           HA       GLN  49  -6.657   5.140   5.372
  370    HB2  GLN  49           2HB      GLN  49  -8.854   4.687   6.137
  371    HB3  GLN  49           1HB      GLN  49  -9.035   5.395   4.543
  372    HG2  GLN  49           2HG      GLN  49  -9.047   2.426   4.982
  373    HG3  GLN  49           1HG      GLN  49 -10.504   3.406   5.120
  374   HE21  GLN  49          1HE2      GLN  49  -8.535   1.667   3.046
  375   HE22  GLN  49          2HE2      GLN  49  -9.193   2.212   1.544
  376    H    ILE  50           H        ILE  50  -6.136   3.813   7.107
  377    HA   ILE  50           HA       ILE  50  -4.772   1.474   6.695
  378    HB   ILE  50           HB       ILE  50  -5.282   0.916   9.133
  379   HG12  ILE  50          2HG1      ILE  50  -6.264   3.664   9.563
  380   HG13  ILE  50          1HG1      ILE  50  -7.425   2.580   8.804
  381   HG21  ILE  50          1HG2      ILE  50  -3.252   1.976   8.711
  382   HG22  ILE  50          2HG2      ILE  50  -4.017   3.002   9.923
  383   HG23  ILE  50          3HG2      ILE  50  -4.031   3.483   8.226
  384   HD11  ILE  50          3HD1      ILE  50  -7.197   1.022  10.654
  385   HD12  ILE  50          1HD1      ILE  50  -7.669   2.622  11.226
  386   HD13  ILE  50          2HD1      ILE  50  -6.001   2.077  11.407
  387    H    GLY  51           H        GLY  51  -5.294  -0.548   6.124
  388    HA2  GLY  51           2HA      GLY  51  -6.710  -2.502   6.715
  389    HA3  GLY  51           1HA      GLY  51  -8.086  -1.432   6.527
  390    H    ASP  52           H        ASP  52  -6.575  -0.198   4.106
  391    HA   ASP  52           HA       ASP  52  -7.817  -1.853   2.167
  392    HB2  ASP  52           2HB      ASP  52  -6.620  -0.272   0.537
  393    HB3  ASP  52           1HB      ASP  52  -7.814   0.426   1.620
  394    H    LYS  53           H        LYS  53  -6.691  -2.792   0.284
  395    HA   LYS  53           HA       LYS  53  -4.126  -3.967   1.123
  396    HB2  LYS  53           2HB      LYS  53  -4.674  -5.763  -0.556
  397    HB3  LYS  53           1HB      LYS  53  -5.737  -5.689   0.838
  398    HG2  LYS  53           2HG      LYS  53  -6.596  -4.157  -1.528
  399    HG3  LYS  53           1HG      LYS  53  -6.611  -5.915  -1.679
  400    HD2  LYS  53           2HD      LYS  53  -7.780  -4.743   0.786
  401    HD3  LYS  53           1HD      LYS  53  -8.684  -4.542  -0.715
  402    HE2  LYS  53           2HE      LYS  53  -9.206  -6.734  -0.848
  403    HE3  LYS  53           1HE      LYS  53  -7.643  -7.250  -0.218
  404    HZ1  LYS  53           3HZ      LYS  53  -9.381  -7.811   1.327
  405    HZ2  LYS  53           1HZ      LYS  53  -9.919  -6.208   1.380
  406    HZ3  LYS  53           2HZ      LYS  53  -8.404  -6.613   2.009
  407    H    LEU  54           H        LEU  54  -2.458  -4.129  -0.289
  408    HA   LEU  54           HA       LEU  54  -2.466  -2.135  -2.425
  409    HG   LEU  54           HG       LEU  54  -1.255  -0.738  -0.952
  410    HB2  LEU  54           2HB      LEU  54  -0.450  -3.195  -0.604
  411    HB3  LEU  54           1HB      LEU  54   0.123  -3.059  -2.256
  412   HD11  LEU  54          1HD1      LEU  54   1.116   0.055  -0.417
  413   HD12  LEU  54          2HD1      LEU  54   1.572  -1.645  -0.530
  414   HD13  LEU  54          3HD1      LEU  54   0.382  -1.129   0.665
  415   HD21  LEU  54          3HD2      LEU  54   0.442  -1.236  -3.327
  416   HD22  LEU  54          1HD2      LEU  54   0.643   0.307  -2.497
  417   HD23  LEU  54          2HD2      LEU  54  -0.939  -0.159  -3.122
  418    H    LEU  55           H        LEU  55  -3.154  -2.880  -4.295
  419    HA   LEU  55           HA       LEU  55  -2.780  -5.561  -5.193
  420    HG   LEU  55           HG       LEU  55  -3.329  -5.856  -7.618
  421    HB2  LEU  55           2HB      LEU  55  -4.708  -4.225  -5.895
  422    HB3  LEU  55           1HB      LEU  55  -3.646  -3.087  -6.697
  423   HD11  LEU  55          1HD1      LEU  55  -5.969  -4.454  -7.803
  424   HD12  LEU  55          2HD1      LEU  55  -5.627  -6.135  -7.394
  425   HD13  LEU  55          3HD1      LEU  55  -5.440  -5.576  -9.056
  426   HD21  LEU  55          3HD2      LEU  55  -2.866  -4.856  -9.610
  427   HD22  LEU  55          1HD2      LEU  55  -2.516  -3.503  -8.535
  428   HD23  LEU  55          2HD2      LEU  55  -4.063  -3.583  -9.379
  429    H    ALA  56           H        ALA  56  -1.456  -2.408  -6.289
  430    HA   ALA  56           HA       ALA  56   1.041  -3.788  -6.955
  431    HB1  ALA  56           3HB      ALA  56   1.016  -2.621  -9.252
  432    HB2  ALA  56           1HB      ALA  56  -0.718  -2.432  -8.995
  433    HB3  ALA  56           2HB      ALA  56  -0.009  -4.045  -9.055
  434    H    VAL  57           H        VAL  57   2.864  -2.421  -7.111
  435    HA   VAL  57           HA       VAL  57   2.412   0.411  -6.405
  436    HB   VAL  57           HB       VAL  57   4.658  -1.291  -5.313
  437   HG11  VAL  57          1HG1      VAL  57   5.318   0.998  -5.448
  438   HG12  VAL  57          2HG1      VAL  57   4.924   0.660  -3.763
  439   HG13  VAL  57          3HG1      VAL  57   3.781   1.541  -4.775
  440   HG21  VAL  57          3HG2      VAL  57   3.412  -0.940  -3.121
  441   HG22  VAL  57          1HG2      VAL  57   2.727  -2.110  -4.249
  442   HG23  VAL  57          2HG2      VAL  57   2.021  -0.500  -4.112
  443    H    ASN  58           H        ASN  58   3.075   1.602  -8.077
  444    HA   ASN  58           HA       ASN  58   4.329   2.452  -9.766
  445    HB2  ASN  58           2HB      ASN  58   6.378   1.120  -8.049
  446    HB3  ASN  58           1HB      ASN  58   6.871   1.681  -9.643
  447   HD21  ASN  58          1HD2      ASN  58   7.314   3.779  -9.923
  448   HD22  ASN  58          2HD2      ASN  58   7.062   5.009  -8.736
  449    H    ASN  59           H        ASN  59   2.816   0.268 -10.405
  450    HA   ASN  59           HA       ASN  59   2.459  -0.943 -12.322
  451    HB2  ASN  59           2HB      ASN  59   4.633   0.384 -13.131
  452    HB3  ASN  59           1HB      ASN  59   5.327  -1.232 -13.039
  453   HD21  ASN  59          1HD2      ASN  59   4.528  -2.860 -14.397
  454   HD22  ASN  59          2HD2      ASN  59   3.606  -2.487 -15.810
  455    H    VAL  60           H        VAL  60   4.755  -1.847  -9.880
  456    HA   VAL  60           HA       VAL  60   4.790  -4.639 -10.698
  457    HB   VAL  60           HB       VAL  60   6.262  -5.069  -8.892
  458   HG11  VAL  60          1HG1      VAL  60   6.861  -2.387 -10.115
  459   HG12  VAL  60          2HG1      VAL  60   7.409  -3.973 -10.658
  460   HG13  VAL  60          3HG1      VAL  60   8.020  -3.297  -9.147
  461   HG21  VAL  60          3HG2      VAL  60   6.607  -2.641  -7.518
  462   HG22  VAL  60          1HG2      VAL  60   5.950  -4.155  -6.900
  463   HG23  VAL  60          2HG2      VAL  60   4.872  -2.942  -7.586
  464    H    CYS  61           H        CYS  61   3.909  -6.367  -9.407
  465    HA   CYS  61           HA       CYS  61   1.477  -5.548  -8.024
  466    HG   CYS  61           HG       CYS  61   2.978  -9.280  -7.871
  467    HB2  CYS  61           2HB      CYS  61   0.832  -7.883  -8.087
  468    HB3  CYS  61           1HB      CYS  61   1.343  -7.358  -9.685
  469    H    LEU  62           H        LEU  62   1.163  -5.644  -5.880
  470    HA   LEU  62           HA       LEU  62   3.443  -6.488  -4.255
  471    HG   LEU  62           HG       LEU  62   3.254  -5.488  -1.760
  472    HB2  LEU  62           2HB      LEU  62   2.174  -4.150  -4.242
  473    HB3  LEU  62           1HB      LEU  62   1.176  -4.985  -3.072
  474   HD11  LEU  62          1HD1      LEU  62   4.665  -3.368  -3.300
  475   HD12  LEU  62          2HD1      LEU  62   4.668  -5.017  -3.926
  476   HD13  LEU  62          3HD1      LEU  62   5.320  -4.683  -2.322
  477   HD21  LEU  62          3HD2      LEU  62   2.954  -2.534  -2.180
  478   HD22  LEU  62          1HD2      LEU  62   3.300  -3.409  -0.689
  479   HD23  LEU  62          2HD2      LEU  62   1.696  -3.497  -1.411
  480    H    GLU  63           H        GLU  63   1.649  -8.515  -5.284
  481    HA   GLU  63           HA       GLU  63   0.049  -9.326  -2.999
  482    HB2  GLU  63           2HB      GLU  63   0.314 -10.241  -5.827
  483    HB3  GLU  63           1HB      GLU  63  -0.262 -11.401  -4.639
  484    HG2  GLU  63           2HG      GLU  63  -2.124 -10.336  -5.718
  485    HG3  GLU  63           1HG      GLU  63  -2.065  -9.872  -4.020
  486    H    GLU  64           H        GLU  64   1.366 -12.049  -4.607
  487    HA   GLU  64           HA       GLU  64   2.461 -13.138  -2.303
  488    HB2  GLU  64           2HB      GLU  64   2.085 -13.932  -5.005
  489    HB3  GLU  64           1HB      GLU  64   3.717 -14.364  -4.523
  490    HG2  GLU  64           2HG      GLU  64   2.924 -16.141  -3.480
  491    HG3  GLU  64           1HG      GLU  64   2.018 -15.087  -2.395
  492    H    VAL  65           H        VAL  65   3.801 -11.522  -1.457
  493    HA   VAL  65           HA       VAL  65   6.588 -11.813  -2.286
  494    HB   VAL  65           HB       VAL  65   7.015  -9.357  -2.055
  495   HG11  VAL  65          1HG1      VAL  65   5.156 -10.060  -4.326
  496   HG12  VAL  65          2HG1      VAL  65   6.860 -10.513  -4.245
  497   HG13  VAL  65          3HG1      VAL  65   6.402  -8.811  -4.316
  498   HG21  VAL  65          3HG2      VAL  65   4.304  -9.312  -1.274
  499   HG22  VAL  65          1HG2      VAL  65   4.414  -8.426  -2.795
  500   HG23  VAL  65          2HG2      VAL  65   5.417  -7.953  -1.423
  501    H    THR  66           H        THR  66   8.086 -11.539  -0.632
  502    HA   THR  66           HA       THR  66   7.125 -11.857   2.023
  503    HB   THR  66           HB       THR  66   9.928 -11.047   1.214
  504    HG1  THR  66           1HG      THR  66   8.743 -13.622   1.237
  505   HG21  THR  66          3HG2      THR  66  10.477 -12.625   3.146
  506   HG22  THR  66          1HG2      THR  66   8.790 -12.425   3.614
  507   HG23  THR  66          2HG2      THR  66   9.856 -11.022   3.538
  508    H    HIS  67           H        HIS  67   7.592 -10.344   3.829
  509    HA   HIS  67           HA       HIS  67   6.505  -7.851   3.350
  510    HD1  HIS  67           1HD      HIS  67   5.050  -6.990   6.206
  511    HD2  HIS  67           2HD      HIS  67   8.906  -5.587   5.591
  512    HE1  HIS  67           1HE      HIS  67   4.978  -4.550   6.760
  513    HE2  HIS  67           2HE      HIS  67   7.280  -3.697   6.250
  514    HB2  HIS  67           2HB      HIS  67   6.619  -8.809   5.607
  515    HB3  HIS  67           1HB      HIS  67   8.343  -8.471   5.675
  516    H    GLU  68           H        GLU  68   9.917  -8.761   3.228
  517    HA   GLU  68           HA       GLU  68  11.108  -6.278   3.185
  518    HB2  GLU  68           2HB      GLU  68  12.862  -7.292   1.740
  519    HB3  GLU  68           1HB      GLU  68  12.458  -8.276   3.138
  520    HG2  GLU  68           2HG      GLU  68  10.855  -9.489   1.493
  521    HG3  GLU  68           1HG      GLU  68  11.869  -8.755   0.252
  522    H    GLU  69           H        GLU  69   9.660  -8.022   0.441
  523    HA   GLU  69           HA       GLU  69  10.169  -6.035  -1.500
  524    HB2  GLU  69           2HB      GLU  69   9.192  -8.562  -1.625
  525    HB3  GLU  69           1HB      GLU  69   7.709  -7.646  -1.853
  526    HG2  GLU  69           2HG      GLU  69  10.206  -7.272  -3.489
  527    HG3  GLU  69           1HG      GLU  69   8.838  -8.278  -3.961
  528    H    ALA  70           H        ALA  70   7.582  -6.458   0.845
  529    HA   ALA  70           HA       ALA  70   5.704  -4.631  -0.167
  530    HB1  ALA  70           3HB      ALA  70   4.848  -4.526   2.121
  531    HB2  ALA  70           1HB      ALA  70   6.315  -5.298   2.715
  532    HB3  ALA  70           2HB      ALA  70   5.221  -6.189   1.660
  533    H    VAL  71           H        VAL  71   8.501  -4.184   1.943
  534    HA   VAL  71           HA       VAL  71   8.041  -1.344   2.219
  535    HB   VAL  71           HB       VAL  71  10.325  -3.106   3.122
  536   HG11  VAL  71          1HG1      VAL  71  10.654  -0.848   4.561
  537   HG12  VAL  71          2HG1      VAL  71  10.105  -0.168   3.030
  538   HG13  VAL  71          3HG1      VAL  71  11.532  -1.202   3.074
  539   HG21  VAL  71          3HG2      VAL  71   7.819  -2.807   4.178
  540   HG22  VAL  71          1HG2      VAL  71   8.758  -1.633   5.100
  541   HG23  VAL  71          2HG2      VAL  71   9.247  -3.327   5.071
  542    H    THR  72           H        THR  72  10.105  -3.461   0.303
  543    HA   THR  72           HA       THR  72  11.858  -1.503  -0.695
  544    HB   THR  72           HB       THR  72  10.983  -4.135  -1.897
  545    HG1  THR  72           1HG      THR  72  12.216  -4.858  -0.376
  546   HG21  THR  72          3HG2      THR  72  11.940  -2.886  -3.687
  547   HG22  THR  72          1HG2      THR  72  13.152  -4.038  -3.122
  548   HG23  THR  72          2HG2      THR  72  13.270  -2.339  -2.666
  549    H    ALA  73           H        ALA  73   8.691  -2.614  -1.809
  550    HA   ALA  73           HA       ALA  73   8.781  -1.101  -4.243
  551    HB1  ALA  73           3HB      ALA  73   6.563  -2.599  -2.862
  552    HB2  ALA  73           1HB      ALA  73   7.499  -3.106  -4.268
  553    HB3  ALA  73           2HB      ALA  73   6.366  -1.760  -4.401
  554    H    LEU  74           H        LEU  74   7.429  -0.657  -0.990
  555    HA   LEU  74           HA       LEU  74   5.933   1.690  -1.668
  556    HG   LEU  74           HG       LEU  74   4.731  -0.275   1.294
  557    HB2  LEU  74           2HB      LEU  74   6.841   0.463   0.928
  558    HB3  LEU  74           1HB      LEU  74   6.006   2.001   0.883
  559   HD11  LEU  74          1HD1      LEU  74   3.526   1.795  -0.519
  560   HD12  LEU  74          2HD1      LEU  74   3.839   2.072   1.195
  561   HD13  LEU  74          3HD1      LEU  74   2.717   0.806   0.696
  562   HD21  LEU  74          3HD2      LEU  74   4.448  -0.016  -1.686
  563   HD22  LEU  74          1HD2      LEU  74   3.800  -1.272  -0.630
  564   HD23  LEU  74          2HD2      LEU  74   5.535  -1.174  -0.920
  565    H    LYS  75           H        LYS  75   9.197   0.971  -0.701
  566    HA   LYS  75           HA       LYS  75   9.836   3.750  -0.130
  567    HB2  LYS  75           2HB      LYS  75  11.923   3.015   0.618
  568    HB3  LYS  75           1HB      LYS  75  10.829   1.718   1.072
  569    HG2  LYS  75           2HG      LYS  75  11.626   0.301  -0.611
  570    HG3  LYS  75           1HG      LYS  75  12.401   1.625  -1.481
  571    HD2  LYS  75           2HD      LYS  75  14.195   0.572  -0.454
  572    HD3  LYS  75           1HD      LYS  75  13.824   1.883   0.668
  573    HE2  LYS  75           2HE      LYS  75  12.844   0.447   2.213
  574    HE3  LYS  75           1HE      LYS  75  12.584  -0.820   1.015
  575    HZ1  LYS  75           3HZ      LYS  75  14.381  -1.376   2.531
  576    HZ2  LYS  75           1HZ      LYS  75  15.223   0.023   2.088
  577    HZ3  LYS  75           2HZ      LYS  75  14.965  -1.205   0.953
  578    H    ASN  76           H        ASN  76   9.922   1.646  -2.875
  579    HA   ASN  76           HA       ASN  76  12.005   3.016  -4.269
  580    HB2  ASN  76           2HB      ASN  76  11.536   0.701  -4.813
  581    HB3  ASN  76           1HB      ASN  76   9.887   1.108  -5.276
  582   HD21  ASN  76          1HD2      ASN  76  12.755   3.009  -6.030
  583   HD22  ASN  76          2HD2      ASN  76  12.671   2.786  -7.736
  584    H    THR  77           H        THR  77  11.052   5.172  -3.777
  585    HA   THR  77           HA       THR  77   9.238   5.998  -5.951
  586    HB   THR  77           HB       THR  77   7.956   6.146  -3.959
  587    HG1  THR  77           1HG      THR  77   9.003   8.753  -4.335
  588   HG21  THR  77          3HG2      THR  77   8.658   7.346  -1.962
  589   HG22  THR  77          1HG2      THR  77  10.249   7.606  -2.679
  590   HG23  THR  77          2HG2      THR  77   9.710   5.970  -2.301
  591    H    SER  78           H        SER  78   9.805   7.769  -7.121
  592    HA   SER  78           HA       SER  78  12.238   9.215  -6.296
  593    HG   SER  78           HG       SER  78  12.596  10.056  -9.629
  594    HB2  SER  78           2HB      SER  78  12.780   7.753  -8.164
  595    HB3  SER  78           1HB      SER  78  11.427   8.389  -9.097
  596    H    ASP  79           H        ASP  79  10.068   9.772  -9.059
  597    HA   ASP  79           HA       ASP  79   9.657  12.507  -8.102
  598    HB2  ASP  79           2HB      ASP  79   9.135  11.224 -10.793
  599    HB3  ASP  79           1HB      ASP  79   8.762  12.902 -10.408
  600    H    PHE  80           H        PHE  80   7.731   9.846  -9.502
  601    HA   PHE  80           HA       PHE  80   5.456  10.746  -7.864
  602    HD1  PHE  80           1HD      PHE  80   5.118  13.044 -10.195
  603    HD2  PHE  80           2HD      PHE  80   2.407   9.933  -9.148
  604    HE1  PHE  80           1HE      PHE  80   3.353  14.715  -9.817
  605    HE2  PHE  80           2HE      PHE  80   0.640  11.602  -8.768
  606    HZ   PHE  80           HZ       PHE  80   1.114  13.992  -9.099
  607    HB2  PHE  80           2HB      PHE  80   5.606  10.722 -10.704
  608    HB3  PHE  80           1HB      PHE  80   4.499   9.438 -10.224
  609    H    VAL  81           H        VAL  81   3.745   8.943  -7.660
  610    HA   VAL  81           HA       VAL  81   4.907   6.270  -7.766
  611    HB   VAL  81           HB       VAL  81   4.122   7.734  -5.280
  612   HG11  VAL  81          1HG1      VAL  81   2.521   6.064  -5.045
  613   HG12  VAL  81          2HG1      VAL  81   3.915   5.409  -4.185
  614   HG13  VAL  81          3HG1      VAL  81   3.537   4.843  -5.812
  615   HG21  VAL  81          3HG2      VAL  81   6.001   6.507  -4.340
  616   HG22  VAL  81          1HG2      VAL  81   6.477   7.343  -5.818
  617   HG23  VAL  81          2HG2      VAL  81   6.182   5.605  -5.844
  618    H    TYR  82           H        TYR  82   3.453   5.003  -8.763
  619    HA   TYR  82           HA       TYR  82   0.639   5.820  -8.760
  620    HD1  TYR  82           1HD      TYR  82  -0.164   2.315 -10.337
  621    HD2  TYR  82           2HD      TYR  82  -0.149   6.349 -11.691
  622    HE1  TYR  82           1HE      TYR  82  -2.371   1.980 -11.347
  623    HE2  TYR  82           2HE      TYR  82  -2.365   6.022 -12.700
  624    HH   TYR  82           HH       TYR  82  -3.642   3.475 -13.553
  625    HB2  TYR  82           2HB      TYR  82   1.890   5.286 -10.906
  626    HB3  TYR  82           1HB      TYR  82   1.886   3.607 -10.385
  627    H    LEU  83           H        LEU  83  -0.220   5.139  -6.905
  628    HA   LEU  83           HA       LEU  83   0.303   2.498  -5.859
  629    HG   LEU  83           HG       LEU  83   0.012   2.277  -3.597
  630    HB2  LEU  83           2HB      LEU  83  -0.069   4.719  -4.559
  631    HB3  LEU  83           1HB      LEU  83  -1.773   4.366  -4.777
  632   HD11  LEU  83          1HD1      LEU  83   0.537   4.281  -2.328
  633   HD12  LEU  83          2HD1      LEU  83  -0.439   3.175  -1.362
  634   HD13  LEU  83          3HD1      LEU  83  -1.182   4.599  -2.089
  635   HD21  LEU  83          3HD2      LEU  83  -2.262   2.081  -2.272
  636   HD22  LEU  83          1HD2      LEU  83  -2.066   1.378  -3.878
  637   HD23  LEU  83          2HD2      LEU  83  -2.886   2.929  -3.689
  638    H    LYS  84           H        LYS  84  -0.861   0.738  -6.165
  639    HA   LYS  84           HA       LYS  84  -3.560   0.985  -7.318
  640    HB2  LYS  84           2HB      LYS  84  -1.327  -0.901  -7.924
  641    HB3  LYS  84           1HB      LYS  84  -2.985  -1.444  -8.128
  642    HG2  LYS  84           2HG      LYS  84  -1.899   1.043  -9.419
  643    HG3  LYS  84           1HG      LYS  84  -1.876  -0.545 -10.188
  644    HD2  LYS  84           2HD      LYS  84  -4.390   0.751  -9.149
  645    HD3  LYS  84           1HD      LYS  84  -3.818   0.943 -10.806
  646    HE2  LYS  84           2HE      LYS  84  -3.744  -1.672 -10.765
  647    HE3  LYS  84           1HE      LYS  84  -4.880  -1.485  -9.430
  648    HZ1  LYS  84           3HZ      LYS  84  -5.231  -0.413 -12.178
  649    HZ2  LYS  84           1HZ      LYS  84  -6.315  -0.193 -10.898
  650    HZ3  LYS  84           2HZ      LYS  84  -6.042  -1.742 -11.519
  651    H    VAL  85           H        VAL  85  -5.161   0.288  -6.040
  652    HA   VAL  85           HA       VAL  85  -4.481  -1.639  -3.924
  653    HB   VAL  85           HB       VAL  85  -6.662   0.462  -3.938
  654   HG11  VAL  85          1HG1      VAL  85  -5.982  -0.804  -1.392
  655   HG12  VAL  85          2HG1      VAL  85  -6.699  -1.909  -2.563
  656   HG13  VAL  85          3HG1      VAL  85  -7.560  -0.443  -2.095
  657   HG21  VAL  85          3HG2      VAL  85  -4.674   1.629  -3.599
  658   HG22  VAL  85          1HG2      VAL  85  -3.966   0.333  -2.634
  659   HG23  VAL  85          2HG2      VAL  85  -5.263   1.324  -1.965
  660    H    ALA  86           H        ALA  86  -5.563  -3.524  -3.839
  661    HA   ALA  86           HA       ALA  86  -7.467  -4.123  -5.948
  662    HB1  ALA  86           3HB      ALA  86  -6.859  -6.181  -3.924
  663    HB2  ALA  86           1HB      ALA  86  -5.490  -5.594  -4.869
  664    HB3  ALA  86           2HB      ALA  86  -6.892  -6.290  -5.684
  665    H    LYS  87           H        LYS  87  -9.525  -5.120  -5.564
  666    HA   LYS  87           HA       LYS  87 -10.768  -4.189  -3.067
  667    HB2  LYS  87           2HB      LYS  87 -12.913  -4.293  -4.302
  668    HB3  LYS  87           1HB      LYS  87 -11.761  -3.179  -5.022
  669    HG2  LYS  87           2HG      LYS  87 -11.688  -4.312  -6.945
  670    HG3  LYS  87           1HG      LYS  87 -11.639  -5.879  -6.136
  671    HD2  LYS  87           2HD      LYS  87 -14.161  -4.254  -6.267
  672    HD3  LYS  87           1HD      LYS  87 -13.689  -5.333  -7.580
  673    HE2  LYS  87           2HE      LYS  87 -13.901  -7.237  -6.259
  674    HE3  LYS  87           1HE      LYS  87 -13.783  -6.324  -4.756
  675    HZ1  LYS  87           3HZ      LYS  87 -16.040  -7.085  -5.165
  676    HZ2  LYS  87           1HZ      LYS  87 -16.081  -6.253  -6.638
  677    HZ3  LYS  87           2HZ      LYS  87 -15.970  -5.396  -5.185
  678    HA   PRO  88           HA       PRO  88 -11.133  -8.467  -1.899
  679    HB2  PRO  88           2HB      PRO  88 -12.804  -8.108   0.226
  680    HB3  PRO  88           1HB      PRO  88 -11.069  -7.792   0.282
  681    HG2  PRO  88           2HG      PRO  88 -13.336  -5.877  -0.031
  682    HG3  PRO  88           1HG      PRO  88 -11.837  -5.702   0.900
  683    HD2  PRO  88           2HD      PRO  88 -12.230  -4.542  -1.531
  684    HD3  PRO  88           1HD      PRO  88 -10.633  -5.029  -0.934
  685    H    THR  89           H        THR  89 -12.620 -10.155  -1.972
  686    HA   THR  89           HA       THR  89 -15.347  -9.489  -2.857
  687    HB   THR  89           HB       THR  89 -13.663 -11.707  -4.037
  688    HG1  THR  89           1HG      THR  89 -12.779 -10.055  -5.021
  689   HG21  THR  89          3HG2      THR  89 -16.232 -10.527  -5.058
  690   HG22  THR  89          1HG2      THR  89 -16.121 -12.030  -4.142
  691   HG23  THR  89          2HG2      THR  89 -15.341 -11.899  -5.718
  692    H    GLY  90           H        GLY  90 -16.963 -10.752  -2.040
  693    HA2  GLY  90           2HA      GLY  90 -16.396 -12.318   0.272
  694    HA3  GLY  90           1HA      GLY  90 -17.969 -12.112  -0.482
  695    H    SER  91           H        SER  91 -15.378 -14.228   0.063
  696    HA   SER  91           HA       SER  91 -15.752 -15.972  -2.168
  697    HG   SER  91           HG       SER  91 -14.246 -18.445  -0.908
  698    HB2  SER  91           2HB      SER  91 -13.696 -15.755  -0.591
  699    HB3  SER  91           1HB      SER  91 -14.584 -16.859   0.459
  700    H    HIS  92           H        HIS  92 -16.623 -16.293   1.288
  701    HA   HIS  92           HA       HIS  92 -18.567 -18.365   0.548
  702    HD1  HIS  92           1HD      HIS  92 -15.366 -18.471   3.927
  703    HD2  HIS  92           2HD      HIS  92 -18.516 -15.760   3.904
  704    HE1  HIS  92           1HE      HIS  92 -14.715 -16.669   5.557
  705    HE2  HIS  92           2HE      HIS  92 -16.667 -15.079   5.579
  706    HB2  HIS  92           2HB      HIS  92 -18.667 -18.797   3.025
  707    HB3  HIS  92           1HB      HIS  92 -17.100 -19.103   2.287
  708    HA   ARG 301           HA       ARG 301   2.243 -11.186  10.189
  709    HE   ARG 301           HE       ARG 301  -2.492 -12.887  12.871
  710    H1   ARG 301           1HT      ARG 301   3.079 -12.811  12.494
  711    H2   ARG 301           2HT      ARG 301   3.864 -12.828  10.969
  712    H3   ARG 301           3HT      ARG 301   2.225 -13.315  11.096
  713    HB2  ARG 301           2HB      ARG 301   1.563 -11.225  13.135
  714    HB3  ARG 301           1HB      ARG 301   1.102  -9.919  12.053
  715    HG2  ARG 301           2HG      ARG 301  -0.723 -11.035  11.500
  716    HG3  ARG 301           1HG      ARG 301   0.273 -12.335  10.844
  717    HD2  ARG 301           2HD      ARG 301   0.349 -13.418  13.004
  718    HD3  ARG 301           1HD      ARG 301  -0.520 -12.074  13.742
  719   HH11  ARG 301          1HH1      ARG 301   0.199 -14.656  11.488
  720   HH12  ARG 301          2HH1      ARG 301  -0.808 -15.878  10.790
  721   HH21  ARG 301          1HH2      ARG 301  -3.809 -14.501  11.946
  722   HH22  ARG 301          2HH2      ARG 301  -3.082 -15.790  11.047
  723    H    ARG 302           H        ARG 302   3.228  -9.262   9.861
  724    HA   ARG 302           HA       ARG 302   4.981  -8.105  11.855
  725    HE   ARG 302           HE       ARG 302   8.192 -10.610  11.270
  726    HB2  ARG 302           2HB      ARG 302   6.307  -9.837  10.484
  727    HB3  ARG 302           1HB      ARG 302   6.166  -8.697   9.153
  728    HG2  ARG 302           2HG      ARG 302   7.423  -7.057  10.293
  729    HG3  ARG 302           1HG      ARG 302   7.319  -7.934  11.820
  730    HD2  ARG 302           2HD      ARG 302   8.676  -9.068   9.385
  731    HD3  ARG 302           1HD      ARG 302   9.522  -8.072  10.565
  732   HH11  ARG 302          1HH1      ARG 302  10.948  -8.445  11.497
  733   HH12  ARG 302          2HH1      ARG 302  11.795  -9.455  12.615
  734   HH21  ARG 302          1HH2      ARG 302   9.325 -11.925  12.738
  735   HH22  ARG 302          2HH2      ARG 302  10.879 -11.427  13.318
  736    H    GLU 303           H        GLU 303   4.973  -5.945  11.738
  737    HA   GLU 303           HA       GLU 303   3.996  -4.681   9.259
  738    HB2  GLU 303           2HB      GLU 303   3.377  -3.725  12.058
  739    HB3  GLU 303           1HB      GLU 303   2.714  -3.109  10.552
  740    HG2  GLU 303           2HG      GLU 303   1.374  -4.998  10.232
  741    HG3  GLU 303           1HG      GLU 303   2.288  -5.952  11.398
  742    H    THR 304           H        THR 304   5.123  -2.953   8.526
  743    HA   THR 304           HA       THR 304   7.037  -1.636  10.295
  744    HB   THR 304           HB       THR 304   7.719  -3.412   8.058
  745    HG1  THR 304           1HG      THR 304   8.706  -3.971   9.847
  746   HG21  THR 304          3HG2      THR 304   9.191  -0.803   8.316
  747   HG22  THR 304          1HG2      THR 304   8.234  -1.325   6.929
  748   HG23  THR 304          2HG2      THR 304   9.705  -2.197   7.365
  749    H    GLN 305           H        GLN 305   7.643   0.458   9.664
  750    HA   GLN 305           HA       GLN 305   5.681   1.826   8.063
  751    HB2  GLN 305           2HB      GLN 305   8.069   2.751   9.647
  752    HB3  GLN 305           1HB      GLN 305   7.111   3.855   8.668
  753    HG2  GLN 305           2HG      GLN 305   5.332   3.787  10.076
  754    HG3  GLN 305           1HG      GLN 305   5.662   2.136  10.596
  755   HE21  GLN 305          1HE2      GLN 305   5.918   5.411  11.367
  756   HE22  GLN 305          2HE2      GLN 305   6.917   5.257  12.769
  757    H    VAL 306           H        VAL 306   6.075   3.126   6.237
  758    HA   VAL 306           HA       VAL 306   8.617   2.721   4.836
  759    HB   VAL 306           HB       VAL 306   7.366   2.324   2.696
  760   HG11  VAL 306          1HG1      VAL 306   8.484   0.530   3.964
  761   HG12  VAL 306          2HG1      VAL 306   7.071  -0.043   3.079
  762   HG13  VAL 306          3HG1      VAL 306   6.973   0.220   4.820
  763   HG21  VAL 306          3HG2      VAL 306   5.054   1.290   3.043
  764   HG22  VAL 306          1HG2      VAL 306   5.173   3.048   3.134
  765   HG23  VAL 306          2HG2      VAL 306   5.061   2.093   4.612
  Start of MODEL   17
    1    HA   MET   1           HA       MET   1  -9.196   1.934  -8.664
    2    H1   MET   1           1HT      MET   1  -9.816  -0.335  -8.437
    3    H2   MET   1           2HT      MET   1  -8.362  -0.681  -7.593
    4    H3   MET   1           3HT      MET   1  -8.308  -0.202  -9.240
    5    HB2  MET   1           2HB      MET   1  -9.228   0.637  -5.957
    6    HB3  MET   1           1HB      MET   1  -9.052   2.382  -6.087
    7    HG2  MET   1           2HG      MET   1 -11.281   0.997  -7.508
    8    HG3  MET   1           1HG      MET   1 -11.400   1.331  -5.782
    9    HE1  MET   1           3HE      MET   1 -13.582   2.552  -6.352
   10    HE2  MET   1           1HE      MET   1 -13.468   2.608  -8.111
   11    HE3  MET   1           2HE      MET   1 -13.702   4.097  -7.195
   12    H    GLU   2           H        GLU   2  -7.690   3.557  -8.577
   13    HA   GLU   2           HA       GLU   2  -5.007   2.851  -7.588
   14    HB2  GLU   2           2HB      GLU   2  -4.002   3.991  -9.474
   15    HB3  GLU   2           1HB      GLU   2  -5.095   2.746 -10.058
   16    HG2  GLU   2           2HG      GLU   2  -6.216   5.465  -9.763
   17    HG3  GLU   2           1HG      GLU   2  -5.035   5.220 -11.047
   18    H    ILE   3           H        ILE   3  -3.640   4.712  -7.041
   19    HA   ILE   3           HA       ILE   3  -5.133   7.160  -6.408
   20    HB   ILE   3           HB       ILE   3  -3.268   5.650  -4.562
   21   HG12  ILE   3          2HG1      ILE   3  -5.481   6.163  -3.104
   22   HG13  ILE   3          1HG1      ILE   3  -6.203   6.057  -4.706
   23   HG21  ILE   3          1HG2      ILE   3  -4.282   8.461  -4.459
   24   HG22  ILE   3          2HG2      ILE   3  -2.653   7.849  -4.180
   25   HG23  ILE   3          3HG2      ILE   3  -3.912   7.583  -2.975
   26   HD11  ILE   3          3HD1      ILE   3  -5.889   3.838  -4.838
   27   HD12  ILE   3          1HD1      ILE   3  -5.827   3.954  -3.081
   28   HD13  ILE   3          2HD1      ILE   3  -4.332   3.898  -4.013
   29    H    LYS   4           H        LYS   4  -3.934   9.066  -6.705
   30    HA   LYS   4           HA       LYS   4  -1.351   8.658  -8.031
   31    HB2  LYS   4           2HB      LYS   4  -3.039   9.907  -9.277
   32    HB3  LYS   4           1HB      LYS   4  -3.185  11.062  -7.960
   33    HG2  LYS   4           2HG      LYS   4  -0.956  11.862  -8.339
   34    HG3  LYS   4           1HG      LYS   4  -0.667  10.606  -9.545
   35    HD2  LYS   4           2HD      LYS   4  -1.488  11.932 -11.129
   36    HD3  LYS   4           1HD      LYS   4  -3.029  12.011 -10.276
   37    HE2  LYS   4           2HE      LYS   4  -0.718  13.733  -9.455
   38    HE3  LYS   4           1HE      LYS   4  -1.772  14.208 -10.784
   39    HZ1  LYS   4           3HZ      LYS   4  -2.425  15.138  -8.604
   40    HZ2  LYS   4           1HZ      LYS   4  -2.731  13.570  -8.048
   41    HZ3  LYS   4           2HZ      LYS   4  -3.643  14.209  -9.321
   42    H    LEU   5           H        LEU   5  -0.075   8.354  -6.236
   43    HA   LEU   5           HA       LEU   5   0.092  10.407  -4.196
   44    HG   LEU   5           HG       LEU   5  -0.830   7.740  -3.689
   45    HB2  LEU   5           2HB      LEU   5   1.536   7.796  -4.593
   46    HB3  LEU   5           1HB      LEU   5   1.924   8.903  -3.289
   47   HD11  LEU   5          1HD1      LEU   5   1.582   6.514  -2.616
   48   HD12  LEU   5          2HD1      LEU   5   0.039   5.786  -3.059
   49   HD13  LEU   5          3HD1      LEU   5   0.241   6.524  -1.471
   50   HD21  LEU   5          3HD2      LEU   5  -1.128   8.400  -1.346
   51   HD22  LEU   5          1HD2      LEU   5  -0.755   9.784  -2.372
   52   HD23  LEU   5          2HD2      LEU   5   0.494   9.091  -1.338
   53    H    ILE   6           H        ILE   6   1.191  12.201  -4.544
   54    HA   ILE   6           HA       ILE   6   3.481  12.209  -6.358
   55    HB   ILE   6           HB       ILE   6   1.770  13.979  -6.607
   56   HG12  ILE   6          2HG1      ILE   6   4.410  15.124  -5.680
   57   HG13  ILE   6          1HG1      ILE   6   4.190  14.309  -7.226
   58   HG21  ILE   6          1HG2      ILE   6   1.358  14.102  -4.082
   59   HG22  ILE   6          2HG2      ILE   6   1.327  15.610  -4.996
   60   HG23  ILE   6          3HG2      ILE   6   2.749  15.186  -4.043
   61   HD11  ILE   6          3HD1      ILE   6   4.007  16.531  -7.793
   62   HD12  ILE   6          1HD1      ILE   6   3.144  16.948  -6.313
   63   HD13  ILE   6          2HD1      ILE   6   2.318  16.060  -7.594
   64    H    LYS   7           H        LYS   7   5.534  12.220  -5.658
   65    HA   LYS   7           HA       LYS   7   6.294  11.728  -3.059
   66    HB2  LYS   7           2HB      LYS   7   7.804  11.311  -4.890
   67    HB3  LYS   7           1HB      LYS   7   7.879  13.023  -5.277
   68    HG2  LYS   7           2HG      LYS   7   9.883  12.567  -4.168
   69    HG3  LYS   7           1HG      LYS   7   8.868  13.348  -2.956
   70    HD2  LYS   7           2HD      LYS   7   8.199  10.827  -2.449
   71    HD3  LYS   7           1HD      LYS   7   9.795  10.531  -3.139
   72    HE2  LYS   7           2HE      LYS   7  10.494  12.469  -1.497
   73    HE3  LYS   7           1HE      LYS   7   9.036  11.968  -0.642
   74    HZ1  LYS   7           3HZ      LYS   7   9.942   9.686  -0.620
   75    HZ2  LYS   7           1HZ      LYS   7  10.904  10.786   0.233
   76    HZ3  LYS   7           2HZ      LYS   7  11.376  10.265  -1.305
   77    H    GLY   8           H        GLY   8   6.012  12.912  -1.300
   78    HA2  GLY   8           2HA      GLY   8   5.896  15.821  -1.466
   79    HA3  GLY   8           1HA      GLY   8   5.508  14.841  -0.060
   80    HA   PRO   9           HA       PRO   9   9.568  16.790   0.870
   81    HB2  PRO   9           2HB      PRO   9   8.658  16.625   3.654
   82    HB3  PRO   9           1HB      PRO   9   9.148  18.036   2.719
   83    HG2  PRO   9           2HG      PRO   9   6.582  17.596   3.442
   84    HG3  PRO   9           1HG      PRO   9   7.024  18.425   1.938
   85    HD2  PRO   9           2HD      PRO   9   6.154  15.589   2.355
   86    HD3  PRO   9           1HD      PRO   9   5.708  16.726   1.064
   87    H    LYS  10           H        LYS  10   8.577  14.882   3.708
   88    HA   LYS  10           HA       LYS  10  10.995  13.483   3.833
   89    HB2  LYS  10           2HB      LYS  10   8.316  12.771   5.044
   90    HB3  LYS  10           1HB      LYS  10   9.852  12.042   5.494
   91    HG2  LYS  10           2HG      LYS  10  10.358  13.724   6.855
   92    HG3  LYS  10           1HG      LYS  10   9.946  14.934   5.641
   93    HD2  LYS  10           2HD      LYS  10   8.059  15.402   6.718
   94    HD3  LYS  10           1HD      LYS  10   7.538  13.722   6.571
   95    HE2  LYS  10           2HE      LYS  10   9.499  14.516   8.688
   96    HE3  LYS  10           1HE      LYS  10   7.774  14.794   8.927
   97    HZ1  LYS  10           3HZ      LYS  10   9.103  12.185   8.430
   98    HZ2  LYS  10           1HZ      LYS  10   7.425  12.401   8.478
   99    HZ3  LYS  10           2HZ      LYS  10   8.355  12.689   9.860
  100    H    GLY  11           H        GLY  11   7.807  11.965   3.205
  101    HA2  GLY  11           2HA      GLY  11   8.607  10.658   0.835
  102    HA3  GLY  11           1HA      GLY  11   8.865   9.577   2.194
  103    H    LEU  12           H        LEU  12   7.238   8.270   2.684
  104    HA   LEU  12           HA       LEU  12   4.645   8.696   1.453
  105    HG   LEU  12           HG       LEU  12   5.861   6.954   0.233
  106    HB2  LEU  12           2HB      LEU  12   5.678   6.402   3.119
  107    HB3  LEU  12           1HB      LEU  12   4.138   6.434   2.287
  108   HD11  LEU  12          1HD1      LEU  12   7.666   6.391   2.062
  109   HD12  LEU  12          2HD1      LEU  12   7.840   5.825   0.401
  110   HD13  LEU  12          3HD1      LEU  12   7.241   4.731   1.648
  111   HD21  LEU  12          3HD2      LEU  12   4.018   5.373   0.190
  112   HD22  LEU  12          1HD2      LEU  12   4.922   4.264   1.222
  113   HD23  LEU  12          2HD2      LEU  12   5.493   4.616  -0.409
  114    H    GLY  13           H        GLY  13   5.891   8.146   4.761
  115    HA2  GLY  13           2HA      GLY  13   5.166   9.139   6.726
  116    HA3  GLY  13           1HA      GLY  13   3.890   9.938   5.827
  117    H    PHE  14           H        PHE  14   4.489   6.440   5.915
  118    HA   PHE  14           HA       PHE  14   2.462   5.944   7.870
  119    HD1  PHE  14           2HD      PHE  14   2.347   3.170   4.948
  120    HD2  PHE  14           1HD      PHE  14   1.269   7.136   3.833
  121    HE1  PHE  14           2HE      PHE  14   2.751   2.613   2.589
  122    HE2  PHE  14           1HE      PHE  14   1.667   6.582   1.471
  123    HZ   PHE  14           HZ       PHE  14   2.410   4.319   0.846
  124    HB2  PHE  14           2HB      PHE  14   0.882   4.752   6.398
  125    HB3  PHE  14           1HB      PHE  14   0.979   6.465   6.022
  126    H    SER  15           H        SER  15   1.815   3.337   7.460
  127    HA   SER  15           HA       SER  15   4.356   1.953   7.046
  128    HG   SER  15           HG       SER  15   2.060   1.189  10.277
  129    HB2  SER  15           2HB      SER  15   3.570   0.454   8.976
  130    HB3  SER  15           1HB      SER  15   4.241   2.024   9.393
  131    H    ILE  16           H        ILE  16   3.886  -0.539   7.005
  132    HA   ILE  16           HA       ILE  16   1.268  -1.268   5.972
  133    HB   ILE  16           HB       ILE  16   1.843  -1.884   3.816
  134   HG12  ILE  16          2HG1      ILE  16   3.988  -3.014   4.427
  135   HG13  ILE  16          1HG1      ILE  16   4.012  -2.176   2.882
  136   HG21  ILE  16          1HG2      ILE  16   1.640   0.510   3.932
  137   HG22  ILE  16          2HG2      ILE  16   2.836   0.069   2.715
  138   HG23  ILE  16          3HG2      ILE  16   3.360   0.664   4.289
  139   HD11  ILE  16          3HD1      ILE  16   5.851  -1.949   4.918
  140   HD12  ILE  16          1HD1      ILE  16   4.889  -0.473   5.031
  141   HD13  ILE  16          2HD1      ILE  16   5.686  -0.891   3.513
  142    H    ALA  17           H        ALA  17   1.278  -3.592   5.269
  143    HA   ALA  17           HA       ALA  17   3.287  -5.275   6.583
  144    HB1  ALA  17           3HB      ALA  17   0.398  -5.108   7.209
  145    HB2  ALA  17           1HB      ALA  17   1.749  -5.602   8.228
  146    HB3  ALA  17           2HB      ALA  17   1.072  -6.732   7.057
  147    H    GLY  18           H        GLY  18   3.071  -7.636   5.607
  148    HA2  GLY  18           2HA      GLY  18   1.494  -8.214   3.452
  149    HA3  GLY  18           1HA      GLY  18   2.762  -7.238   2.757
  150    H    GLY  19           H        GLY  19   1.821 -10.284   2.741
  151    HA2  GLY  19           2HA      GLY  19   3.313 -11.871   1.726
  152    HA3  GLY  19           1HA      GLY  19   4.606 -11.239   2.729
  153    H    VAL  20           H        VAL  20   3.852 -13.983   2.438
  154    HA   VAL  20           HA       VAL  20   2.284 -14.898   4.602
  155    HB   VAL  20           HB       VAL  20   4.532 -16.388   3.225
  156   HG11  VAL  20          1HG1      VAL  20   2.217 -17.298   4.921
  157   HG12  VAL  20          2HG1      VAL  20   3.939 -17.549   5.205
  158   HG13  VAL  20          3HG1      VAL  20   3.134 -18.385   3.878
  159   HG21  VAL  20          3HG2      VAL  20   1.661 -15.952   2.475
  160   HG22  VAL  20          1HG2      VAL  20   2.529 -17.396   1.952
  161   HG23  VAL  20          2HG2      VAL  20   3.107 -15.799   1.477
  162    H    GLY  21           H        GLY  21   2.832 -15.555   6.685
  163    HA2  GLY  21           2HA      GLY  21   4.184 -15.890   8.564
  164    HA3  GLY  21           1HA      GLY  21   5.591 -15.486   7.592
  165    H    ASN  22           H        ASN  22   3.908 -13.017   6.774
  166    HA   ASN  22           HA       ASN  22   4.077 -11.387   9.181
  167    HB2  ASN  22           2HB      ASN  22   5.176  -9.628   7.482
  168    HB3  ASN  22           1HB      ASN  22   6.165 -10.709   8.443
  169   HD21  ASN  22          1HD2      ASN  22   4.508 -10.563   5.314
  170   HD22  ASN  22          2HD2      ASN  22   5.733 -11.411   4.441
  171    H    GLN  23           H        GLN  23   1.927 -12.479   7.380
  172    HA   GLN  23           HA       GLN  23   0.900 -10.488   5.699
  173    HB2  GLN  23           2HB      GLN  23  -0.795 -12.506   7.159
  174    HB3  GLN  23           1HB      GLN  23  -1.089 -11.776   5.589
  175    HG2  GLN  23           2HG      GLN  23   0.242 -13.239   4.506
  176    HG3  GLN  23           1HG      GLN  23   1.382 -13.365   5.843
  177   HE21  GLN  23          1HE2      GLN  23   0.930 -14.790   7.558
  178   HE22  GLN  23          2HE2      GLN  23  -0.182 -16.098   7.366
  179    H    HIS  24           H        HIS  24  -0.804  -9.059   5.916
  180    HA   HIS  24           HA       HIS  24  -1.123  -7.918   8.581
  181    HD1  HIS  24           1HD      HIS  24  -0.691  -5.083   8.875
  182    HD2  HIS  24           2HD      HIS  24  -4.275  -5.452   6.820
  183    HE1  HIS  24           1HE      HIS  24  -2.165  -3.284   9.784
  184    HE2  HIS  24           2HE      HIS  24  -4.293  -3.434   8.446
  185    HB2  HIS  24           2HB      HIS  24  -0.617  -6.468   6.602
  186    HB3  HIS  24           1HB      HIS  24  -2.178  -6.901   5.935
  187    H    ILE  25           H        ILE  25  -2.949  -9.622   6.150
  188    HA   ILE  25           HA       ILE  25  -5.240  -9.750   7.984
  189    HB   ILE  25           HB       ILE  25  -5.547  -9.365   5.003
  190   HG12  ILE  25          2HG1      ILE  25  -4.627  -7.341   6.178
  191   HG13  ILE  25          1HG1      ILE  25  -6.193  -7.091   5.414
  192   HG21  ILE  25          1HG2      ILE  25  -7.513  -9.463   7.279
  193   HG22  ILE  25          2HG2      ILE  25  -7.400 -10.556   5.899
  194   HG23  ILE  25          3HG2      ILE  25  -7.917  -8.886   5.662
  195   HD11  ILE  25          3HD1      ILE  25  -7.037  -6.401   7.333
  196   HD12  ILE  25          1HD1      ILE  25  -5.452  -6.593   8.081
  197   HD13  ILE  25          2HD1      ILE  25  -6.606  -7.926   8.107
  198    HA   PRO  26           HA       PRO  26  -4.590 -14.135   7.420
  199    HB2  PRO  26           2HB      PRO  26  -7.492 -14.164   8.124
  200    HB3  PRO  26           1HB      PRO  26  -6.160 -15.112   8.797
  201    HG2  PRO  26           2HG      PRO  26  -7.170 -13.058  10.149
  202    HG3  PRO  26           1HG      PRO  26  -5.424 -13.372  10.143
  203    HD2  PRO  26           2HD      PRO  26  -6.983 -11.284   8.690
  204    HD3  PRO  26           1HD      PRO  26  -5.354 -11.196   9.389
  205    H    GLY  27           H        GLY  27  -4.530 -15.076   5.482
  206    HA2  GLY  27           2HA      GLY  27  -5.573 -16.197   3.668
  207    HA3  GLY  27           1HA      GLY  27  -6.964 -15.138   3.843
  208    H    ASP  28           H        ASP  28  -5.916 -12.643   3.746
  209    HA   ASP  28           HA       ASP  28  -5.043 -12.481   0.974
  210    HB2  ASP  28           2HB      ASP  28  -6.745 -10.931   2.587
  211    HB3  ASP  28           1HB      ASP  28  -5.344  -9.914   2.271
  212    H    ASN  29           H        ASN  29  -2.917 -12.680   0.673
  213    HA   ASN  29           HA       ASN  29  -1.024 -11.665   2.629
  214    HB2  ASN  29           2HB      ASN  29  -0.333 -12.918  -0.023
  215    HB3  ASN  29           1HB      ASN  29   0.659 -12.824   1.428
  216   HD21  ASN  29          1HD2      ASN  29  -0.387 -15.089  -0.274
  217   HD22  ASN  29          2HD2      ASN  29  -1.097 -16.178   0.864
  218    H    SER  30           H        SER  30  -2.737  -9.895   0.731
  219    HA   SER  30           HA       SER  30  -0.766  -8.526  -0.873
  220    HG   SER  30           HG       SER  30  -4.476  -8.848  -1.251
  221    HB2  SER  30           2HB      SER  30  -3.449  -7.364  -0.174
  222    HB3  SER  30           1HB      SER  30  -2.527  -7.204  -1.667
  223    H    ILE  31           H        ILE  31  -0.066  -6.315  -0.504
  224    HA   ILE  31           HA       ILE  31   0.536  -5.868   2.233
  225    HB   ILE  31           HB       ILE  31   0.987  -3.842   0.054
  226   HG12  ILE  31          2HG1      ILE  31   1.991  -5.597  -1.021
  227   HG13  ILE  31          1HG1      ILE  31   3.320  -5.077   0.002
  228   HG21  ILE  31          1HG2      ILE  31   1.421  -3.345   2.511
  229   HG22  ILE  31          2HG2      ILE  31   2.722  -3.020   1.365
  230   HG23  ILE  31          3HG2      ILE  31   2.772  -4.469   2.368
  231   HD11  ILE  31          3HD1      ILE  31   2.219  -7.632  -0.205
  232   HD12  ILE  31          1HD1      ILE  31   1.715  -7.027   1.370
  233   HD13  ILE  31          2HD1      ILE  31   3.425  -7.075   0.953
  234    H    TYR  32           H        TYR  32  -0.548  -4.851   3.725
  235    HA   TYR  32           HA       TYR  32  -2.627  -2.887   3.003
  236    HD1  TYR  32           2HD      TYR  32  -2.524  -6.470   3.387
  237    HD2  TYR  32           1HD      TYR  32  -5.701  -3.847   4.389
  238    HE1  TYR  32           2HE      TYR  32  -4.093  -7.959   2.225
  239    HE2  TYR  32           1HE      TYR  32  -7.299  -5.319   3.252
  240    HH   TYR  32           HH       TYR  32  -6.437  -7.656   1.106
  241    HB2  TYR  32           2HB      TYR  32  -2.451  -4.779   5.350
  242    HB3  TYR  32           1HB      TYR  32  -3.603  -3.456   5.271
  243    H    VAL  33           H        VAL  33  -2.765  -0.984   4.232
  244    HA   VAL  33           HA       VAL  33  -0.307  -0.093   5.427
  245    HB   VAL  33           HB       VAL  33  -2.978   1.266   5.029
  246   HG11  VAL  33          1HG1      VAL  33  -1.434   3.332   5.668
  247   HG12  VAL  33          2HG1      VAL  33  -0.634   2.105   6.650
  248   HG13  VAL  33          3HG1      VAL  33  -2.349   2.439   6.881
  249   HG21  VAL  33          3HG2      VAL  33  -0.413   1.158   3.584
  250   HG22  VAL  33          1HG2      VAL  33  -1.142   2.757   3.725
  251   HG23  VAL  33          2HG2      VAL  33  -2.046   1.439   2.982
  252    H    THR  34           H        THR  34   0.200  -0.211   7.529
  253    HA   THR  34           HA       THR  34  -1.820  -1.197   9.386
  254    HB   THR  34           HB       THR  34  -0.012  -1.859  10.804
  255    HG1  THR  34           1HG      THR  34   1.762  -0.513   9.055
  256   HG21  THR  34          3HG2      THR  34   1.572  -2.648   8.604
  257   HG22  THR  34          1HG2      THR  34  -0.116  -2.710   8.101
  258   HG23  THR  34          2HG2      THR  34   0.414  -3.603   9.525
  259    H    LYS  35           H        LYS  35   0.039   1.716   8.823
  260    HA   LYS  35           HA       LYS  35  -1.521   3.153  10.750
  261    HB2  LYS  35           2HB      LYS  35   0.120   2.068  12.244
  262    HB3  LYS  35           1HB      LYS  35   1.428   2.792  11.317
  263    HG2  LYS  35           2HG      LYS  35   0.804   4.986  12.007
  264    HG3  LYS  35           1HG      LYS  35  -0.676   4.387  12.759
  265    HD2  LYS  35           2HD      LYS  35   0.395   3.752  14.629
  266    HD3  LYS  35           1HD      LYS  35   1.763   3.091  13.733
  267    HE2  LYS  35           2HE      LYS  35   1.392   6.052  13.942
  268    HE3  LYS  35           1HE      LYS  35   2.102   5.156  15.283
  269    HZ1  LYS  35           3HZ      LYS  35   3.806   4.328  13.783
  270    HZ2  LYS  35           1HZ      LYS  35   3.797   6.021  13.797
  271    HZ3  LYS  35           2HZ      LYS  35   3.122   5.182  12.492
  272    H    ILE  36           H        ILE  36  -1.793   5.154   9.968
  273    HA   ILE  36           HA       ILE  36   0.176   6.154   8.035
  274    HB   ILE  36           HB       ILE  36  -2.668   7.065   8.495
  275   HG12  ILE  36          2HG1      ILE  36  -1.382   5.340   6.370
  276   HG13  ILE  36          1HG1      ILE  36  -2.676   4.893   7.476
  277   HG21  ILE  36          1HG2      ILE  36  -0.740   7.864   6.316
  278   HG22  ILE  36          2HG2      ILE  36  -1.141   8.855   7.717
  279   HG23  ILE  36          3HG2      ILE  36  -2.388   8.450   6.539
  280   HD11  ILE  36          3HD1      ILE  36  -2.787   6.639   5.056
  281   HD12  ILE  36          1HD1      ILE  36  -4.018   6.749   6.314
  282   HD13  ILE  36          2HD1      ILE  36  -3.760   5.226   5.461
  283    H    ILE  37           H        ILE  37   1.489   7.778   8.571
  284    HA   ILE  37           HA       ILE  37   1.287   9.053  11.142
  285    HB   ILE  37           HB       ILE  37   3.271   9.202   8.883
  286   HG12  ILE  37          2HG1      ILE  37   4.779   8.511  10.868
  287   HG13  ILE  37          1HG1      ILE  37   3.269   8.158  11.702
  288   HG21  ILE  37          1HG2      ILE  37   4.636  10.681  10.410
  289   HG22  ILE  37          2HG2      ILE  37   3.145  10.979  11.302
  290   HG23  ILE  37          3HG2      ILE  37   3.266  11.442   9.604
  291   HD11  ILE  37          3HD1      ILE  37   2.685   6.516  10.057
  292   HD12  ILE  37          1HD1      ILE  37   4.319   6.191  10.635
  293   HD13  ILE  37          2HD1      ILE  37   4.076   6.956   9.066
  294    H    GLU  38           H        GLU  38   1.043  11.285  11.535
  295    HA   GLU  38           HA       GLU  38  -0.897  12.606   9.999
  296    HB2  GLU  38           2HB      GLU  38   0.906  13.429  12.243
  297    HB3  GLU  38           1HB      GLU  38  -0.022  14.657  11.393
  298    HG2  GLU  38           2HG      GLU  38  -2.080  13.659  12.011
  299    HG3  GLU  38           1HG      GLU  38  -1.271  12.209  12.606
  300    H    GLY  39           H        GLY  39  -0.805  14.394   8.632
  301    HA2  GLY  39           2HA      GLY  39   0.024  15.695   6.941
  302    HA3  GLY  39           1HA      GLY  39   1.484  15.819   7.902
  303    H    GLY  40           H        GLY  40   0.530  12.631   6.933
  304    HA2  GLY  40           2HA      GLY  40   2.896  12.456   5.247
  305    HA3  GLY  40           1HA      GLY  40   1.899  11.116   5.789
  306    H    ALA  41           H        ALA  41   2.750  11.138   3.219
  307    HA   ALA  41           HA       ALA  41   1.321  12.394   1.248
  308    HB1  ALA  41           3HB      ALA  41   2.193   9.507   1.215
  309    HB2  ALA  41           1HB      ALA  41   3.219  10.892   0.841
  310    HB3  ALA  41           2HB      ALA  41   1.842  10.510  -0.193
  311    H    ALA  42           H        ALA  42   0.422   9.285   2.781
  312    HA   ALA  42           HA       ALA  42  -2.054   9.062   1.405
  313    HB1  ALA  42           3HB      ALA  42  -2.547   7.352   3.229
  314    HB2  ALA  42           1HB      ALA  42  -0.929   7.702   3.837
  315    HB3  ALA  42           2HB      ALA  42  -1.139   7.053   2.211
  316    H    HIS  43           H        HIS  43  -1.272   9.994   4.756
  317    HA   HIS  43           HA       HIS  43  -3.812  10.507   5.706
  318    HD1  HIS  43           1HD      HIS  43  -2.480  14.164   7.113
  319    HD2  HIS  43           2HD      HIS  43  -3.791  10.723   9.038
  320    HE1  HIS  43           1HE      HIS  43  -3.838  14.966   9.070
  321    HE2  HIS  43           2HE      HIS  43  -4.564  12.868  10.262
  322    HB2  HIS  43           2HB      HIS  43  -1.786  10.497   7.101
  323    HB3  HIS  43           1HB      HIS  43  -1.270  12.009   6.366
  324    H    LYS  44           H        LYS  44  -1.635  12.783   4.040
  325    HA   LYS  44           HA       LYS  44  -3.442  14.979   4.167
  326    HB2  LYS  44           2HB      LYS  44  -1.007  14.479   2.452
  327    HB3  LYS  44           1HB      LYS  44  -1.901  15.993   2.457
  328    HG2  LYS  44           2HG      LYS  44  -1.281  15.297   5.149
  329    HG3  LYS  44           1HG      LYS  44   0.186  15.179   4.174
  330    HD2  LYS  44           2HD      LYS  44  -0.886  17.511   3.262
  331    HD3  LYS  44           1HD      LYS  44  -1.381  17.536   4.955
  332    HE2  LYS  44           2HE      LYS  44   0.694  18.605   4.955
  333    HE3  LYS  44           1HE      LYS  44   1.059  16.964   5.481
  334    HZ1  LYS  44           3HZ      LYS  44   1.755  16.438   3.223
  335    HZ2  LYS  44           1HZ      LYS  44   2.648  17.737   3.838
  336    HZ3  LYS  44           2HZ      LYS  44   1.407  18.017   2.723
  337    H    ASP  45           H        ASP  45  -2.732  12.540   1.696
  338    HA   ASP  45           HA       ASP  45  -4.259  13.686  -0.380
  339    HB2  ASP  45           2HB      ASP  45  -2.552  11.884  -0.674
  340    HB3  ASP  45           1HB      ASP  45  -3.677  10.749   0.062
  341    H    GLY  46           H        GLY  46  -5.077  11.062   1.899
  342    HA2  GLY  46           2HA      GLY  46  -7.190  10.895   2.985
  343    HA3  GLY  46           1HA      GLY  46  -7.896  11.867   1.705
  344    H    LYS  47           H        LYS  47  -6.602  10.236  -0.417
  345    HA   LYS  47           HA       LYS  47  -8.681   8.407  -0.867
  346    HB2  LYS  47           2HB      LYS  47  -5.921   8.506  -2.098
  347    HB3  LYS  47           1HB      LYS  47  -7.251   7.530  -2.702
  348    HG2  LYS  47           2HG      LYS  47  -8.537   9.518  -3.192
  349    HG3  LYS  47           1HG      LYS  47  -7.275  10.535  -2.494
  350    HD2  LYS  47           2HD      LYS  47  -6.221  10.591  -4.450
  351    HD3  LYS  47           1HD      LYS  47  -6.081   8.833  -4.440
  352    HE2  LYS  47           2HE      LYS  47  -8.757   9.683  -5.140
  353    HE3  LYS  47           1HE      LYS  47  -7.553  10.389  -6.217
  354    HZ1  LYS  47           3HZ      LYS  47  -8.470   8.165  -6.891
  355    HZ2  LYS  47           1HZ      LYS  47  -7.629   7.494  -5.585
  356    HZ3  LYS  47           2HZ      LYS  47  -6.783   8.265  -6.830
  357    H    LEU  48           H        LEU  48  -5.406   7.928   0.418
  358    HA   LEU  48           HA       LEU  48  -5.893   5.081   0.767
  359    HG   LEU  48           HG       LEU  48  -3.996   3.751   0.707
  360    HB2  LEU  48           2HB      LEU  48  -3.656   6.246   0.077
  361    HB3  LEU  48           1HB      LEU  48  -3.469   6.500   1.800
  362   HD11  LEU  48          1HD1      LEU  48  -2.036   4.771  -0.467
  363   HD12  LEU  48          2HD1      LEU  48  -1.658   3.342   0.495
  364   HD13  LEU  48          3HD1      LEU  48  -1.260   4.947   1.107
  365   HD21  LEU  48          3HD2      LEU  48  -2.239   4.223   3.020
  366   HD22  LEU  48          1HD2      LEU  48  -3.504   3.019   2.771
  367   HD23  LEU  48          2HD2      LEU  48  -3.932   4.661   3.246
  368    H    GLN  49           H        GLN  49  -6.698   4.231   2.540
  369    HA   GLN  49           HA       GLN  49  -6.419   5.642   5.100
  370    HB2  GLN  49           2HB      GLN  49  -8.705   4.981   5.693
  371    HB3  GLN  49           1HB      GLN  49  -8.688   6.022   4.279
  372    HG2  GLN  49           2HG      GLN  49  -8.739   3.052   3.955
  373    HG3  GLN  49           1HG      GLN  49 -10.218   3.932   4.334
  374   HE21  GLN  49          1HE2      GLN  49  -8.241   2.832   1.886
  375   HE22  GLN  49          2HE2      GLN  49  -8.863   3.789   0.589
  376    H    ILE  50           H        ILE  50  -6.093   4.328   6.898
  377    HA   ILE  50           HA       ILE  50  -4.725   1.963   6.628
  378    HB   ILE  50           HB       ILE  50  -5.392   1.456   9.017
  379   HG12  ILE  50          2HG1      ILE  50  -6.418   4.045   9.656
  380   HG13  ILE  50          1HG1      ILE  50  -7.437   3.351   8.400
  381   HG21  ILE  50          1HG2      ILE  50  -4.299   4.194   8.388
  382   HG22  ILE  50          2HG2      ILE  50  -3.380   2.692   8.491
  383   HG23  ILE  50          3HG2      ILE  50  -4.139   3.362   9.935
  384   HD11  ILE  50          3HD1      ILE  50  -8.072   1.563   9.733
  385   HD12  ILE  50          1HD1      ILE  50  -8.042   2.927  10.852
  386   HD13  ILE  50          2HD1      ILE  50  -6.709   1.772  10.831
  387    H    GLY  51           H        GLY  51  -5.252  -0.036   5.985
  388    HA2  GLY  51           2HA      GLY  51  -6.729  -1.968   6.484
  389    HA3  GLY  51           1HA      GLY  51  -8.075  -0.878   6.229
  390    H    ASP  52           H        ASP  52  -6.463   0.349   3.877
  391    HA   ASP  52           HA       ASP  52  -7.664  -1.224   1.877
  392    HB2  ASP  52           2HB      ASP  52  -6.157   0.209   0.329
  393    HB3  ASP  52           1HB      ASP  52  -7.419   1.001   1.258
  394    H    LYS  53           H        LYS  53  -6.637  -2.379   0.148
  395    HA   LYS  53           HA       LYS  53  -4.157  -3.709   1.014
  396    HB2  LYS  53           2HB      LYS  53  -4.899  -5.591  -0.464
  397    HB3  LYS  53           1HB      LYS  53  -5.944  -5.293   0.914
  398    HG2  LYS  53           2HG      LYS  53  -6.659  -3.937  -1.611
  399    HG3  LYS  53           1HG      LYS  53  -6.868  -5.688  -1.549
  400    HD2  LYS  53           2HD      LYS  53  -7.898  -3.998   0.690
  401    HD3  LYS  53           1HD      LYS  53  -8.813  -4.100  -0.815
  402    HE2  LYS  53           2HE      LYS  53  -9.504  -6.185  -0.382
  403    HE3  LYS  53           1HE      LYS  53  -7.911  -6.694   0.171
  404    HZ1  LYS  53           3HZ      LYS  53 -10.187  -6.006   1.704
  405    HZ2  LYS  53           1HZ      LYS  53  -8.899  -4.990   2.116
  406    HZ3  LYS  53           2HZ      LYS  53  -8.721  -6.668   2.220
  407    H    LEU  54           H        LEU  54  -2.560  -4.140  -0.476
  408    HA   LEU  54           HA       LEU  54  -2.572  -2.324  -2.781
  409    HG   LEU  54           HG       LEU  54  -1.190  -0.736  -1.693
  410    HB2  LEU  54           2HB      LEU  54  -0.583  -3.081  -0.854
  411    HB3  LEU  54           1HB      LEU  54   0.008  -3.383  -2.476
  412   HD11  LEU  54          1HD1      LEU  54   1.740  -0.947  -1.824
  413   HD12  LEU  54          2HD1      LEU  54   0.986  -1.695  -0.416
  414   HD13  LEU  54          3HD1      LEU  54   0.711   0.012  -0.760
  415   HD21  LEU  54          3HD2      LEU  54   0.380  -1.807  -3.995
  416   HD22  LEU  54          1HD2      LEU  54   0.502  -0.099  -3.572
  417   HD23  LEU  54          2HD2      LEU  54  -1.064  -0.794  -3.991
  418    H    LEU  55           H        LEU  55  -2.720  -3.007  -4.747
  419    HA   LEU  55           HA       LEU  55  -2.593  -5.853  -5.344
  420    HG   LEU  55           HG       LEU  55  -2.722  -5.454  -8.417
  421    HB2  LEU  55           2HB      LEU  55  -4.511  -4.558  -6.156
  422    HB3  LEU  55           1HB      LEU  55  -3.433  -3.493  -7.036
  423   HD11  LEU  55          1HD1      LEU  55  -3.369  -7.529  -7.958
  424   HD12  LEU  55          2HD1      LEU  55  -5.062  -7.048  -7.857
  425   HD13  LEU  55          3HD1      LEU  55  -4.022  -6.914  -6.439
  426   HD21  LEU  55          3HD2      LEU  55  -4.532  -5.282  -9.884
  427   HD22  LEU  55          1HD2      LEU  55  -4.578  -3.775  -8.969
  428   HD23  LEU  55          2HD2      LEU  55  -5.694  -5.082  -8.573
  429    H    ALA  56           H        ALA  56  -1.244  -2.779  -6.626
  430    HA   ALA  56           HA       ALA  56   1.266  -4.181  -7.160
  431    HB1  ALA  56           3HB      ALA  56   1.315  -3.273  -9.523
  432    HB2  ALA  56           1HB      ALA  56  -0.396  -2.892  -9.334
  433    HB3  ALA  56           2HB      ALA  56   0.147  -4.567  -9.245
  434    H    VAL  57           H        VAL  57   3.060  -2.740  -7.581
  435    HA   VAL  57           HA       VAL  57   2.563   0.110  -7.040
  436    HB   VAL  57           HB       VAL  57   4.714  -1.512  -5.663
  437   HG11  VAL  57          1HG1      VAL  57   5.123   0.962  -6.275
  438   HG12  VAL  57          2HG1      VAL  57   5.431   0.440  -4.620
  439   HG13  VAL  57          3HG1      VAL  57   3.947   1.311  -5.008
  440   HG21  VAL  57          3HG2      VAL  57   2.077  -0.442  -4.696
  441   HG22  VAL  57          1HG2      VAL  57   3.398  -0.833  -3.594
  442   HG23  VAL  57          2HG2      VAL  57   2.692  -2.093  -4.606
  443    H    ASN  58           H        ASN  58   3.314   1.160  -8.767
  444    HA   ASN  58           HA       ASN  58   4.645   1.854 -10.470
  445    HB2  ASN  58           2HB      ASN  58   6.711   0.534  -8.712
  446    HB3  ASN  58           1HB      ASN  58   7.143   1.326 -10.223
  447   HD21  ASN  58          1HD2      ASN  58   7.847   3.312  -9.961
  448   HD22  ASN  58          2HD2      ASN  58   7.340   4.423  -8.739
  449    H    ASN  59           H        ASN  59   3.168  -0.451 -10.918
  450    HA   ASN  59           HA       ASN  59   2.898  -1.839 -12.731
  451    HB2  ASN  59           2HB      ASN  59   5.002  -0.532 -13.650
  452    HB3  ASN  59           1HB      ASN  59   5.822  -2.051 -13.295
  453   HD21  ASN  59          1HD2      ASN  59   3.264  -0.543 -15.157
  454   HD22  ASN  59          2HD2      ASN  59   3.158  -1.776 -16.362
  455    H    VAL  60           H        VAL  60   5.017  -2.427 -10.085
  456    HA   VAL  60           HA       VAL  60   5.213  -5.283 -10.632
  457    HB   VAL  60           HB       VAL  60   6.638  -5.480  -8.776
  458   HG11  VAL  60          1HG1      VAL  60   8.189  -3.405  -8.995
  459   HG12  VAL  60          2HG1      VAL  60   7.084  -2.947 -10.290
  460   HG13  VAL  60          3HG1      VAL  60   7.958  -4.477 -10.377
  461   HG21  VAL  60          3HG2      VAL  60   6.010  -4.526  -6.868
  462   HG22  VAL  60          1HG2      VAL  60   5.110  -3.261  -7.702
  463   HG23  VAL  60          2HG2      VAL  60   6.841  -3.078  -7.435
  464    H    CYS  61           H        CYS  61   4.203  -6.902  -9.360
  465    HA   CYS  61           HA       CYS  61   1.732  -6.008  -8.131
  466    HG   CYS  61           HG       CYS  61   2.750 -10.235  -8.797
  467    HB2  CYS  61           2HB      CYS  61   1.161  -8.379  -7.966
  468    HB3  CYS  61           1HB      CYS  61   1.654  -7.952  -9.599
  469    H    LEU  62           H        LEU  62   1.352  -5.817  -6.021
  470    HA   LEU  62           HA       LEU  62   3.472  -6.624  -4.166
  471    HG   LEU  62           HG       LEU  62   3.610  -5.276  -2.050
  472    HB2  LEU  62           2HB      LEU  62   2.235  -4.202  -4.508
  473    HB3  LEU  62           1HB      LEU  62   1.352  -4.874  -3.155
  474   HD11  LEU  62          1HD1      LEU  62   5.521  -4.150  -2.845
  475   HD12  LEU  62          2HD1      LEU  62   4.594  -3.277  -4.065
  476   HD13  LEU  62          3HD1      LEU  62   4.857  -5.013  -4.231
  477   HD21  LEU  62          3HD2      LEU  62   1.944  -3.294  -1.735
  478   HD22  LEU  62          1HD2      LEU  62   3.208  -2.359  -2.534
  479   HD23  LEU  62          2HD2      LEU  62   3.559  -3.211  -1.031
  480    H    GLU  63           H        GLU  63   1.307  -8.383  -5.267
  481    HA   GLU  63           HA       GLU  63  -0.173  -9.000  -2.805
  482    HB2  GLU  63           2HB      GLU  63  -0.757  -9.256  -5.688
  483    HB3  GLU  63           1HB      GLU  63  -1.319 -10.582  -4.680
  484    HG2  GLU  63           2HG      GLU  63  -2.130  -8.415  -3.244
  485    HG3  GLU  63           1HG      GLU  63  -2.292  -7.835  -4.899
  486    H    GLU  64           H        GLU  64   2.338 -10.230  -4.851
  487    HA   GLU  64           HA       GLU  64   2.286 -12.747  -3.329
  488    HB2  GLU  64           2HB      GLU  64   2.148 -12.366  -6.173
  489    HB3  GLU  64           1HB      GLU  64   3.586 -13.284  -5.758
  490    HG2  GLU  64           2HG      GLU  64   2.087 -14.976  -6.002
  491    HG3  GLU  64           1HG      GLU  64   1.891 -14.643  -4.281
  492    H    VAL  65           H        VAL  65   3.683 -10.892  -2.171
  493    HA   VAL  65           HA       VAL  65   6.455 -11.695  -2.630
  494    HB   VAL  65           HB       VAL  65   7.229  -9.315  -2.363
  495   HG11  VAL  65          1HG1      VAL  65   7.105  -8.830  -4.697
  496   HG12  VAL  65          2HG1      VAL  65   5.651  -9.811  -4.882
  497   HG13  VAL  65          3HG1      VAL  65   7.194 -10.583  -4.520
  498   HG21  VAL  65          3HG2      VAL  65   5.626  -7.555  -3.091
  499   HG22  VAL  65          1HG2      VAL  65   5.237  -8.276  -1.530
  500   HG23  VAL  65          2HG2      VAL  65   4.331  -8.745  -2.969
  501    H    THR  66           H        THR  66   7.863 -11.353  -0.886
  502    HA   THR  66           HA       THR  66   6.700 -11.667   1.683
  503    HB   THR  66           HB       THR  66   9.173 -11.214   2.416
  504    HG1  THR  66           1HG      THR  66  10.653 -11.395   0.770
  505   HG21  THR  66          3HG2      THR  66   8.785 -13.549   0.577
  506   HG22  THR  66          1HG2      THR  66   8.053 -13.466   2.180
  507   HG23  THR  66          2HG2      THR  66   9.807 -13.432   2.010
  508    H    HIS  67           H        HIS  67   7.274 -10.233   3.578
  509    HA   HIS  67           HA       HIS  67   6.172  -7.714   3.203
  510    HD1  HIS  67           1HD      HIS  67   4.804  -6.968   6.296
  511    HD2  HIS  67           2HD      HIS  67   8.618  -5.588   5.427
  512    HE1  HIS  67           1HE      HIS  67   4.816  -4.553   6.961
  513    HE2  HIS  67           2HE      HIS  67   7.083  -3.709   6.295
  514    HB2  HIS  67           2HB      HIS  67   6.237  -8.758   5.410
  515    HB3  HIS  67           1HB      HIS  67   7.974  -8.505   5.509
  516    H    GLU  68           H        GLU  68   9.597  -8.618   3.163
  517    HA   GLU  68           HA       GLU  68  10.753  -6.107   3.191
  518    HB2  GLU  68           2HB      GLU  68  12.572  -7.128   1.772
  519    HB3  GLU  68           1HB      GLU  68  12.183  -8.010   3.240
  520    HG2  GLU  68           2HG      GLU  68  10.958  -9.653   2.007
  521    HG3  GLU  68           1HG      GLU  68  11.113  -8.718   0.522
  522    H    GLU  69           H        GLU  69   9.361  -7.859   0.440
  523    HA   GLU  69           HA       GLU  69   9.996  -5.948  -1.547
  524    HB2  GLU  69           2HB      GLU  69   8.139  -8.256  -1.331
  525    HB3  GLU  69           1HB      GLU  69   7.812  -7.085  -2.600
  526    HG2  GLU  69           2HG      GLU  69   9.204  -8.333  -3.815
  527    HG3  GLU  69           1HG      GLU  69  10.474  -7.485  -2.933
  528    H    ALA  70           H        ALA  70   7.263  -6.290   0.654
  529    HA   ALA  70           HA       ALA  70   5.505  -4.393  -0.450
  530    HB1  ALA  70           3HB      ALA  70   4.328  -4.535   1.542
  531    HB2  ALA  70           1HB      ALA  70   5.781  -4.777   2.508
  532    HB3  ALA  70           2HB      ALA  70   5.171  -6.081   1.490
  533    H    VAL  71           H        VAL  71   8.212  -4.074   1.788
  534    HA   VAL  71           HA       VAL  71   7.824  -1.236   2.160
  535    HB   VAL  71           HB       VAL  71   9.993  -3.137   3.050
  536   HG11  VAL  71          1HG1      VAL  71   9.962  -0.171   3.076
  537   HG12  VAL  71          2HG1      VAL  71  11.318  -1.291   2.960
  538   HG13  VAL  71          3HG1      VAL  71  10.554  -0.994   4.520
  539   HG21  VAL  71          3HG2      VAL  71   7.557  -2.840   4.082
  540   HG22  VAL  71          1HG2      VAL  71   8.369  -1.523   4.927
  541   HG23  VAL  71          2HG2      VAL  71   8.973  -3.171   5.077
  542    H    THR  72           H        THR  72   9.918  -3.339   0.255
  543    HA   THR  72           HA       THR  72  11.725  -1.391  -0.653
  544    HB   THR  72           HB       THR  72  10.841  -3.984  -1.931
  545    HG1  THR  72           1HG      THR  72  12.057  -4.791  -0.447
  546   HG21  THR  72          3HG2      THR  72  13.197  -2.231  -2.594
  547   HG22  THR  72          1HG2      THR  72  11.876  -2.701  -3.664
  548   HG23  THR  72          2HG2      THR  72  13.030  -3.912  -3.104
  549    H    ALA  73           H        ALA  73   8.566  -2.411  -1.865
  550    HA   ALA  73           HA       ALA  73   8.735  -0.882  -4.281
  551    HB1  ALA  73           3HB      ALA  73   7.389  -2.844  -4.323
  552    HB2  ALA  73           1HB      ALA  73   6.304  -1.462  -4.468
  553    HB3  ALA  73           2HB      ALA  73   6.454  -2.306  -2.927
  554    H    LEU  74           H        LEU  74   7.332  -0.427  -1.052
  555    HA   LEU  74           HA       LEU  74   5.938   1.982  -1.724
  556    HG   LEU  74           HG       LEU  74   4.463   0.263   1.234
  557    HB2  LEU  74           2HB      LEU  74   6.700   0.596   0.825
  558    HB3  LEU  74           1HB      LEU  74   6.078   2.234   0.874
  559   HD11  LEU  74          1HD1      LEU  74   3.861   2.660   0.915
  560   HD12  LEU  74          2HD1      LEU  74   2.642   1.522   0.345
  561   HD13  LEU  74          3HD1      LEU  74   3.699   2.335  -0.809
  562   HD21  LEU  74          3HD2      LEU  74   3.643  -0.913  -0.567
  563   HD22  LEU  74          1HD2      LEU  74   5.357  -0.802  -0.965
  564   HD23  LEU  74          2HD2      LEU  74   4.201   0.282  -1.738
  565    H    LYS  75           H        LYS  75   9.127   1.126  -0.573
  566    HA   LYS  75           HA       LYS  75   9.867   3.861   0.031
  567    HB2  LYS  75           2HB      LYS  75  11.925   3.030   0.777
  568    HB3  LYS  75           1HB      LYS  75  10.771   1.773   1.195
  569    HG2  LYS  75           2HG      LYS  75  11.591   0.308  -0.371
  570    HG3  LYS  75           1HG      LYS  75  12.234   1.589  -1.396
  571    HD2  LYS  75           2HD      LYS  75  14.202   0.907  -0.517
  572    HD3  LYS  75           1HD      LYS  75  13.728   1.980   0.800
  573    HE2  LYS  75           2HE      LYS  75  14.038   0.194   2.114
  574    HE3  LYS  75           1HE      LYS  75  12.479  -0.346   1.494
  575    HZ1  LYS  75           3HZ      LYS  75  14.036  -2.115   1.263
  576    HZ2  LYS  75           1HZ      LYS  75  15.164  -1.118   0.491
  577    HZ3  LYS  75           2HZ      LYS  75  13.718  -1.520  -0.288
  578    H    ASN  76           H        ASN  76   9.979   1.814  -2.764
  579    HA   ASN  76           HA       ASN  76  12.096   3.206  -4.099
  580    HB2  ASN  76           2HB      ASN  76  11.411   0.825  -4.566
  581    HB3  ASN  76           1HB      ASN  76   9.977   1.461  -5.365
  582   HD21  ASN  76          1HD2      ASN  76  10.225   2.661  -7.290
  583   HD22  ASN  76          2HD2      ASN  76  11.653   2.525  -8.249
  584    H    THR  77           H        THR  77  11.058   5.352  -3.537
  585    HA   THR  77           HA       THR  77   9.335   6.189  -5.775
  586    HB   THR  77           HB       THR  77   7.746   6.729  -4.306
  587    HG1  THR  77           1HG      THR  77   8.215   8.791  -4.191
  588   HG21  THR  77          3HG2      THR  77   7.866   6.461  -1.954
  589   HG22  THR  77          1HG2      THR  77   9.629   6.494  -1.983
  590   HG23  THR  77          2HG2      THR  77   8.760   5.135  -2.698
  591    H    SER  78           H        SER  78   9.838   8.056  -6.803
  592    HA   SER  78           HA       SER  78  12.114   9.617  -5.776
  593    HG   SER  78           HG       SER  78  13.067   7.233  -7.520
  594    HB2  SER  78           2HB      SER  78  11.701   8.526  -8.558
  595    HB3  SER  78           1HB      SER  78  12.749   9.912  -8.254
  596    H    ASP  79           H        ASP  79  10.158   9.954  -8.736
  597    HA   ASP  79           HA       ASP  79   9.568  12.706  -7.973
  598    HB2  ASP  79           2HB      ASP  79   9.163  11.188 -10.558
  599    HB3  ASP  79           1HB      ASP  79   8.665  12.860 -10.319
  600    H    PHE  80           H        PHE  80   7.715   9.936  -9.281
  601    HA   PHE  80           HA       PHE  80   5.425  10.826  -7.661
  602    HD1  PHE  80           2HD      PHE  80   2.487  10.079  -8.644
  603    HD2  PHE  80           1HD      PHE  80   5.025  13.062 -10.310
  604    HE1  PHE  80           2HE      PHE  80   0.744  11.771  -8.268
  605    HE2  PHE  80           1HE      PHE  80   3.282  14.758  -9.942
  606    HZ   PHE  80           HZ       PHE  80   1.139  14.112  -8.916
  607    HB2  PHE  80           2HB      PHE  80   5.587  10.773 -10.504
  608    HB3  PHE  80           1HB      PHE  80   4.466   9.507 -10.005
  609    H    VAL  81           H        VAL  81   3.696   9.013  -7.527
  610    HA   VAL  81           HA       VAL  81   4.871   6.343  -7.539
  611    HB   VAL  81           HB       VAL  81   3.570   7.616  -5.119
  612   HG11  VAL  81          1HG1      VAL  81   2.770   5.467  -4.983
  613   HG12  VAL  81          2HG1      VAL  81   4.300   5.313  -4.119
  614   HG13  VAL  81          3HG1      VAL  81   4.175   4.775  -5.793
  615   HG21  VAL  81          3HG2      VAL  81   6.376   6.682  -5.665
  616   HG22  VAL  81          1HG2      VAL  81   5.760   6.987  -4.041
  617   HG23  VAL  81          2HG2      VAL  81   5.834   8.300  -5.217
  618    H    TYR  82           H        TYR  82   3.459   5.063  -8.598
  619    HA   TYR  82           HA       TYR  82   0.628   5.848  -8.635
  620    HD1  TYR  82           1HD      TYR  82   0.241   2.316 -10.495
  621    HD2  TYR  82           2HD      TYR  82  -0.397   6.407 -11.470
  622    HE1  TYR  82           1HE      TYR  82  -1.914   1.732 -11.504
  623    HE2  TYR  82           2HE      TYR  82  -2.562   5.834 -12.479
  624    HH   TYR  82           HH       TYR  82  -4.102   2.902 -12.005
  625    HB2  TYR  82           2HB      TYR  82   1.810   5.602 -10.816
  626    HB3  TYR  82           1HB      TYR  82   2.063   3.902 -10.437
  627    H    LEU  83           H        LEU  83  -0.247   4.980  -6.876
  628    HA   LEU  83           HA       LEU  83   0.346   2.309  -5.994
  629    HG   LEU  83           HG       LEU  83  -1.047   1.653  -3.929
  630    HB2  LEU  83           2HB      LEU  83  -0.355   4.481  -4.656
  631    HB3  LEU  83           1HB      LEU  83  -1.967   3.849  -4.931
  632   HD11  LEU  83          1HD1      LEU  83   1.328   2.449  -4.014
  633   HD12  LEU  83          2HD1      LEU  83   0.806   1.831  -2.447
  634   HD13  LEU  83          3HD1      LEU  83   0.929   3.571  -2.713
  635   HD21  LEU  83          3HD2      LEU  83  -1.234   2.868  -1.564
  636   HD22  LEU  83          1HD2      LEU  83  -2.632   2.575  -2.598
  637   HD23  LEU  83          2HD2      LEU  83  -1.861   4.160  -2.590
  638    H    LYS  84           H        LYS  84  -0.703   0.493  -6.421
  639    HA   LYS  84           HA       LYS  84  -3.291   0.634  -7.814
  640    HB2  LYS  84           2HB      LYS  84  -0.875  -0.954  -8.337
  641    HB3  LYS  84           1HB      LYS  84  -2.372  -1.869  -8.377
  642    HG2  LYS  84           2HG      LYS  84  -2.582   0.623  -9.841
  643    HG3  LYS  84           1HG      LYS  84  -1.279  -0.403 -10.444
  644    HD2  LYS  84           2HD      LYS  84  -3.265  -0.969 -11.646
  645    HD3  LYS  84           1HD      LYS  84  -2.916  -2.292 -10.532
  646    HE2  LYS  84           2HE      LYS  84  -5.271  -1.838 -10.466
  647    HE3  LYS  84           1HE      LYS  84  -4.557  -1.313  -8.943
  648    HZ1  LYS  84           3HZ      LYS  84  -6.172   0.275  -9.907
  649    HZ2  LYS  84           1HZ      LYS  84  -5.128   0.508 -11.216
  650    HZ3  LYS  84           2HZ      LYS  84  -4.641   0.944  -9.657
  651    H    VAL  85           H        VAL  85  -4.908   0.107  -6.468
  652    HA   VAL  85           HA       VAL  85  -4.376  -2.014  -4.496
  653    HB   VAL  85           HB       VAL  85  -6.102  -0.996  -3.059
  654   HG11  VAL  85          1HG1      VAL  85  -4.721   0.649  -2.142
  655   HG12  VAL  85          2HG1      VAL  85  -4.082   1.122  -3.716
  656   HG13  VAL  85          3HG1      VAL  85  -3.606  -0.417  -2.997
  657   HG21  VAL  85          3HG2      VAL  85  -7.369   0.147  -4.862
  658   HG22  VAL  85          1HG2      VAL  85  -6.061   1.323  -4.988
  659   HG23  VAL  85          2HG2      VAL  85  -6.994   1.197  -3.496
  660    H    ALA  86           H        ALA  86  -5.658  -3.745  -4.442
  661    HA   ALA  86           HA       ALA  86  -7.792  -3.941  -6.435
  662    HB1  ALA  86           3HB      ALA  86  -7.660  -6.405  -5.865
  663    HB2  ALA  86           1HB      ALA  86  -6.247  -6.006  -4.889
  664    HB3  ALA  86           2HB      ALA  86  -6.233  -5.703  -6.626
  665    H    LYS  87           H        LYS  87  -9.844  -4.934  -5.895
  666    HA   LYS  87           HA       LYS  87 -10.758  -4.131  -3.243
  667    HB2  LYS  87           2HB      LYS  87 -11.987  -4.473  -5.886
  668    HB3  LYS  87           1HB      LYS  87 -12.973  -5.084  -4.565
  669    HG2  LYS  87           2HG      LYS  87 -11.844  -2.456  -4.017
  670    HG3  LYS  87           1HG      LYS  87 -12.879  -2.487  -5.446
  671    HD2  LYS  87           2HD      LYS  87 -13.800  -3.801  -2.924
  672    HD3  LYS  87           1HD      LYS  87 -13.909  -2.047  -3.082
  673    HE2  LYS  87           2HE      LYS  87 -15.237  -2.298  -5.109
  674    HE3  LYS  87           1HE      LYS  87 -15.094  -4.052  -5.001
  675    HZ1  LYS  87           3HZ      LYS  87 -16.444  -2.295  -3.021
  676    HZ2  LYS  87           1HZ      LYS  87 -16.292  -3.975  -2.896
  677    HZ3  LYS  87           2HZ      LYS  87 -17.214  -3.299  -4.142
  678    HA   PRO  88           HA       PRO  88 -10.722  -8.292  -1.704
  679    HB2  PRO  88           2HB      PRO  88 -12.506  -8.002   0.338
  680    HB3  PRO  88           1HB      PRO  88 -10.837  -7.434   0.411
  681    HG2  PRO  88           2HG      PRO  88 -13.341  -5.901  -0.130
  682    HG3  PRO  88           1HG      PRO  88 -11.920  -5.434   0.823
  683    HD2  PRO  88           2HD      PRO  88 -12.376  -4.546  -1.709
  684    HD3  PRO  88           1HD      PRO  88 -10.750  -4.750  -1.030
  685    H    THR  89           H        THR  89 -12.078 -10.158  -1.430
  686    HA   THR  89           HA       THR  89 -14.759  -9.944  -2.621
  687    HB   THR  89           HB       THR  89 -12.853 -12.199  -3.259
  688    HG1  THR  89           1HG      THR  89 -11.886 -10.706  -4.400
  689   HG21  THR  89          3HG2      THR  89 -14.795 -11.613  -5.276
  690   HG22  THR  89          1HG2      THR  89 -15.594 -11.889  -3.728
  691   HG23  THR  89          2HG2      THR  89 -14.513 -13.112  -4.392
  692    H    GLY  90           H        GLY  90 -16.283 -10.872  -1.409
  693    HA2  GLY  90           2HA      GLY  90 -15.576 -12.288   0.986
  694    HA3  GLY  90           1HA      GLY  90 -17.202 -11.935   0.423
  695    H    SER  91           H        SER  91 -15.142 -14.378   1.132
  696    HA   SER  91           HA       SER  91 -15.773 -16.208  -0.994
  697    HG   SER  91           HG       SER  91 -13.899 -17.298   2.444
  698    HB2  SER  91           2HB      SER  91 -14.679 -17.900   0.486
  699    HB3  SER  91           1HB      SER  91 -13.674 -16.487   0.176
  700    H    HIS  92           H        HIS  92 -16.918 -15.666   2.317
  701    HA   HIS  92           HA       HIS  92 -18.668 -17.908   2.383
  702    HD1  HIS  92           1HD      HIS  92 -21.473 -16.963   4.085
  703    HD2  HIS  92           2HD      HIS  92 -18.147 -18.435   6.094
  704    HE1  HIS  92           1HE      HIS  92 -22.367 -18.656   5.713
  705    HE2  HIS  92           2HE      HIS  92 -20.346 -19.466   6.982
  706    HB2  HIS  92           2HB      HIS  92 -17.709 -16.437   4.332
  707    HB3  HIS  92           1HB      HIS  92 -19.137 -15.451   4.039
  708    HA   ARG 301           HA       ARG 301   1.723 -10.835   9.966
  709    HE   ARG 301           HE       ARG 301  -3.465 -11.613  11.213
  710    H1   ARG 301           1HT      ARG 301   2.408 -12.501  12.289
  711    H2   ARG 301           2HT      ARG 301   3.257 -12.544  10.798
  712    H3   ARG 301           3HT      ARG 301   1.593 -12.962  10.853
  713    HB2  ARG 301           2HB      ARG 301   0.994 -10.753  12.904
  714    HB3  ARG 301           1HB      ARG 301   0.525  -9.539  11.722
  715    HG2  ARG 301           2HG      ARG 301  -0.289 -12.011  10.664
  716    HG3  ARG 301           1HG      ARG 301  -0.736 -12.027  12.371
  717    HD2  ARG 301           2HD      ARG 301  -1.498  -9.519  11.640
  718    HD3  ARG 301           1HD      ARG 301  -1.791 -10.418  10.153
  719   HH11  ARG 301          1HH1      ARG 301  -1.808  -9.569  13.528
  720   HH12  ARG 301          2HH1      ARG 301  -3.017  -9.768  14.750
  721   HH21  ARG 301          1HH2      ARG 301  -5.052 -11.868  12.829
  722   HH22  ARG 301          2HH2      ARG 301  -4.857 -11.071  14.354
  723    H    ARG 302           H        ARG 302   2.892  -9.038   9.598
  724    HA   ARG 302           HA       ARG 302   4.659  -7.985  11.667
  725    HE   ARG 302           HE       ARG 302   8.366 -10.114  11.192
  726    HB2  ARG 302           2HB      ARG 302   5.913  -9.707  10.272
  727    HB3  ARG 302           1HB      ARG 302   5.744  -8.595   8.921
  728    HG2  ARG 302           2HG      ARG 302   6.979  -6.893  10.152
  729    HG3  ARG 302           1HG      ARG 302   7.138  -7.994  11.522
  730    HD2  ARG 302           2HD      ARG 302   8.203  -8.500   8.748
  731    HD3  ARG 302           1HD      ARG 302   9.161  -7.919  10.108
  732   HH11  ARG 302          1HH1      ARG 302   9.104  -9.730   7.784
  733   HH12  ARG 302          2HH1      ARG 302   9.537 -11.391   7.572
  734   HH21  ARG 302          1HH2      ARG 302   8.942 -12.297  10.896
  735   HH22  ARG 302          2HH2      ARG 302   9.447 -12.846   9.334
  736    H    GLU 303           H        GLU 303   4.788  -5.822  11.630
  737    HA   GLU 303           HA       GLU 303   3.839  -4.412   9.219
  738    HB2  GLU 303           2HB      GLU 303   3.415  -3.341  11.999
  739    HB3  GLU 303           1HB      GLU 303   2.607  -2.876  10.509
  740    HG2  GLU 303           2HG      GLU 303   1.467  -5.047  10.462
  741    HG3  GLU 303           1HG      GLU 303   2.262  -5.486  11.973
  742    H    THR 304           H        THR 304   5.002  -2.660   8.558
  743    HA   THR 304           HA       THR 304   7.070  -1.560  10.290
  744    HB   THR 304           HB       THR 304   7.582  -3.358   8.042
  745    HG1  THR 304           1HG      THR 304   8.692  -3.945   9.731
  746   HG21  THR 304          3HG2      THR 304   9.141  -0.791   8.146
  747   HG22  THR 304          1HG2      THR 304   8.129  -1.357   6.817
  748   HG23  THR 304          2HG2      THR 304   9.596  -2.236   7.243
  749    H    GLN 305           H        GLN 305   7.663   0.538   9.798
  750    HA   GLN 305           HA       GLN 305   5.805   2.006   8.170
  751    HB2  GLN 305           2HB      GLN 305   7.998   2.692  10.055
  752    HB3  GLN 305           1HB      GLN 305   7.575   3.894   8.842
  753    HG2  GLN 305           2HG      GLN 305   5.368   4.077   9.645
  754    HG3  GLN 305           1HG      GLN 305   5.529   2.629  10.636
  755   HE21  GLN 305          1HE2      GLN 305   6.601   5.961  10.262
  756   HE22  GLN 305          2HE2      GLN 305   6.996   6.212  11.925
  757    H    VAL 306           H        VAL 306   6.310   3.360   6.409
  758    HA   VAL 306           HA       VAL 306   8.861   2.860   5.056
  759    HB   VAL 306           HB       VAL 306   7.624   2.619   2.877
  760   HG11  VAL 306          1HG1      VAL 306   7.253   0.263   3.141
  761   HG12  VAL 306          2HG1      VAL 306   7.058   0.440   4.885
  762   HG13  VAL 306          3HG1      VAL 306   8.630   0.726   4.139
  763   HG21  VAL 306          3HG2      VAL 306   5.285   2.404   4.759
  764   HG22  VAL 306          1HG2      VAL 306   5.261   1.712   3.136
  765   HG23  VAL 306          2HG2      VAL 306   5.467   3.450   3.350
  Start of MODEL   18
    1    HA   MET   1           HA       MET   1  -8.884   2.631  -8.018
    2    H1   MET   1           1HT      MET   1  -7.920  -0.094  -8.586
    3    H2   MET   1           2HT      MET   1  -8.240   1.132  -9.743
    4    H3   MET   1           3HT      MET   1  -9.519   0.487  -8.800
    5    HB2  MET   1           2HB      MET   1  -8.587   0.140  -6.441
    6    HB3  MET   1           1HB      MET   1  -8.014   1.609  -5.667
    7    HG2  MET   1           2HG      MET   1 -10.080   2.367  -5.304
    8    HG3  MET   1           1HG      MET   1 -10.645   1.882  -6.902
    9    HE1  MET   1           3HE      MET   1 -10.437  -1.359  -7.032
   10    HE2  MET   1           1HE      MET   1 -11.639  -0.177  -7.548
   11    HE3  MET   1           2HE      MET   1 -12.115  -1.527  -6.519
   12    H    GLU   2           H        GLU   2  -7.280   3.942  -8.640
   13    HA   GLU   2           HA       GLU   2  -4.537   3.276  -7.793
   14    HB2  GLU   2           2HB      GLU   2  -3.732   4.514  -9.798
   15    HB3  GLU   2           1HB      GLU   2  -4.620   3.048 -10.189
   16    HG2  GLU   2           2HG      GLU   2  -6.213   5.524 -10.077
   17    HG3  GLU   2           1HG      GLU   2  -5.034   5.418 -11.382
   18    H    ILE   3           H        ILE   3  -3.133   5.161  -7.408
   19    HA   ILE   3           HA       ILE   3  -4.493   7.696  -6.947
   20    HB   ILE   3           HB       ILE   3  -2.896   6.227  -4.832
   21   HG12  ILE   3          2HG1      ILE   3  -5.231   6.867  -3.635
   22   HG13  ILE   3          1HG1      ILE   3  -5.796   6.653  -5.287
   23   HG21  ILE   3          1HG2      ILE   3  -4.048   9.008  -4.840
   24   HG22  ILE   3          2HG2      ILE   3  -2.345   8.556  -4.771
   25   HG23  ILE   3          3HG2      ILE   3  -3.408   8.193  -3.412
   26   HD11  ILE   3          3HD1      ILE   3  -4.981   4.682  -3.320
   27   HD12  ILE   3          1HD1      ILE   3  -4.209   4.449  -4.887
   28   HD13  ILE   3          2HD1      ILE   3  -5.967   4.499  -4.771
   29    H    LYS   4           H        LYS   4  -3.170   9.381  -7.560
   30    HA   LYS   4           HA       LYS   4  -0.413   8.655  -8.253
   31    HB2  LYS   4           2HB      LYS   4  -0.512  10.870  -9.554
   32    HB3  LYS   4           1HB      LYS   4  -1.429   9.507 -10.170
   33    HG2  LYS   4           2HG      LYS   4  -3.445  10.478  -9.020
   34    HG3  LYS   4           1HG      LYS   4  -2.472  11.918  -8.708
   35    HD2  LYS   4           2HD      LYS   4  -2.647  12.629 -10.829
   36    HD3  LYS   4           1HD      LYS   4  -2.376  11.015 -11.488
   37    HE2  LYS   4           2HE      LYS   4  -4.985  11.730 -10.198
   38    HE3  LYS   4           1HE      LYS   4  -4.661  12.163 -11.875
   39    HZ1  LYS   4           3HZ      LYS   4  -4.326   9.859 -12.407
   40    HZ2  LYS   4           1HZ      LYS   4  -5.823  10.027 -11.636
   41    HZ3  LYS   4           2HZ      LYS   4  -4.500   9.403 -10.787
   42    H    LEU   5           H        LEU   5   0.562   8.834  -6.304
   43    HA   LEU   5           HA       LEU   5   0.474  11.390  -4.884
   44    HG   LEU   5           HG       LEU   5  -0.839   9.270  -3.620
   45    HB2  LEU   5           2HB      LEU   5   1.532   8.670  -4.203
   46    HB3  LEU   5           1HB      LEU   5   2.053  10.073  -3.288
   47   HD11  LEU   5          1HD1      LEU   5   0.117   7.505  -2.402
   48   HD12  LEU   5          2HD1      LEU   5  -0.578   8.581  -1.190
   49   HD13  LEU   5          3HD1      LEU   5   1.161   8.591  -1.484
   50   HD21  LEU   5          3HD2      LEU   5   0.580  11.305  -1.918
   51   HD22  LEU   5          1HD2      LEU   5  -1.063  10.756  -1.589
   52   HD23  LEU   5          2HD2      LEU   5  -0.694  11.575  -3.107
   53    H    ILE   6           H        ILE   6   2.015  12.893  -4.965
   54    HA   ILE   6           HA       ILE   6   4.331  12.411  -6.660
   55    HB   ILE   6           HB       ILE   6   3.123  14.442  -7.095
   56   HG12  ILE   6          2HG1      ILE   6   5.790  14.301  -6.930
   57   HG13  ILE   6          1HG1      ILE   6   4.949  15.761  -7.435
   58   HG21  ILE   6          1HG2      ILE   6   1.992  15.227  -5.327
   59   HG22  ILE   6          2HG2      ILE   6   3.415  16.255  -5.150
   60   HG23  ILE   6          3HG2      ILE   6   3.257  14.793  -4.177
   61   HD11  ILE   6          3HD1      ILE   6   5.347  16.835  -5.427
   62   HD12  ILE   6          1HD1      ILE   6   6.838  15.933  -5.699
   63   HD13  ILE   6          2HD1      ILE   6   5.637  15.327  -4.559
   64    H    LYS   7           H        LYS   7   6.325  12.051  -5.940
   65    HA   LYS   7           HA       LYS   7   6.911  11.538  -3.262
   66    HB2  LYS   7           2HB      LYS   7   8.172  10.596  -5.156
   67    HB3  LYS   7           1HB      LYS   7   8.846  12.184  -5.488
   68    HG2  LYS   7           2HG      LYS   7  10.515  11.022  -4.321
   69    HG3  LYS   7           1HG      LYS   7   9.799  12.120  -3.141
   70    HD2  LYS   7           2HD      LYS   7   8.302  10.163  -2.481
   71    HD3  LYS   7           1HD      LYS   7   9.404   9.154  -3.419
   72    HE2  LYS   7           2HE      LYS   7  10.726  10.966  -1.531
   73    HE3  LYS   7           1HE      LYS   7   9.691   9.756  -0.774
   74    HZ1  LYS   7           3HZ      LYS   7  10.894   8.040  -2.015
   75    HZ2  LYS   7           1HZ      LYS   7  11.925   8.921  -1.002
   76    HZ3  LYS   7           2HZ      LYS   7  11.917   9.219  -2.667
   77    H    GLY   8           H        GLY   8   7.346  12.791  -1.589
   78    HA2  GLY   8           2HA      GLY   8   8.321  15.539  -2.096
   79    HA3  GLY   8           1HA      GLY   8   7.147  15.165  -0.844
   80    HA   PRO   9           HA       PRO   9  11.502  15.358   0.984
   81    HB2  PRO   9           2HB      PRO   9   9.917  16.695   3.111
   82    HB3  PRO   9           1HB      PRO   9  11.475  17.150   2.412
   83    HG2  PRO   9           2HG      PRO   9   9.261  18.504   1.805
   84    HG3  PRO   9           1HG      PRO   9  10.500  18.181   0.579
   85    HD2  PRO   9           2HD      PRO   9   7.861  16.839   1.009
   86    HD3  PRO   9           1HD      PRO   9   8.666  17.281  -0.511
   87    H    LYS  10           H        LYS  10   8.355  14.712   2.500
   88    HA   LYS  10           HA       LYS  10   9.493  12.974   4.502
   89    HB2  LYS  10           2HB      LYS  10   6.763  13.939   3.809
   90    HB3  LYS  10           1HB      LYS  10   6.878  12.418   4.683
   91    HG2  LYS  10           2HG      LYS  10   8.368  14.807   5.671
   92    HG3  LYS  10           1HG      LYS  10   6.636  14.654   5.979
   93    HD2  LYS  10           2HD      LYS  10   6.941  13.057   7.525
   94    HD3  LYS  10           1HD      LYS  10   8.145  12.214   6.546
   95    HE2  LYS  10           2HE      LYS  10   9.802  13.953   7.216
   96    HE3  LYS  10           1HE      LYS  10   8.589  14.619   8.311
   97    HZ1  LYS  10           3HZ      LYS  10   9.722  11.874   8.430
   98    HZ2  LYS  10           1HZ      LYS  10   8.532  12.487   9.467
   99    HZ3  LYS  10           2HZ      LYS  10  10.089  13.148   9.481
  100    H    GLY  11           H        GLY  11   7.089  12.395   1.917
  101    HA2  GLY  11           2HA      GLY  11   7.788  10.594   0.288
  102    HA3  GLY  11           1HA      GLY  11   8.119   9.632   1.721
  103    H    LEU  12           H        LEU  12   6.575   8.237   2.263
  104    HA   LEU  12           HA       LEU  12   3.926   8.512   1.102
  105    HG   LEU  12           HG       LEU  12   5.907   6.730   0.269
  106    HB2  LEU  12           2HB      LEU  12   5.153   6.316   2.766
  107    HB3  LEU  12           1HB      LEU  12   3.558   6.252   2.047
  108   HD11  LEU  12          1HD1      LEU  12   5.567   4.394   1.932
  109   HD12  LEU  12          2HD1      LEU  12   6.897   4.836   0.862
  110   HD13  LEU  12          3HD1      LEU  12   5.492   3.988   0.218
  111   HD21  LEU  12          3HD2      LEU  12   4.227   4.963  -0.944
  112   HD22  LEU  12          1HD2      LEU  12   4.149   6.715  -1.122
  113   HD23  LEU  12          2HD2      LEU  12   3.106   5.901   0.042
  114    H    GLY  13           H        GLY  13   5.343   8.134   4.360
  115    HA2  GLY  13           2HA      GLY  13   4.662   9.137   6.335
  116    HA3  GLY  13           1HA      GLY  13   3.319   9.867   5.475
  117    H    PHE  14           H        PHE  14   4.093   6.409   5.658
  118    HA   PHE  14           HA       PHE  14   2.146   5.871   7.677
  119    HD1  PHE  14           2HD      PHE  14   2.132   3.036   4.809
  120    HD2  PHE  14           1HD      PHE  14   0.745   6.896   3.664
  121    HE1  PHE  14           2HE      PHE  14   2.499   2.463   2.448
  122    HE2  PHE  14           1HE      PHE  14   1.104   6.326   1.300
  123    HZ   PHE  14           HZ       PHE  14   1.984   4.108   0.688
  124    HB2  PHE  14           2HB      PHE  14   0.599   4.543   6.277
  125    HB3  PHE  14           1HB      PHE  14   0.578   6.252   5.872
  126    H    SER  15           H        SER  15   1.626   3.229   7.356
  127    HA   SER  15           HA       SER  15   4.229   1.963   6.910
  128    HG   SER  15           HG       SER  15   2.463   2.962   9.722
  129    HB2  SER  15           2HB      SER  15   3.329   0.417   8.888
  130    HB3  SER  15           1HB      SER  15   4.293   1.854   9.204
  131    H    ILE  16           H        ILE  16   3.873  -0.550   6.933
  132    HA   ILE  16           HA       ILE  16   1.278  -1.402   5.958
  133    HB   ILE  16           HB       ILE  16   1.842  -2.035   3.798
  134   HG12  ILE  16          2HG1      ILE  16   4.089  -3.008   4.462
  135   HG13  ILE  16          1HG1      ILE  16   3.978  -2.319   2.848
  136   HG21  ILE  16          1HG2      ILE  16   1.521   0.344   3.869
  137   HG22  ILE  16          2HG2      ILE  16   2.734  -0.051   2.652
  138   HG23  ILE  16          3HG2      ILE  16   3.232   0.594   4.216
  139   HD11  ILE  16          3HD1      ILE  16   5.568  -0.848   3.273
  140   HD12  ILE  16          1HD1      ILE  16   5.901  -1.786   4.731
  141   HD13  ILE  16          2HD1      ILE  16   4.835  -0.381   4.809
  142    H    ALA  17           H        ALA  17   1.380  -3.732   5.284
  143    HA   ALA  17           HA       ALA  17   3.477  -5.300   6.596
  144    HB1  ALA  17           3HB      ALA  17   0.620  -5.202   7.322
  145    HB2  ALA  17           1HB      ALA  17   2.014  -5.710   8.275
  146    HB3  ALA  17           2HB      ALA  17   1.289  -6.824   7.117
  147    H    GLY  18           H        GLY  18   3.307  -7.692   5.696
  148    HA2  GLY  18           2HA      GLY  18   1.731  -8.384   3.577
  149    HA3  GLY  18           1HA      GLY  18   2.961  -7.393   2.838
  150    H    GLY  19           H        GLY  19   2.122 -10.470   2.921
  151    HA2  GLY  19           2HA      GLY  19   3.622 -12.060   1.967
  152    HA3  GLY  19           1HA      GLY  19   4.935 -11.312   2.859
  153    H    VAL  20           H        VAL  20   4.446 -14.064   2.802
  154    HA   VAL  20           HA       VAL  20   2.983 -14.987   5.032
  155    HB   VAL  20           HB       VAL  20   4.415 -17.064   4.845
  156   HG11  VAL  20          1HG1      VAL  20   3.471 -17.740   2.677
  157   HG12  VAL  20          2HG1      VAL  20   3.070 -16.056   2.341
  158   HG13  VAL  20          3HG1      VAL  20   2.297 -16.895   3.687
  159   HG21  VAL  20          3HG2      VAL  20   6.392 -15.772   3.895
  160   HG22  VAL  20          1HG2      VAL  20   5.531 -15.793   2.357
  161   HG23  VAL  20          2HG2      VAL  20   6.005 -17.309   3.124
  162    H    GLY  21           H        GLY  21   3.571 -15.376   7.158
  163    HA2  GLY  21           2HA      GLY  21   4.962 -15.468   9.039
  164    HA3  GLY  21           1HA      GLY  21   6.323 -15.017   8.026
  165    H    ASN  22           H        ASN  22   4.516 -12.735   7.026
  166    HA   ASN  22           HA       ASN  22   4.610 -10.951   9.344
  167    HB2  ASN  22           2HB      ASN  22   5.407  -9.205   7.474
  168    HB3  ASN  22           1HB      ASN  22   6.561 -10.133   8.416
  169   HD21  ASN  22          1HD2      ASN  22   8.173 -10.765   7.188
  170   HD22  ASN  22          2HD2      ASN  22   8.049 -11.367   5.575
  171    H    GLN  23           H        GLN  23   2.514 -12.364   7.545
  172    HA   GLN  23           HA       GLN  23   1.174 -10.587   5.924
  173    HB2  GLN  23           2HB      GLN  23   0.131 -12.852   7.619
  174    HB3  GLN  23           1HB      GLN  23  -0.856 -11.991   6.448
  175    HG2  GLN  23           2HG      GLN  23   0.678 -12.683   4.666
  176    HG3  GLN  23           1HG      GLN  23   1.634 -13.570   5.851
  177   HE21  GLN  23          1HE2      GLN  23   1.147 -15.631   6.170
  178   HE22  GLN  23          2HE2      GLN  23  -0.321 -16.406   5.694
  179    H    HIS  24           H        HIS  24  -0.496  -9.174   6.143
  180    HA   HIS  24           HA       HIS  24  -0.837  -7.951   8.767
  181    HD1  HIS  24           1HD      HIS  24  -0.469  -5.030   8.867
  182    HD2  HIS  24           2HD      HIS  24  -4.124  -5.745   7.045
  183    HE1  HIS  24           1HE      HIS  24  -2.003  -3.275   9.756
  184    HE2  HIS  24           2HE      HIS  24  -4.258  -3.804   8.761
  185    HB2  HIS  24           2HB      HIS  24  -0.410  -6.562   6.724
  186    HB3  HIS  24           1HB      HIS  24  -1.964  -7.077   6.101
  187    H    ILE  25           H        ILE  25  -2.607  -9.853   6.447
  188    HA   ILE  25           HA       ILE  25  -4.862  -9.981   8.310
  189    HB   ILE  25           HB       ILE  25  -5.084  -8.424   6.139
  190   HG12  ILE  25          2HG1      ILE  25  -7.295 -10.191   7.201
  191   HG13  ILE  25          1HG1      ILE  25  -6.732  -8.695   7.941
  192   HG21  ILE  25          1HG2      ILE  25  -6.128 -11.072   5.159
  193   HG22  ILE  25          2HG2      ILE  25  -4.653 -10.289   4.589
  194   HG23  ILE  25          3HG2      ILE  25  -6.216  -9.517   4.330
  195   HD11  ILE  25          3HD1      ILE  25  -8.087  -8.992   5.273
  196   HD12  ILE  25          1HD1      ILE  25  -7.416  -7.484   5.896
  197   HD13  ILE  25          2HD1      ILE  25  -8.754  -8.268   6.736
  198    HA   PRO  26           HA       PRO  26  -4.316 -14.343   7.780
  199    HB2  PRO  26           2HB      PRO  26  -6.864 -15.135   8.462
  200    HB3  PRO  26           1HB      PRO  26  -5.598 -14.730   9.625
  201    HG2  PRO  26           2HG      PRO  26  -7.854 -13.046   8.616
  202    HG3  PRO  26           1HG      PRO  26  -7.218 -13.196  10.264
  203    HD2  PRO  26           2HD      PRO  26  -6.608 -11.096   8.714
  204    HD3  PRO  26           1HD      PRO  26  -5.420 -11.797   9.832
  205    H    GLY  27           H        GLY  27  -4.190 -15.295   5.854
  206    HA2  GLY  27           2HA      GLY  27  -5.247 -16.549   4.112
  207    HA3  GLY  27           1HA      GLY  27  -6.616 -15.451   4.196
  208    H    ASP  28           H        ASP  28  -5.379 -12.984   4.028
  209    HA   ASP  28           HA       ASP  28  -4.439 -13.059   1.256
  210    HB2  ASP  28           2HB      ASP  28  -6.230 -11.367   2.668
  211    HB3  ASP  28           1HB      ASP  28  -4.854 -10.383   2.187
  212    H    ASN  29           H        ASN  29  -2.322 -13.131   1.018
  213    HA   ASN  29           HA       ASN  29  -0.513 -11.986   2.976
  214    HB2  ASN  29           2HB      ASN  29   0.305 -13.167   0.330
  215    HB3  ASN  29           1HB      ASN  29   1.234 -13.072   1.821
  216   HD21  ASN  29          1HD2      ASN  29   1.301 -14.816   3.054
  217   HD22  ASN  29          2HD2      ASN  29   0.230 -16.168   2.949
  218    H    SER  30           H        SER  30  -2.292 -10.279   1.125
  219    HA   SER  30           HA       SER  30  -0.570  -8.884  -0.651
  220    HG   SER  30           HG       SER  30  -3.570  -9.733  -0.849
  221    HB2  SER  30           2HB      SER  30  -2.800  -7.277   0.300
  222    HB3  SER  30           1HB      SER  30  -2.475  -7.889  -1.319
  223    H    ILE  31           H        ILE  31  -0.621  -6.294  -0.298
  224    HA   ILE  31           HA       ILE  31   0.769  -5.918   2.264
  225    HB   ILE  31           HB       ILE  31   0.893  -4.095  -0.135
  226   HG12  ILE  31          2HG1      ILE  31   2.148  -5.724  -1.055
  227   HG13  ILE  31          1HG1      ILE  31   3.384  -5.154   0.048
  228   HG21  ILE  31          1HG2      ILE  31   2.788  -3.080   0.975
  229   HG22  ILE  31          2HG2      ILE  31   2.620  -4.203   2.325
  230   HG23  ILE  31          3HG2      ILE  31   1.359  -3.011   2.007
  231   HD11  ILE  31          3HD1      ILE  31   2.028  -6.982   1.569
  232   HD12  ILE  31          1HD1      ILE  31   3.525  -7.279   0.691
  233   HD13  ILE  31          2HD1      ILE  31   1.977  -7.694  -0.038
  234    H    TYR  32           H        TYR  32  -0.510  -5.193   3.798
  235    HA   TYR  32           HA       TYR  32  -2.587  -3.205   3.160
  236    HD1  TYR  32           2HD      TYR  32  -2.227  -6.648   3.251
  237    HD2  TYR  32           1HD      TYR  32  -5.633  -4.527   4.663
  238    HE1  TYR  32           2HE      TYR  32  -3.684  -8.200   2.033
  239    HE2  TYR  32           1HE      TYR  32  -7.109  -6.072   3.463
  240    HH   TYR  32           HH       TYR  32  -6.816  -8.629   2.626
  241    HB2  TYR  32           2HB      TYR  32  -2.324  -5.121   5.473
  242    HB3  TYR  32           1HB      TYR  32  -3.555  -3.870   5.385
  243    H    VAL  33           H        VAL  33  -2.808  -1.335   4.393
  244    HA   VAL  33           HA       VAL  33  -0.385  -0.306   5.545
  245    HB   VAL  33           HB       VAL  33  -3.131   0.907   5.206
  246   HG11  VAL  33          1HG1      VAL  33  -0.737   1.931   6.655
  247   HG12  VAL  33          2HG1      VAL  33  -2.448   2.113   7.035
  248   HG13  VAL  33          3HG1      VAL  33  -1.727   3.064   5.738
  249   HG21  VAL  33          3HG2      VAL  33  -1.253   2.407   3.837
  250   HG22  VAL  33          1HG2      VAL  33  -2.362   1.227   3.136
  251   HG23  VAL  33          2HG2      VAL  33  -0.727   0.743   3.586
  252    H    THR  34           H        THR  34   0.148  -0.194   7.637
  253    HA   THR  34           HA       THR  34  -1.751  -1.281   9.587
  254    HB   THR  34           HB       THR  34   0.114  -1.873  10.937
  255    HG1  THR  34           1HG      THR  34   1.661  -0.458  10.964
  256   HG21  THR  34          3HG2      THR  34   0.695  -3.576   9.662
  257   HG22  THR  34          1HG2      THR  34   1.664  -2.523   8.632
  258   HG23  THR  34          2HG2      THR  34  -0.047  -2.767   8.283
  259    H    LYS  35           H        LYS  35   0.107   1.649   8.965
  260    HA   LYS  35           HA       LYS  35  -1.467   3.083  10.916
  261    HB2  LYS  35           2HB      LYS  35   1.503   2.711  11.335
  262    HB3  LYS  35           1HB      LYS  35   0.571   3.981  12.111
  263    HG2  LYS  35           2HG      LYS  35  -0.876   2.157  13.084
  264    HG3  LYS  35           1HG      LYS  35   0.331   1.013  12.495
  265    HD2  LYS  35           2HD      LYS  35   1.143   1.348  14.598
  266    HD3  LYS  35           1HD      LYS  35   1.973   2.663  13.765
  267    HE2  LYS  35           2HE      LYS  35   1.118   3.786  15.571
  268    HE3  LYS  35           1HE      LYS  35  -0.188   4.009  14.408
  269    HZ1  LYS  35           3HZ      LYS  35  -0.099   1.929  16.527
  270    HZ2  LYS  35           1HZ      LYS  35  -1.356   2.151  15.417
  271    HZ3  LYS  35           2HZ      LYS  35  -1.028   3.342  16.572
  272    H    ILE  36           H        ILE  36  -1.933   4.992  10.011
  273    HA   ILE  36           HA       ILE  36  -0.127   6.042   7.958
  274    HB   ILE  36           HB       ILE  36  -2.954   6.885   8.608
  275   HG12  ILE  36          2HG1      ILE  36  -1.783   5.030   6.538
  276   HG13  ILE  36          1HG1      ILE  36  -3.071   4.701   7.691
  277   HG21  ILE  36          1HG2      ILE  36  -1.282   7.604   6.205
  278   HG22  ILE  36          2HG2      ILE  36  -1.480   8.647   7.614
  279   HG23  ILE  36          3HG2      ILE  36  -2.879   8.222   6.628
  280   HD11  ILE  36          3HD1      ILE  36  -4.124   4.905   5.617
  281   HD12  ILE  36          1HD1      ILE  36  -3.185   6.332   5.182
  282   HD13  ILE  36          2HD1      ILE  36  -4.425   6.440   6.431
  283    H    ILE  37           H        ILE  37   1.238   7.636   8.456
  284    HA   ILE  37           HA       ILE  37   1.149   8.985  10.977
  285    HB   ILE  37           HB       ILE  37   2.939   9.209   8.566
  286   HG12  ILE  37          2HG1      ILE  37   4.612   8.613  10.492
  287   HG13  ILE  37          1HG1      ILE  37   3.159   8.097  11.340
  288   HG21  ILE  37          1HG2      ILE  37   4.355  10.729  10.042
  289   HG22  ILE  37          2HG2      ILE  37   2.884  10.988  10.981
  290   HG23  ILE  37          3HG2      ILE  37   2.935  11.437   9.277
  291   HD11  ILE  37          3HD1      ILE  37   3.914   7.093   8.613
  292   HD12  ILE  37          1HD1      ILE  37   2.693   6.447   9.710
  293   HD13  ILE  37          2HD1      ILE  37   4.404   6.306  10.113
  294    H    GLU  38           H        GLU  38   0.707  11.154  11.408
  295    HA   GLU  38           HA       GLU  38  -1.330  12.387   9.938
  296    HB2  GLU  38           2HB      GLU  38   0.479  13.276  12.146
  297    HB3  GLU  38           1HB      GLU  38  -0.511  14.474  11.325
  298    HG2  GLU  38           2HG      GLU  38  -2.359  13.822  12.373
  299    HG3  GLU  38           1HG      GLU  38  -2.025  12.115  12.083
  300    H    GLY  39           H        GLY  39  -1.381  14.200   8.605
  301    HA2  GLY  39           2HA      GLY  39  -0.692  15.540   6.884
  302    HA3  GLY  39           1HA      GLY  39   0.775  15.775   7.815
  303    H    GLY  40           H        GLY  40   0.032  12.526   6.846
  304    HA2  GLY  40           2HA      GLY  40   2.368  12.536   5.105
  305    HA3  GLY  40           1HA      GLY  40   1.504  11.121   5.682
  306    H    ALA  41           H        ALA  41   2.242  11.104   3.116
  307    HA   ALA  41           HA       ALA  41   0.725  12.244   1.144
  308    HB1  ALA  41           3HB      ALA  41   1.546   9.350   1.069
  309    HB2  ALA  41           1HB      ALA  41   2.686  10.683   0.875
  310    HB3  ALA  41           2HB      ALA  41   1.373  10.472  -0.283
  311    H    ALA  42           H        ALA  42  -0.039   9.127   2.748
  312    HA   ALA  42           HA       ALA  42  -2.553   8.837   1.452
  313    HB1  ALA  42           3HB      ALA  42  -2.944   7.105   3.262
  314    HB2  ALA  42           1HB      ALA  42  -1.334   7.508   3.859
  315    HB3  ALA  42           2HB      ALA  42  -1.534   6.858   2.233
  316    H    HIS  43           H        HIS  43  -1.678   9.798   4.773
  317    HA   HIS  43           HA       HIS  43  -4.181  10.230   5.834
  318    HD1  HIS  43           1HD      HIS  43  -3.153  13.928   7.157
  319    HD2  HIS  43           2HD      HIS  43  -3.849  10.373   9.192
  320    HE1  HIS  43           1HE      HIS  43  -4.415  14.578   9.230
  321    HE2  HIS  43           2HE      HIS  43  -4.743  12.422  10.493
  322    HB2  HIS  43           2HB      HIS  43  -2.035  10.358   7.080
  323    HB3  HIS  43           1HB      HIS  43  -1.725  11.920   6.335
  324    H    LYS  44           H        LYS  44  -2.204  12.558   4.002
  325    HA   LYS  44           HA       LYS  44  -4.130  14.657   4.145
  326    HB2  LYS  44           2HB      LYS  44  -1.724  14.258   2.364
  327    HB3  LYS  44           1HB      LYS  44  -2.701  15.720   2.374
  328    HG2  LYS  44           2HG      LYS  44  -1.698  14.839   4.999
  329    HG3  LYS  44           1HG      LYS  44  -0.476  15.381   3.848
  330    HD2  LYS  44           2HD      LYS  44  -2.192  17.370   3.518
  331    HD3  LYS  44           1HD      LYS  44  -2.680  16.901   5.147
  332    HE2  LYS  44           2HE      LYS  44  -0.451  17.234   5.972
  333    HE3  LYS  44           1HE      LYS  44   0.160  17.504   4.341
  334    HZ1  LYS  44           3HZ      LYS  44  -1.788  19.245   5.757
  335    HZ2  LYS  44           1HZ      LYS  44  -1.163  19.513   4.207
  336    HZ3  LYS  44           2HZ      LYS  44  -0.143  19.580   5.554
  337    H    ASP  45           H        ASP  45  -3.372  12.165   1.748
  338    HA   ASP  45           HA       ASP  45  -4.995  13.154  -0.335
  339    HB2  ASP  45           2HB      ASP  45  -3.198  11.310  -0.423
  340    HB3  ASP  45           1HB      ASP  45  -4.468  10.222   0.126
  341    H    GLY  46           H        GLY  46  -5.650  10.534   2.010
  342    HA2  GLY  46           2HA      GLY  46  -7.725  10.341   3.181
  343    HA3  GLY  46           1HA      GLY  46  -8.502  11.248   1.894
  344    H    LYS  47           H        LYS  47  -7.150   9.592  -0.194
  345    HA   LYS  47           HA       LYS  47  -9.170   7.700  -0.603
  346    HB2  LYS  47           2HB      LYS  47  -7.598   8.723  -2.325
  347    HB3  LYS  47           1HB      LYS  47  -6.410   7.536  -1.807
  348    HG2  LYS  47           2HG      LYS  47  -7.405   5.872  -2.923
  349    HG3  LYS  47           1HG      LYS  47  -9.026   6.401  -2.468
  350    HD2  LYS  47           2HD      LYS  47  -7.410   7.913  -4.494
  351    HD3  LYS  47           1HD      LYS  47  -8.355   6.496  -4.954
  352    HE2  LYS  47           2HE      LYS  47 -10.354   7.597  -3.937
  353    HE3  LYS  47           1HE      LYS  47  -9.373   9.042  -3.702
  354    HZ1  LYS  47           3HZ      LYS  47  -9.991   7.766  -6.313
  355    HZ2  LYS  47           1HZ      LYS  47  -9.020   9.135  -6.099
  356    HZ3  LYS  47           2HZ      LYS  47 -10.668   9.200  -5.722
  357    H    LEU  48           H        LEU  48  -5.838   7.258   0.590
  358    HA   LEU  48           HA       LEU  48  -6.302   4.436   1.044
  359    HG   LEU  48           HG       LEU  48  -4.361   3.121   1.070
  360    HB2  LEU  48           2HB      LEU  48  -4.089   5.576   0.317
  361    HB3  LEU  48           1HB      LEU  48  -3.899   5.939   2.022
  362   HD11  LEU  48          1HD1      LEU  48  -2.027   2.748   0.914
  363   HD12  LEU  48          2HD1      LEU  48  -1.657   4.367   1.511
  364   HD13  LEU  48          3HD1      LEU  48  -2.382   4.159  -0.083
  365   HD21  LEU  48          3HD2      LEU  48  -4.045   2.537   3.192
  366   HD22  LEU  48          1HD2      LEU  48  -4.294   4.239   3.578
  367   HD23  LEU  48          2HD2      LEU  48  -2.659   3.613   3.378
  368    H    GLN  49           H        GLN  49  -7.149   3.621   2.801
  369    HA   GLN  49           HA       GLN  49  -6.787   4.951   5.383
  370    HB2  GLN  49           2HB      GLN  49  -9.070   4.707   5.969
  371    HB3  GLN  49           1HB      GLN  49  -9.056   5.452   4.381
  372    HG2  GLN  49           2HG      GLN  49  -9.413   2.495   4.786
  373    HG3  GLN  49           1HG      GLN  49 -10.761   3.629   4.775
  374   HE21  GLN  49          1HE2      GLN  49  -8.689   1.730   2.902
  375   HE22  GLN  49          2HE2      GLN  49  -9.166   2.308   1.345
  376    H    ILE  50           H        ILE  50  -6.675   3.531   7.167
  377    HA   ILE  50           HA       ILE  50  -5.405   1.147   6.922
  378    HB   ILE  50           HB       ILE  50  -6.365   0.487   9.153
  379   HG12  ILE  50          2HG1      ILE  50  -7.513   2.977   9.887
  380   HG13  ILE  50          1HG1      ILE  50  -8.319   2.458   8.411
  381   HG21  ILE  50          1HG2      ILE  50  -4.325   1.828   8.915
  382   HG22  ILE  50          2HG2      ILE  50  -5.228   2.252  10.369
  383   HG23  ILE  50          3HG2      ILE  50  -5.298   3.299   8.951
  384   HD11  ILE  50          3HD1      ILE  50  -8.069   0.863  10.950
  385   HD12  ILE  50          1HD1      ILE  50  -8.857   0.320   9.468
  386   HD13  ILE  50          2HD1      ILE  50  -9.514   1.688  10.367
  387    H    GLY  51           H        GLY  51  -5.885  -0.998   6.549
  388    HA2  GLY  51           2HA      GLY  51  -7.425  -2.835   6.554
  389    HA3  GLY  51           1HA      GLY  51  -8.721  -1.711   6.210
  390    H    ASP  52           H        ASP  52  -6.821  -0.412   4.104
  391    HA   ASP  52           HA       ASP  52  -7.792  -1.985   1.949
  392    HB2  ASP  52           2HB      ASP  52  -6.458  -0.313   0.552
  393    HB3  ASP  52           1HB      ASP  52  -7.777   0.320   1.521
  394    H    LYS  53           H        LYS  53  -6.560  -2.960   0.280
  395    HA   LYS  53           HA       LYS  53  -3.927  -3.905   1.195
  396    HB2  LYS  53           2HB      LYS  53  -4.317  -5.909  -0.199
  397    HB3  LYS  53           1HB      LYS  53  -5.498  -5.731   1.084
  398    HG2  LYS  53           2HG      LYS  53  -6.446  -4.453  -1.298
  399    HG3  LYS  53           1HG      LYS  53  -5.978  -6.120  -1.637
  400    HD2  LYS  53           2HD      LYS  53  -7.451  -5.871   0.857
  401    HD3  LYS  53           1HD      LYS  53  -8.372  -5.275  -0.526
  402    HE2  LYS  53           2HE      LYS  53  -7.031  -7.974  -0.382
  403    HE3  LYS  53           1HE      LYS  53  -8.739  -7.682  -0.059
  404    HZ1  LYS  53           3HZ      LYS  53  -8.547  -6.573  -2.446
  405    HZ2  LYS  53           1HZ      LYS  53  -8.878  -8.219  -2.238
  406    HZ3  LYS  53           2HZ      LYS  53  -7.307  -7.711  -2.599
  407    H    LEU  54           H        LEU  54  -2.297  -4.057  -0.252
  408    HA   LEU  54           HA       LEU  54  -2.511  -2.204  -2.499
  409    HG   LEU  54           HG       LEU  54  -1.152  -0.533  -1.456
  410    HB2  LEU  54           2HB      LEU  54  -0.478  -2.811  -0.620
  411    HB3  LEU  54           1HB      LEU  54   0.157  -3.140  -2.221
  412   HD11  LEU  54          1HD1      LEU  54   1.179  -1.399  -0.373
  413   HD12  LEU  54          2HD1      LEU  54   0.773   0.294  -0.662
  414   HD13  LEU  54          3HD1      LEU  54   1.756  -0.589  -1.829
  415   HD21  LEU  54          3HD2      LEU  54  -1.197  -0.492  -3.724
  416   HD22  LEU  54          1HD2      LEU  54   0.148  -1.621  -3.887
  417   HD23  LEU  54          2HD2      LEU  54   0.457   0.068  -3.486
  418    H    LEU  55           H        LEU  55  -3.245  -3.086  -4.275
  419    HA   LEU  55           HA       LEU  55  -2.869  -5.756  -5.095
  420    HG   LEU  55           HG       LEU  55  -3.995  -6.343  -7.120
  421    HB2  LEU  55           2HB      LEU  55  -4.678  -4.148  -5.850
  422    HB3  LEU  55           1HB      LEU  55  -3.476  -3.404  -6.885
  423   HD11  LEU  55          1HD1      LEU  55  -5.570  -5.366  -9.068
  424   HD12  LEU  55          2HD1      LEU  55  -5.853  -4.162  -7.812
  425   HD13  LEU  55          3HD1      LEU  55  -6.167  -5.866  -7.485
  426   HD21  LEU  55          3HD2      LEU  55  -2.837  -4.160  -8.786
  427   HD22  LEU  55          1HD2      LEU  55  -3.577  -5.546  -9.588
  428   HD23  LEU  55          2HD2      LEU  55  -2.230  -5.786  -8.476
  429    H    ALA  56           H        ALA  56  -1.357  -2.698  -6.228
  430    HA   ALA  56           HA       ALA  56   1.116  -4.147  -6.734
  431    HB1  ALA  56           3HB      ALA  56   0.085  -4.649  -8.814
  432    HB2  ALA  56           1HB      ALA  56   1.187  -3.309  -9.146
  433    HB3  ALA  56           2HB      ALA  56  -0.542  -3.010  -8.985
  434    H    VAL  57           H        VAL  57   2.912  -2.730  -7.357
  435    HA   VAL  57           HA       VAL  57   2.464   0.143  -6.974
  436    HB   VAL  57           HB       VAL  57   4.459  -1.447  -5.349
  437   HG11  VAL  57          1HG1      VAL  57   5.568   0.551  -5.827
  438   HG12  VAL  57          2HG1      VAL  57   4.807   0.856  -4.266
  439   HG13  VAL  57          3HG1      VAL  57   4.086   1.504  -5.740
  440   HG21  VAL  57          3HG2      VAL  57   1.992   0.096  -4.566
  441   HG22  VAL  57          1HG2      VAL  57   3.182  -0.528  -3.424
  442   HG23  VAL  57          2HG2      VAL  57   2.253  -1.643  -4.425
  443    H    ASN  58           H        ASN  58   3.276   1.022  -8.759
  444    HA   ASN  58           HA       ASN  58   4.696   1.600 -10.432
  445    HB2  ASN  58           2HB      ASN  58   6.700   0.299  -8.581
  446    HB3  ASN  58           1HB      ASN  58   7.161   1.081 -10.090
  447   HD21  ASN  58          1HD2      ASN  58   7.327   3.257 -10.163
  448   HD22  ASN  58          2HD2      ASN  58   7.013   4.302  -8.825
  449    H    ASN  59           H        ASN  59   3.155  -0.518 -10.960
  450    HA   ASN  59           HA       ASN  59   2.869  -2.034 -12.641
  451    HB2  ASN  59           2HB      ASN  59   5.859  -1.814 -13.022
  452    HB3  ASN  59           1HB      ASN  59   4.790  -2.765 -14.044
  453   HD21  ASN  59          1HD2      ASN  59   3.831  -1.801 -15.711
  454   HD22  ASN  59          2HD2      ASN  59   3.819  -0.099 -16.005
  455    H    VAL  60           H        VAL  60   4.831  -2.625  -9.891
  456    HA   VAL  60           HA       VAL  60   4.900  -5.510 -10.395
  457    HB   VAL  60           HB       VAL  60   6.298  -5.741  -8.481
  458   HG11  VAL  60          1HG1      VAL  60   7.828  -3.485  -9.115
  459   HG12  VAL  60          2HG1      VAL  60   6.962  -3.910 -10.591
  460   HG13  VAL  60          3HG1      VAL  60   7.975  -5.109  -9.789
  461   HG21  VAL  60          3HG2      VAL  60   6.736  -3.105  -7.553
  462   HG22  VAL  60          1HG2      VAL  60   6.071  -4.482  -6.677
  463   HG23  VAL  60          2HG2      VAL  60   4.997  -3.394  -7.553
  464    H    CYS  61           H        CYS  61   3.793  -7.024  -9.105
  465    HA   CYS  61           HA       CYS  61   1.419  -5.965  -7.839
  466    HG   CYS  61           HG       CYS  61   2.310 -10.102  -7.455
  467    HB2  CYS  61           2HB      CYS  61   0.710  -8.270  -7.600
  468    HB3  CYS  61           1HB      CYS  61   1.272  -7.979  -9.240
  469    H    LEU  62           H        LEU  62   0.996  -5.825  -5.711
  470    HA   LEU  62           HA       LEU  62   3.161  -6.542  -3.877
  471    HG   LEU  62           HG       LEU  62   3.597  -5.022  -2.055
  472    HB2  LEU  62           2HB      LEU  62   1.686  -4.179  -4.229
  473    HB3  LEU  62           1HB      LEU  62   1.144  -4.856  -2.710
  474   HD11  LEU  62          1HD1      LEU  62   4.077  -2.972  -4.175
  475   HD12  LEU  62          2HD1      LEU  62   4.271  -4.688  -4.529
  476   HD13  LEU  62          3HD1      LEU  62   5.239  -3.933  -3.261
  477   HD21  LEU  62          3HD2      LEU  62   3.625  -2.853  -1.186
  478   HD22  LEU  62          1HD2      LEU  62   1.912  -3.219  -1.382
  479   HD23  LEU  62          2HD2      LEU  62   2.734  -2.195  -2.556
  480    H    GLU  63           H        GLU  63   1.111  -8.414  -4.899
  481    HA   GLU  63           HA       GLU  63  -0.262  -9.062  -2.375
  482    HB2  GLU  63           2HB      GLU  63  -1.163  -9.010  -5.141
  483    HB3  GLU  63           1HB      GLU  63  -1.497 -10.553  -4.364
  484    HG2  GLU  63           2HG      GLU  63  -2.617  -9.347  -2.529
  485    HG3  GLU  63           1HG      GLU  63  -2.349  -7.835  -3.392
  486    H    GLU  64           H        GLU  64   2.020 -10.228  -4.717
  487    HA   GLU  64           HA       GLU  64   2.030 -12.841  -3.359
  488    HB2  GLU  64           2HB      GLU  64   1.748 -12.251  -6.121
  489    HB3  GLU  64           1HB      GLU  64   3.296 -13.048  -5.893
  490    HG2  GLU  64           2HG      GLU  64   2.241 -14.933  -4.858
  491    HG3  GLU  64           1HG      GLU  64   0.679 -14.116  -4.868
  492    H    VAL  65           H        VAL  65   3.471 -10.739  -2.299
  493    HA   VAL  65           HA       VAL  65   6.215 -11.699  -2.711
  494    HB   VAL  65           HB       VAL  65   7.065  -9.350  -2.491
  495   HG11  VAL  65          1HG1      VAL  65   5.426  -9.568  -4.984
  496   HG12  VAL  65          2HG1      VAL  65   6.718 -10.725  -4.662
  497   HG13  VAL  65          3HG1      VAL  65   7.085  -9.004  -4.778
  498   HG21  VAL  65          3HG2      VAL  65   5.523  -7.530  -3.161
  499   HG22  VAL  65          1HG2      VAL  65   5.108  -8.255  -1.608
  500   HG23  VAL  65          2HG2      VAL  65   4.180  -8.667  -3.051
  501    H    THR  66           H        THR  66   7.684 -11.218  -0.997
  502    HA   THR  66           HA       THR  66   6.531 -11.548   1.590
  503    HB   THR  66           HB       THR  66   8.853 -11.456   2.416
  504    HG1  THR  66           1HG      THR  66   9.992 -10.087   1.256
  505   HG21  THR  66          3HG2      THR  66   7.985 -13.544   1.334
  506   HG22  THR  66          1HG2      THR  66   9.739 -13.362   1.351
  507   HG23  THR  66          2HG2      THR  66   8.834 -13.045  -0.129
  508    H    HIS  67           H        HIS  67   7.519 -10.088   3.442
  509    HA   HIS  67           HA       HIS  67   6.294  -7.577   3.154
  510    HD1  HIS  67           1HD      HIS  67   5.105  -6.924   6.262
  511    HD2  HIS  67           2HD      HIS  67   8.779  -5.332   5.170
  512    HE1  HIS  67           1HE      HIS  67   5.005  -4.502   6.892
  513    HE2  HIS  67           2HE      HIS  67   7.181  -3.534   6.102
  514    HB2  HIS  67           2HB      HIS  67   6.629  -8.650   5.365
  515    HB3  HIS  67           1HB      HIS  67   8.340  -8.252   5.282
  516    H    GLU  68           H        GLU  68   9.708  -8.491   2.886
  517    HA   GLU  68           HA       GLU  68  10.898  -6.020   2.746
  518    HB2  GLU  68           2HB      GLU  68  11.549  -8.402   0.995
  519    HB3  GLU  68           1HB      GLU  68  12.618  -7.047   1.329
  520    HG2  GLU  68           2HG      GLU  68  11.718  -9.223   3.181
  521    HG3  GLU  68           1HG      GLU  68  13.358  -8.773   2.718
  522    H    GLU  69           H        GLU  69   9.390  -7.809   0.070
  523    HA   GLU  69           HA       GLU  69   9.822  -5.883  -1.935
  524    HB2  GLU  69           2HB      GLU  69   7.859  -8.124  -1.609
  525    HB3  GLU  69           1HB      GLU  69   7.727  -7.025  -2.976
  526    HG2  GLU  69           2HG      GLU  69   9.017  -8.625  -3.923
  527    HG3  GLU  69           1HG      GLU  69  10.290  -7.618  -3.235
  528    H    ALA  70           H        ALA  70   7.263  -6.223   0.463
  529    HA   ALA  70           HA       ALA  70   5.413  -4.367  -0.574
  530    HB1  ALA  70           3HB      ALA  70   5.906  -4.887   2.352
  531    HB2  ALA  70           1HB      ALA  70   5.046  -6.014   1.306
  532    HB3  ALA  70           2HB      ALA  70   4.405  -4.394   1.574
  533    H    VAL  71           H        VAL  71   8.166  -3.989   1.613
  534    HA   VAL  71           HA       VAL  71   7.757  -1.148   1.928
  535    HB   VAL  71           HB       VAL  71   9.956  -3.006   2.838
  536   HG11  VAL  71          1HG1      VAL  71   9.855  -0.027   2.873
  537   HG12  VAL  71          2HG1      VAL  71  11.224  -1.107   2.613
  538   HG13  VAL  71          3HG1      VAL  71  10.580  -0.876   4.238
  539   HG21  VAL  71          3HG2      VAL  71   7.576  -2.815   3.912
  540   HG22  VAL  71          1HG2      VAL  71   8.239  -1.343   4.622
  541   HG23  VAL  71          2HG2      VAL  71   9.011  -2.897   4.932
  542    H    THR  72           H        THR  72   9.902  -3.263   0.082
  543    HA   THR  72           HA       THR  72  11.652  -1.299  -0.892
  544    HB   THR  72           HB       THR  72  10.832  -3.971  -2.038
  545    HG1  THR  72           1HG      THR  72  12.044  -4.511  -0.403
  546   HG21  THR  72          3HG2      THR  72  11.715  -2.783  -3.898
  547   HG22  THR  72          1HG2      THR  72  12.985  -3.852  -3.302
  548   HG23  THR  72          2HG2      THR  72  13.036  -2.129  -2.930
  549    H    ALA  73           H        ALA  73   8.489  -2.380  -2.026
  550    HA   ALA  73           HA       ALA  73   8.631  -0.932  -4.497
  551    HB1  ALA  73           3HB      ALA  73   7.294  -3.030  -4.136
  552    HB2  ALA  73           1HB      ALA  73   6.420  -1.701  -4.897
  553    HB3  ALA  73           2HB      ALA  73   6.166  -2.061  -3.189
  554    H    LEU  74           H        LEU  74   7.284  -0.396  -1.265
  555    HA   LEU  74           HA       LEU  74   5.841   1.974  -1.976
  556    HG   LEU  74           HG       LEU  74   4.371   0.485   1.081
  557    HB2  LEU  74           2HB      LEU  74   6.630   0.598   0.556
  558    HB3  LEU  74           1HB      LEU  74   6.119   2.269   0.642
  559   HD11  LEU  74          1HD1      LEU  74   2.617   1.770   0.022
  560   HD12  LEU  74          2HD1      LEU  74   3.786   2.505  -1.075
  561   HD13  LEU  74          3HD1      LEU  74   3.859   2.851   0.653
  562   HD21  LEU  74          3HD2      LEU  74   5.215  -0.708  -1.133
  563   HD22  LEU  74          1HD2      LEU  74   3.956   0.299  -1.846
  564   HD23  LEU  74          2HD2      LEU  74   3.552  -0.845  -0.566
  565    H    LYS  75           H        LYS  75   9.042   1.184  -0.775
  566    HA   LYS  75           HA       LYS  75   9.762   3.946  -0.309
  567    HB2  LYS  75           2HB      LYS  75  11.792   3.164   0.532
  568    HB3  LYS  75           1HB      LYS  75  10.649   1.898   0.954
  569    HG2  LYS  75           2HG      LYS  75  11.428   0.773  -1.231
  570    HG3  LYS  75           1HG      LYS  75  12.798   1.879  -1.127
  571    HD2  LYS  75           2HD      LYS  75  11.951  -0.036   1.046
  572    HD3  LYS  75           1HD      LYS  75  13.256  -0.328  -0.106
  573    HE2  LYS  75           2HE      LYS  75  14.182   1.937   0.761
  574    HE3  LYS  75           1HE      LYS  75  13.112   1.655   2.133
  575    HZ1  LYS  75           3HZ      LYS  75  15.261  -0.172   1.200
  576    HZ2  LYS  75           1HZ      LYS  75  14.223  -0.468   2.503
  577    HZ3  LYS  75           2HZ      LYS  75  15.324   0.814   2.572
  578    H    ASN  76           H        ASN  76   9.992   1.735  -2.993
  579    HA   ASN  76           HA       ASN  76  12.085   3.141  -4.359
  580    HB2  ASN  76           2HB      ASN  76  11.469   0.704  -4.707
  581    HB3  ASN  76           1HB      ASN  76  10.066   1.269  -5.608
  582   HD21  ASN  76          1HD2      ASN  76  10.315   1.918  -7.683
  583   HD22  ASN  76          2HD2      ASN  76  11.823   1.920  -8.524
  584    H    THR  77           H        THR  77  10.937   5.262  -3.912
  585    HA   THR  77           HA       THR  77   9.146   5.907  -6.162
  586    HB   THR  77           HB       THR  77   8.319   7.779  -4.618
  587    HG1  THR  77           1HG      THR  77   8.636   7.446  -2.430
  588   HG21  THR  77          3HG2      THR  77   7.075   5.633  -5.119
  589   HG22  THR  77          1HG2      THR  77   6.648   6.470  -3.627
  590   HG23  THR  77          2HG2      THR  77   7.683   5.043  -3.572
  591    H    SER  78           H        SER  78  10.139   7.098  -7.624
  592    HA   SER  78           HA       SER  78  12.466   8.692  -6.915
  593    HG   SER  78           HG       SER  78  13.787   9.069  -9.405
  594    HB2  SER  78           2HB      SER  78  12.634   7.345  -8.927
  595    HB3  SER  78           1HB      SER  78  11.191   8.100  -9.601
  596    H    ASP  79           H        ASP  79  10.087   9.663  -9.354
  597    HA   ASP  79           HA       ASP  79   9.911  12.271  -8.031
  598    HB2  ASP  79           2HB      ASP  79   9.038  13.105 -10.172
  599    HB3  ASP  79           1HB      ASP  79  10.588  12.300 -10.388
  600    H    PHE  80           H        PHE  80   7.865   9.711  -9.383
  601    HA   PHE  80           HA       PHE  80   5.662  10.664  -7.687
  602    HD1  PHE  80           1HD      PHE  80   5.397  12.957  -9.778
  603    HD2  PHE  80           2HD      PHE  80   2.481   9.929  -9.097
  604    HE1  PHE  80           1HE      PHE  80   3.712  14.690  -9.337
  605    HE2  PHE  80           2HE      PHE  80   0.789  11.665  -8.653
  606    HZ   PHE  80           HZ       PHE  80   1.407  14.046  -8.765
  607    HB2  PHE  80           2HB      PHE  80   5.704  10.606 -10.538
  608    HB3  PHE  80           1HB      PHE  80   4.579   9.366  -9.988
  609    H    VAL  81           H        VAL  81   3.901   8.836  -7.521
  610    HA   VAL  81           HA       VAL  81   5.091   6.186  -7.633
  611    HB   VAL  81           HB       VAL  81   5.596   6.945  -5.361
  612   HG11  VAL  81          1HG1      VAL  81   3.053   8.157  -5.500
  613   HG12  VAL  81          2HG1      VAL  81   4.226   8.229  -4.188
  614   HG13  VAL  81          3HG1      VAL  81   2.993   6.970  -4.199
  615   HG21  VAL  81          3HG2      VAL  81   4.652   5.088  -4.149
  616   HG22  VAL  81          1HG2      VAL  81   5.026   4.575  -5.795
  617   HG23  VAL  81          2HG2      VAL  81   3.358   4.922  -5.336
  618    H    TYR  82           H        TYR  82   3.693   4.908  -8.627
  619    HA   TYR  82           HA       TYR  82   0.861   5.661  -8.673
  620    HD1  TYR  82           1HD      TYR  82  -0.086   2.379 -10.351
  621    HD2  TYR  82           2HD      TYR  82   0.391   6.386 -11.693
  622    HE1  TYR  82           1HE      TYR  82  -2.260   2.253 -11.476
  623    HE2  TYR  82           2HE      TYR  82  -1.786   6.274 -12.821
  624    HH   TYR  82           HH       TYR  82  -3.792   5.053 -12.864
  625    HB2  TYR  82           2HB      TYR  82   2.252   5.183 -10.782
  626    HB3  TYR  82           1HB      TYR  82   2.107   3.485 -10.335
  627    H    LEU  83           H        LEU  83  -0.022   4.912  -6.862
  628    HA   LEU  83           HA       LEU  83   0.538   2.250  -5.882
  629    HG   LEU  83           HG       LEU  83  -0.972   1.737  -3.816
  630    HB2  LEU  83           2HB      LEU  83   0.190   4.398  -4.506
  631    HB3  LEU  83           1HB      LEU  83  -1.521   4.133  -4.783
  632   HD11  LEU  83          1HD1      LEU  83   1.391   1.956  -3.595
  633   HD12  LEU  83          2HD1      LEU  83   0.703   1.977  -1.971
  634   HD13  LEU  83          3HD1      LEU  83   1.227   3.482  -2.726
  635   HD21  LEU  83          3HD2      LEU  83  -2.584   2.997  -2.731
  636   HD22  LEU  83          1HD2      LEU  83  -1.467   4.318  -2.392
  637   HD23  LEU  83          2HD2      LEU  83  -1.345   2.807  -1.490
  638    H    LYS  84           H        LYS  84  -0.598   0.494  -6.292
  639    HA   LYS  84           HA       LYS  84  -3.282   0.756  -7.464
  640    HB2  LYS  84           2HB      LYS  84  -1.175  -1.361  -7.832
  641    HB3  LYS  84           1HB      LYS  84  -2.845  -1.599  -8.315
  642    HG2  LYS  84           2HG      LYS  84  -1.555   0.854  -9.316
  643    HG3  LYS  84           1HG      LYS  84  -0.932  -0.670  -9.950
  644    HD2  LYS  84           2HD      LYS  84  -2.666   0.054 -11.417
  645    HD3  LYS  84           1HD      LYS  84  -3.298  -1.307 -10.489
  646    HE2  LYS  84           2HE      LYS  84  -4.633   0.077  -9.153
  647    HE3  LYS  84           1HE      LYS  84  -3.739   1.526  -9.607
  648    HZ1  LYS  84           3HZ      LYS  84  -5.959   1.316 -10.662
  649    HZ2  LYS  84           1HZ      LYS  84  -5.402  -0.046 -11.498
  650    HZ3  LYS  84           2HZ      LYS  84  -4.692   1.463 -11.774
  651    H    VAL  85           H        VAL  85  -4.786   0.454  -5.950
  652    HA   VAL  85           HA       VAL  85  -4.268  -1.571  -3.877
  653    HB   VAL  85           HB       VAL  85  -6.130   0.815  -3.802
  654   HG11  VAL  85          1HG1      VAL  85  -6.987   0.133  -1.817
  655   HG12  VAL  85          2HG1      VAL  85  -5.511  -0.707  -1.340
  656   HG13  VAL  85          3HG1      VAL  85  -6.625  -1.460  -2.480
  657   HG21  VAL  85          3HG2      VAL  85  -4.018   1.707  -3.499
  658   HG22  VAL  85          1HG2      VAL  85  -3.418   0.275  -2.664
  659   HG23  VAL  85          2HG2      VAL  85  -4.522   1.377  -1.841
  660    H    ALA  86           H        ALA  86  -5.568  -3.295  -3.680
  661    HA   ALA  86           HA       ALA  86  -7.806  -3.551  -5.560
  662    HB1  ALA  86           3HB      ALA  86  -6.558  -5.736  -3.905
  663    HB2  ALA  86           1HB      ALA  86  -5.976  -5.270  -5.502
  664    HB3  ALA  86           2HB      ALA  86  -7.607  -5.908  -5.313
  665    H    LYS  87           H        LYS  87  -9.827  -4.449  -4.881
  666    HA   LYS  87           HA       LYS  87 -10.504  -3.714  -2.124
  667    HB2  LYS  87           2HB      LYS  87 -12.824  -3.633  -2.867
  668    HB3  LYS  87           1HB      LYS  87 -11.814  -2.633  -3.898
  669    HG2  LYS  87           2HG      LYS  87 -12.728  -3.662  -5.633
  670    HG3  LYS  87           1HG      LYS  87 -11.844  -5.112  -5.156
  671    HD2  LYS  87           2HD      LYS  87 -13.703  -6.141  -4.432
  672    HD3  LYS  87           1HD      LYS  87 -14.305  -4.687  -3.633
  673    HE2  LYS  87           2HE      LYS  87 -14.901  -3.841  -5.953
  674    HE3  LYS  87           1HE      LYS  87 -14.588  -5.480  -6.522
  675    HZ1  LYS  87           3HZ      LYS  87 -16.273  -6.268  -4.932
  676    HZ2  LYS  87           1HZ      LYS  87 -16.917  -5.209  -6.084
  677    HZ3  LYS  87           2HZ      LYS  87 -16.616  -4.667  -4.511
  678    HA   PRO  88           HA       PRO  88 -10.638  -7.969  -0.851
  679    HB2  PRO  88           2HB      PRO  88 -12.757  -6.979   0.991
  680    HB3  PRO  88           1HB      PRO  88 -11.284  -7.885   1.352
  681    HG2  PRO  88           2HG      PRO  88 -11.448  -5.287   1.904
  682    HG3  PRO  88           1HG      PRO  88  -9.945  -5.994   1.283
  683    HD2  PRO  88           2HD      PRO  88 -11.997  -4.348  -0.135
  684    HD3  PRO  88           1HD      PRO  88 -10.230  -4.346  -0.310
  685    H    THR  89           H        THR  89 -11.963  -9.779  -1.040
  686    HA   THR  89           HA       THR  89 -14.757  -9.459  -1.764
  687    HB   THR  89           HB       THR  89 -14.360 -10.957  -3.818
  688    HG1  THR  89           1HG      THR  89 -11.777  -9.820  -3.780
  689   HG21  THR  89          3HG2      THR  89 -13.181  -8.220  -4.135
  690   HG22  THR  89          1HG2      THR  89 -14.906  -8.482  -3.875
  691   HG23  THR  89          2HG2      THR  89 -14.115  -9.163  -5.296
  692    H    GLY  90           H        GLY  90 -15.787 -11.653  -2.155
  693    HA2  GLY  90           2HA      GLY  90 -16.356 -13.714  -1.312
  694    HA3  GLY  90           1HA      GLY  90 -14.640 -14.075  -1.405
  695    H    SER  91           H        SER  91 -17.259 -13.041   0.661
  696    HA   SER  91           HA       SER  91 -15.634 -12.687   3.001
  697    HG   SER  91           HG       SER  91 -17.842 -12.754   5.069
  698    HB2  SER  91           2HB      SER  91 -17.980 -11.680   2.484
  699    HB3  SER  91           1HB      SER  91 -18.593 -13.216   3.094
  700    H    HIS  92           H        HIS  92 -17.681 -15.282   1.717
  701    HA   HIS  92           HA       HIS  92 -17.381 -16.997   3.976
  702    HD1  HIS  92           1HD      HIS  92 -18.934 -20.351   1.514
  703    HD2  HIS  92           2HD      HIS  92 -19.311 -18.119   4.997
  704    HE1  HIS  92           1HE      HIS  92 -19.908 -21.924   3.217
  705    HE2  HIS  92           2HE      HIS  92 -20.050 -20.573   5.339
  706    HB2  HIS  92           2HB      HIS  92 -19.155 -16.991   2.013
  707    HB3  HIS  92           1HB      HIS  92 -17.997 -18.077   1.255
  708    HA   ARG 301           HA       ARG 301   2.462 -10.871  10.227
  709    HE   ARG 301           HE       ARG 301  -0.876 -13.275  13.895
  710    H1   ARG 301           1HT      ARG 301   4.268 -12.170  11.284
  711    H2   ARG 301           2HT      ARG 301   2.808 -13.012  10.966
  712    H3   ARG 301           3HT      ARG 301   3.176 -12.501  12.564
  713    HB2  ARG 301           2HB      ARG 301   1.318 -11.122  13.020
  714    HB3  ARG 301           1HB      ARG 301   0.682 -10.101  11.738
  715    HG2  ARG 301           2HG      ARG 301   0.191 -12.099  10.402
  716    HG3  ARG 301           1HG      ARG 301   0.801 -13.111  11.712
  717    HD2  ARG 301           2HD      ARG 301  -1.517 -11.194  11.932
  718    HD3  ARG 301           1HD      ARG 301  -1.660 -12.933  11.700
  719   HH11  ARG 301          1HH1      ARG 301  -1.225  -9.865  13.138
  720   HH12  ARG 301          2HH1      ARG 301  -1.205  -9.374  14.796
  721   HH21  ARG 301          1HH2      ARG 301  -0.851 -12.609  16.074
  722   HH22  ARG 301          2HH2      ARG 301  -0.993 -10.928  16.460
  723    H    ARG 302           H        ARG 302   3.656  -9.096   9.988
  724    HA   ARG 302           HA       ARG 302   4.336  -7.498  12.324
  725    HE   ARG 302           HE       ARG 302   9.097  -8.971  11.836
  726    HB2  ARG 302           2HB      ARG 302   6.619  -7.534  12.104
  727    HB3  ARG 302           1HB      ARG 302   6.245  -9.172  11.590
  728    HG2  ARG 302           2HG      ARG 302   6.242  -8.259   9.216
  729    HG3  ARG 302           1HG      ARG 302   6.981  -6.808   9.894
  730    HD2  ARG 302           2HD      ARG 302   8.065  -9.617   9.907
  731    HD3  ARG 302           1HD      ARG 302   8.742  -8.203   9.103
  732   HH11  ARG 302          1HH1      ARG 302   9.027  -6.220   9.667
  733   HH12  ARG 302          2HH1      ARG 302  10.017  -5.237  10.690
  734   HH21  ARG 302          1HH2      ARG 302  10.398  -7.669  13.178
  735   HH22  ARG 302          2HH2      ARG 302  10.797  -6.058  12.683
  736    H    GLU 303           H        GLU 303   5.005  -5.312  11.788
  737    HA   GLU 303           HA       GLU 303   4.269  -4.474   9.067
  738    HB2  GLU 303           2HB      GLU 303   3.146  -2.486  10.038
  739    HB3  GLU 303           1HB      GLU 303   2.352  -4.001  10.441
  740    HG2  GLU 303           2HG      GLU 303   4.252  -3.383  12.475
  741    HG3  GLU 303           1HG      GLU 303   3.238  -1.972  12.179
  742    H    THR 304           H        THR 304   5.147  -2.421   8.396
  743    HA   THR 304           HA       THR 304   7.263  -1.272  10.013
  744    HB   THR 304           HB       THR 304   7.775  -3.117   7.827
  745    HG1  THR 304           1HG      THR 304   9.066  -3.537   9.418
  746   HG21  THR 304          3HG2      THR 304   9.196  -0.471   7.685
  747   HG22  THR 304          1HG2      THR 304   8.100  -1.133   6.471
  748   HG23  THR 304          2HG2      THR 304   9.634  -1.936   6.806
  749    H    GLN 305           H        GLN 305   7.744   0.845   9.495
  750    HA   GLN 305           HA       GLN 305   5.775   2.247   7.966
  751    HB2  GLN 305           2HB      GLN 305   8.090   2.995   9.664
  752    HB3  GLN 305           1HB      GLN 305   7.580   4.167   8.456
  753    HG2  GLN 305           2HG      GLN 305   5.479   4.435   9.421
  754    HG3  GLN 305           1HG      GLN 305   5.609   2.937  10.343
  755   HE21  GLN 305          1HE2      GLN 305   6.675   6.264  10.111
  756   HE22  GLN 305          2HE2      GLN 305   7.211   6.406  11.747
  757    H    VAL 306           H        VAL 306   6.088   3.564   6.150
  758    HA   VAL 306           HA       VAL 306   8.536   3.184   4.598
  759    HB   VAL 306           HB       VAL 306   7.129   2.717   2.542
  760   HG11  VAL 306          1HG1      VAL 306   7.030   0.567   4.652
  761   HG12  VAL 306          2HG1      VAL 306   8.494   1.029   3.783
  762   HG13  VAL 306          3HG1      VAL 306   7.122   0.356   2.903
  763   HG21  VAL 306          3HG2      VAL 306   4.952   1.476   3.171
  764   HG22  VAL 306          1HG2      VAL 306   4.935   3.238   3.131
  765   HG23  VAL 306          2HG2      VAL 306   5.046   2.393   4.675
  Start of MODEL   19
    1    HA   MET   1           HA       MET   1  -8.592   0.599  -6.793
    2    H1   MET   1           1HT      MET   1  -9.019   2.796  -5.873
    3    H2   MET   1           2HT      MET   1 -10.360   2.101  -6.688
    4    H3   MET   1           3HT      MET   1  -9.441   3.340  -7.442
    5    HB2  MET   1           2HB      MET   1  -9.643   1.992  -9.144
    6    HB3  MET   1           1HB      MET   1  -8.143   1.135  -9.466
    7    HG2  MET   1           2HG      MET   1  -9.069  -0.935  -8.908
    8    HG3  MET   1           1HG      MET   1 -10.442  -0.198  -8.084
    9    HE1  MET   1           3HE      MET   1 -12.452  -0.118  -8.799
   10    HE2  MET   1           1HE      MET   1 -13.113  -0.352 -10.418
   11    HE3  MET   1           2HE      MET   1 -12.539   1.241  -9.922
   12    H    GLU   2           H        GLU   2  -7.553   3.607  -8.449
   13    HA   GLU   2           HA       GLU   2  -4.813   3.049  -7.519
   14    HB2  GLU   2           2HB      GLU   2  -4.009   4.149  -9.609
   15    HB3  GLU   2           1HB      GLU   2  -4.859   2.639  -9.888
   16    HG2  GLU   2           2HG      GLU   2  -6.559   5.021  -9.981
   17    HG3  GLU   2           1HG      GLU   2  -5.311   4.955 -11.225
   18    H    ILE   3           H        ILE   3  -3.440   4.974  -7.259
   19    HA   ILE   3           HA       ILE   3  -4.839   7.519  -6.996
   20    HB   ILE   3           HB       ILE   3  -3.321   6.169  -4.751
   21   HG12  ILE   3          2HG1      ILE   3  -5.745   7.202  -3.816
   22   HG13  ILE   3          1HG1      ILE   3  -6.140   6.494  -5.377
   23   HG21  ILE   3          1HG2      ILE   3  -4.210   9.022  -5.063
   24   HG22  ILE   3          2HG2      ILE   3  -2.594   8.407  -4.720
   25   HG23  ILE   3          3HG2      ILE   3  -3.857   8.299  -3.493
   26   HD11  ILE   3          3HD1      ILE   3  -4.697   5.052  -3.167
   27   HD12  ILE   3          1HD1      ILE   3  -5.278   4.365  -4.684
   28   HD13  ILE   3          2HD1      ILE   3  -6.429   4.945  -3.480
   29    H    LYS   4           H        LYS   4  -3.492   9.264  -7.462
   30    HA   LYS   4           HA       LYS   4  -0.751   8.546  -8.237
   31    HB2  LYS   4           2HB      LYS   4  -2.603  10.762  -9.082
   32    HB3  LYS   4           1HB      LYS   4  -0.880  10.823  -9.423
   33    HG2  LYS   4           2HG      LYS   4  -1.331   9.726 -11.295
   34    HG3  LYS   4           1HG      LYS   4  -1.627   8.308 -10.288
   35    HD2  LYS   4           2HD      LYS   4  -3.909   8.533 -10.403
   36    HD3  LYS   4           1HD      LYS   4  -3.832  10.276 -10.669
   37    HE2  LYS   4           2HE      LYS   4  -2.787   8.385 -12.739
   38    HE3  LYS   4           1HE      LYS   4  -4.517   8.700 -12.621
   39    HZ1  LYS   4           3HZ      LYS   4  -4.072  11.058 -12.912
   40    HZ2  LYS   4           1HZ      LYS   4  -3.455  10.171 -14.215
   41    HZ3  LYS   4           2HZ      LYS   4  -2.411  10.758 -13.021
   42    H    LEU   5           H        LEU   5   0.227   8.642  -6.265
   43    HA   LEU   5           HA       LEU   5   0.074  11.068  -4.670
   44    HG   LEU   5           HG       LEU   5  -1.000   9.061  -3.241
   45    HB2  LEU   5           2HB      LEU   5   1.144   8.338  -4.284
   46    HB3  LEU   5           1HB      LEU   5   1.964   9.619  -3.410
   47   HD11  LEU   5          1HD1      LEU   5   1.289   8.246  -1.467
   48   HD12  LEU   5          2HD1      LEU   5   0.099   7.210  -2.255
   49   HD13  LEU   5          3HD1      LEU   5  -0.391   8.265  -0.931
   50   HD21  LEU   5          3HD2      LEU   5  -0.777  10.516  -1.197
   51   HD22  LEU   5          1HD2      LEU   5  -0.597  11.346  -2.742
   52   HD23  LEU   5          2HD2      LEU   5   0.828  10.956  -1.780
   53    H    ILE   6           H        ILE   6   1.438  12.714  -4.738
   54    HA   ILE   6           HA       ILE   6   3.777  12.544  -6.469
   55    HB   ILE   6           HB       ILE   6   2.231  14.458  -6.735
   56   HG12  ILE   6          2HG1      ILE   6   4.968  15.294  -5.749
   57   HG13  ILE   6          1HG1      ILE   6   4.644  14.614  -7.341
   58   HG21  ILE   6          1HG2      ILE   6   1.779  16.020  -5.114
   59   HG22  ILE   6          2HG2      ILE   6   3.249  15.666  -4.206
   60   HG23  ILE   6          3HG2      ILE   6   1.884  14.551  -4.143
   61   HD11  ILE   6          3HD1      ILE   6   4.606  16.805  -7.885
   62   HD12  ILE   6          1HD1      ILE   6   4.090  17.312  -6.277
   63   HD13  ILE   6          2HD1      ILE   6   2.917  16.635  -7.406
   64    H    LYS   7           H        LYS   7   5.794  12.363  -5.726
   65    HA   LYS   7           HA       LYS   7   6.370  11.922  -3.018
   66    HB2  LYS   7           2HB      LYS   7   7.719  11.047  -4.908
   67    HB3  LYS   7           1HB      LYS   7   8.309  12.674  -5.207
   68    HG2  LYS   7           2HG      LYS   7  10.025  11.730  -3.990
   69    HG3  LYS   7           1HG      LYS   7   9.107  12.588  -2.750
   70    HD2  LYS   7           2HD      LYS   7   7.873  10.165  -2.745
   71    HD3  LYS   7           1HD      LYS   7   9.531   9.705  -3.140
   72    HE2  LYS   7           2HE      LYS   7  10.306  11.004  -1.174
   73    HE3  LYS   7           1HE      LYS   7   8.622  11.318  -0.760
   74    HZ1  LYS   7           3HZ      LYS   7   9.918   8.649  -0.899
   75    HZ2  LYS   7           1HZ      LYS   7   8.284   8.919  -0.554
   76    HZ3  LYS   7           2HZ      LYS   7   9.475   9.469   0.510
   77    H    GLY   8           H        GLY   8   6.341  13.353  -1.428
   78    HA2  GLY   8           2HA      GLY   8   7.059  16.156  -1.987
   79    HA3  GLY   8           1HA      GLY   8   6.116  15.596  -0.611
   80    HA   PRO   9           HA       PRO   9  10.342  16.403   1.061
   81    HB2  PRO   9           2HB      PRO   9   8.800  16.506   3.593
   82    HB3  PRO   9           1HB      PRO   9   9.957  17.661   2.932
   83    HG2  PRO   9           2HG      PRO   9   7.325  18.174   2.961
   84    HG3  PRO   9           1HG      PRO   9   8.369  18.717   1.635
   85    HD2  PRO   9           2HD      PRO   9   6.468  16.409   1.729
   86    HD3  PRO   9           1HD      PRO   9   6.807  17.538   0.401
   87    H    LYS  10           H        LYS  10   8.374  14.842   3.593
   88    HA   LYS  10           HA       LYS  10  10.260  12.775   3.970
   89    HB2  LYS  10           2HB      LYS  10   7.376  12.969   4.868
   90    HB3  LYS  10           1HB      LYS  10   8.521  11.761   5.436
   91    HG2  LYS  10           2HG      LYS  10   9.958  13.755   6.168
   92    HG3  LYS  10           1HG      LYS  10   8.490  14.710   5.956
   93    HD2  LYS  10           2HD      LYS  10   7.626  12.529   7.409
   94    HD3  LYS  10           1HD      LYS  10   9.226  12.853   8.079
   95    HE2  LYS  10           2HE      LYS  10   8.561  15.227   8.373
   96    HE3  LYS  10           1HE      LYS  10   6.938  14.801   7.832
   97    HZ1  LYS  10           3HZ      LYS  10   7.090  14.855  10.244
   98    HZ2  LYS  10           1HZ      LYS  10   8.308  13.681  10.220
   99    HZ3  LYS  10           2HZ      LYS  10   6.745  13.289   9.706
  100    H    GLY  11           H        GLY  11   6.905  12.582   2.733
  101    HA2  GLY  11           2HA      GLY  11   6.725  11.422   0.508
  102    HA3  GLY  11           1HA      GLY  11   7.711  10.166   1.236
  103    H    LEU  12           H        LEU  12   6.356   8.474   1.205
  104    HA   LEU  12           HA       LEU  12   3.700   8.212   1.359
  105    HG   LEU  12           HG       LEU  12   5.128   6.691   0.021
  106    HB2  LEU  12           2HB      LEU  12   5.641   6.492   2.901
  107    HB3  LEU  12           1HB      LEU  12   4.013   6.032   2.446
  108   HD11  LEU  12          1HD1      LEU  12   7.317   6.643   1.580
  109   HD12  LEU  12          2HD1      LEU  12   7.318   6.177  -0.121
  110   HD13  LEU  12          3HD1      LEU  12   7.223   4.940   1.133
  111   HD21  LEU  12          3HD2      LEU  12   5.432   4.115  -0.118
  112   HD22  LEU  12          1HD2      LEU  12   3.821   4.789   0.115
  113   HD23  LEU  12          2HD2      LEU  12   4.703   4.121   1.487
  114    H    GLY  13           H        GLY  13   5.649   8.059   4.358
  115    HA2  GLY  13           2HA      GLY  13   5.191   8.826   6.480
  116    HA3  GLY  13           1HA      GLY  13   3.899   9.794   5.792
  117    H    PHE  14           H        PHE  14   4.393   6.267   5.902
  118    HA   PHE  14           HA       PHE  14   2.384   5.844   7.877
  119    HD1  PHE  14           2HD      PHE  14   2.150   3.016   4.997
  120    HD2  PHE  14           1HD      PHE  14   1.143   6.992   3.850
  121    HE1  PHE  14           2HE      PHE  14   2.493   2.420   2.639
  122    HE2  PHE  14           1HE      PHE  14   1.483   6.399   1.489
  123    HZ   PHE  14           HZ       PHE  14   2.157   4.110   0.880
  124    HB2  PHE  14           2HB      PHE  14   0.763   4.639   6.456
  125    HB3  PHE  14           1HB      PHE  14   0.864   6.345   6.054
  126    H    SER  15           H        SER  15   1.715   3.208   7.503
  127    HA   SER  15           HA       SER  15   4.256   1.842   7.039
  128    HG   SER  15           HG       SER  15   2.050   1.179  10.344
  129    HB2  SER  15           2HB      SER  15   3.449   0.336   9.013
  130    HB3  SER  15           1HB      SER  15   4.288   1.841   9.363
  131    H    ILE  16           H        ILE  16   3.786  -0.657   7.079
  132    HA   ILE  16           HA       ILE  16   1.151  -1.415   6.122
  133    HB   ILE  16           HB       ILE  16   1.714  -2.121   3.967
  134   HG12  ILE  16          2HG1      ILE  16   4.040  -2.966   4.732
  135   HG13  ILE  16          1HG1      ILE  16   3.807  -2.505   3.054
  136   HG21  ILE  16          1HG2      ILE  16   2.438  -0.154   2.776
  137   HG22  ILE  16          2HG2      ILE  16   3.126   0.514   4.257
  138   HG23  ILE  16          3HG2      ILE  16   1.382   0.294   4.114
  139   HD11  ILE  16          3HD1      ILE  16   5.832  -1.677   4.658
  140   HD12  ILE  16          1HD1      ILE  16   4.702  -0.325   4.756
  141   HD13  ILE  16          2HD1      ILE  16   5.294  -0.864   3.183
  142    H    ALA  17           H        ALA  17   1.236  -3.770   5.391
  143    HA   ALA  17           HA       ALA  17   3.282  -5.371   6.748
  144    HB1  ALA  17           3HB      ALA  17   1.741  -5.796   8.357
  145    HB2  ALA  17           1HB      ALA  17   1.074  -6.897   7.152
  146    HB3  ALA  17           2HB      ALA  17   0.393  -5.280   7.346
  147    H    GLY  18           H        GLY  18   3.158  -7.749   5.753
  148    HA2  GLY  18           2HA      GLY  18   1.634  -8.327   3.553
  149    HA3  GLY  18           1HA      GLY  18   2.906  -7.328   2.905
  150    H    GLY  19           H        GLY  19   1.981 -10.398   2.896
  151    HA2  GLY  19           2HA      GLY  19   3.485 -11.967   1.877
  152    HA3  GLY  19           1HA      GLY  19   4.777 -11.318   2.873
  153    H    VAL  20           H        VAL  20   4.094 -14.065   2.615
  154    HA   VAL  20           HA       VAL  20   2.524 -14.985   4.775
  155    HB   VAL  20           HB       VAL  20   4.814 -16.434   3.419
  156   HG11  VAL  20          1HG1      VAL  20   3.444 -18.457   4.127
  157   HG12  VAL  20          2HG1      VAL  20   2.585 -17.362   5.211
  158   HG13  VAL  20          3HG1      VAL  20   4.323 -17.608   5.397
  159   HG21  VAL  20          3HG2      VAL  20   3.280 -15.848   1.718
  160   HG22  VAL  20          1HG2      VAL  20   1.889 -16.224   2.737
  161   HG23  VAL  20          2HG2      VAL  20   2.919 -17.523   2.136
  162    H    GLY  21           H        GLY  21   3.064 -15.549   6.888
  163    HA2  GLY  21           2HA      GLY  21   4.422 -15.819   8.778
  164    HA3  GLY  21           1HA      GLY  21   5.822 -15.402   7.803
  165    H    ASN  22           H        ASN  22   4.128 -12.986   6.909
  166    HA   ASN  22           HA       ASN  22   4.293 -11.306   9.294
  167    HB2  ASN  22           2HB      ASN  22   5.204  -9.529   7.514
  168    HB3  ASN  22           1HB      ASN  22   6.302 -10.551   8.421
  169   HD21  ASN  22          1HD2      ASN  22   7.804 -11.520   7.269
  170   HD22  ASN  22          2HD2      ASN  22   7.696 -11.924   5.593
  171    H    GLN  23           H        GLN  23   2.155 -12.548   7.473
  172    HA   GLN  23           HA       GLN  23   0.934 -10.654   5.863
  173    HB2  GLN  23           2HB      GLN  23  -0.348 -12.866   7.475
  174    HB3  GLN  23           1HB      GLN  23  -1.123 -11.996   6.160
  175    HG2  GLN  23           2HG      GLN  23   0.335 -12.932   4.555
  176    HG3  GLN  23           1HG      GLN  23   1.418 -13.551   5.800
  177   HE21  GLN  23          1HE2      GLN  23  -2.072 -13.737   5.097
  178   HE22  GLN  23          2HE2      GLN  23  -2.181 -15.452   5.281
  179    H    HIS  24           H        HIS  24  -0.740  -9.234   6.110
  180    HA   HIS  24           HA       HIS  24  -1.017  -8.037   8.749
  181    HD1  HIS  24           1HD      HIS  24  -0.699  -5.279   9.038
  182    HD2  HIS  24           2HD      HIS  24  -4.249  -5.609   6.915
  183    HE1  HIS  24           1HE      HIS  24  -2.170  -3.464   9.916
  184    HE2  HIS  24           2HE      HIS  24  -4.268  -3.583   8.530
  185    HB2  HIS  24           2HB      HIS  24  -0.620  -6.641   6.706
  186    HB3  HIS  24           1HB      HIS  24  -2.194  -7.138   6.112
  187    H    ILE  25           H        ILE  25  -2.847  -9.960   6.506
  188    HA   ILE  25           HA       ILE  25  -5.004 -10.198   8.450
  189    HB   ILE  25           HB       ILE  25  -5.719  -9.650   5.574
  190   HG12  ILE  25          2HG1      ILE  25  -5.511  -7.666   7.849
  191   HG13  ILE  25          1HG1      ILE  25  -4.607  -7.642   6.340
  192   HG21  ILE  25          1HG2      ILE  25  -7.267  -9.672   8.156
  193   HG22  ILE  25          2HG2      ILE  25  -7.429 -10.779   6.791
  194   HG23  ILE  25          3HG2      ILE  25  -7.918  -9.092   6.623
  195   HD11  ILE  25          3HD1      ILE  25  -6.865  -7.398   5.190
  196   HD12  ILE  25          1HD1      ILE  25  -6.252  -6.009   6.090
  197   HD13  ILE  25          2HD1      ILE  25  -7.503  -7.035   6.794
  198    HA   PRO  26           HA       PRO  26  -4.431 -14.461   7.308
  199    HB2  PRO  26           2HB      PRO  26  -6.900 -15.347   8.201
  200    HB3  PRO  26           1HB      PRO  26  -5.462 -15.161   9.211
  201    HG2  PRO  26           2HG      PRO  26  -7.784 -13.313   8.857
  202    HG3  PRO  26           1HG      PRO  26  -6.891 -13.725  10.333
  203    HD2  PRO  26           2HD      PRO  26  -6.480 -11.407   9.058
  204    HD3  PRO  26           1HD      PRO  26  -5.138 -12.288   9.820
  205    H    GLY  27           H        GLY  27  -4.633 -15.296   5.339
  206    HA2  GLY  27           2HA      GLY  27  -6.044 -16.292   3.649
  207    HA3  GLY  27           1HA      GLY  27  -7.209 -15.007   3.931
  208    H    ASP  28           H        ASP  28  -5.867 -12.720   3.728
  209    HA   ASP  28           HA       ASP  28  -4.951 -12.747   0.947
  210    HB2  ASP  28           2HB      ASP  28  -6.792 -11.159   2.106
  211    HB3  ASP  28           1HB      ASP  28  -5.358 -10.170   2.364
  212    H    ASN  29           H        ASN  29  -2.838 -12.955   0.695
  213    HA   ASN  29           HA       ASN  29  -0.965 -11.995   2.696
  214    HB2  ASN  29           2HB      ASN  29  -0.241 -13.235   0.048
  215    HB3  ASN  29           1HB      ASN  29   0.713 -13.185   1.529
  216   HD21  ASN  29          1HD2      ASN  29  -1.819 -14.788  -0.196
  217   HD22  ASN  29          2HD2      ASN  29  -2.005 -16.112   0.897
  218    H    SER  30           H        SER  30  -2.579 -10.148   0.766
  219    HA   SER  30           HA       SER  30  -0.464  -8.835  -0.718
  220    HG   SER  30           HG       SER  30  -3.590  -8.792  -2.427
  221    HB2  SER  30           2HB      SER  30  -3.348  -8.004  -0.291
  222    HB3  SER  30           1HB      SER  30  -2.215  -7.249  -1.412
  223    H    ILE  31           H        ILE  31   0.063  -6.546  -0.384
  224    HA   ILE  31           HA       ILE  31   0.606  -6.055   2.358
  225    HB   ILE  31           HB       ILE  31   0.953  -4.034   0.156
  226   HG12  ILE  31          2HG1      ILE  31   2.089  -5.710  -0.892
  227   HG13  ILE  31          1HG1      ILE  31   3.363  -5.152   0.177
  228   HG21  ILE  31          1HG2      ILE  31   1.337  -3.542   2.655
  229   HG22  ILE  31          2HG2      ILE  31   2.555  -3.043   1.480
  230   HG23  ILE  31          3HG2      ILE  31   2.805  -4.498   2.445
  231   HD11  ILE  31          3HD1      ILE  31   3.544  -7.196   1.004
  232   HD12  ILE  31          1HD1      ILE  31   2.241  -7.741  -0.050
  233   HD13  ILE  31          2HD1      ILE  31   1.874  -7.128   1.559
  234    H    TYR  32           H        TYR  32  -0.488  -4.978   3.849
  235    HA   TYR  32           HA       TYR  32  -2.629  -3.119   3.046
  236    HD1  TYR  32           2HD      TYR  32  -2.484  -6.699   3.420
  237    HD2  TYR  32           1HD      TYR  32  -5.729  -4.111   4.307
  238    HE1  TYR  32           2HE      TYR  32  -3.990  -8.201   2.195
  239    HE2  TYR  32           1HE      TYR  32  -7.263  -5.597   3.105
  240    HH   TYR  32           HH       TYR  32  -7.024  -8.412   2.528
  241    HB2  TYR  32           2HB      TYR  32  -2.496  -5.023   5.385
  242    HB3  TYR  32           1HB      TYR  32  -3.663  -3.713   5.288
  243    H    VAL  33           H        VAL  33  -2.864  -1.226   4.302
  244    HA   VAL  33           HA       VAL  33  -0.446  -0.248   5.501
  245    HB   VAL  33           HB       VAL  33  -3.162   1.011   5.105
  246   HG11  VAL  33          1HG1      VAL  33  -0.718   2.178   6.430
  247   HG12  VAL  33          2HG1      VAL  33  -2.328   1.982   7.124
  248   HG13  VAL  33          3HG1      VAL  33  -2.064   3.143   5.824
  249   HG21  VAL  33          3HG2      VAL  33  -2.271   1.267   3.061
  250   HG22  VAL  33          1HG2      VAL  33  -0.636   0.928   3.624
  251   HG23  VAL  33          2HG2      VAL  33  -1.315   2.544   3.811
  252    H    THR  34           H        THR  34   0.066  -0.223   7.600
  253    HA   THR  34           HA       THR  34  -1.907  -1.259   9.502
  254    HB   THR  34           HB       THR  34  -0.063  -1.877  10.906
  255    HG1  THR  34           1HG      THR  34   1.615  -0.526   9.065
  256   HG21  THR  34          3HG2      THR  34   0.208  -3.664   9.640
  257   HG22  THR  34          1HG2      THR  34   1.480  -2.802   8.778
  258   HG23  THR  34          2HG2      THR  34  -0.177  -2.758   8.178
  259    H    LYS  35           H        LYS  35   0.039   1.621   8.938
  260    HA   LYS  35           HA       LYS  35  -1.509   3.084  10.887
  261    HB2  LYS  35           2HB      LYS  35   1.480   2.896  11.318
  262    HB3  LYS  35           1HB      LYS  35   0.343   3.836  12.269
  263    HG2  LYS  35           2HG      LYS  35  -0.711   1.765  13.047
  264    HG3  LYS  35           1HG      LYS  35   0.449   0.831  12.102
  265    HD2  LYS  35           2HD      LYS  35   1.668   0.815  13.987
  266    HD3  LYS  35           1HD      LYS  35   2.095   2.467  13.537
  267    HE2  LYS  35           2HE      LYS  35   1.389   2.752  15.711
  268    HE3  LYS  35           1HE      LYS  35  -0.094   3.081  14.818
  269    HZ1  LYS  35           3HZ      LYS  35  -0.466   1.611  16.712
  270    HZ2  LYS  35           1HZ      LYS  35   0.610   0.476  16.064
  271    HZ3  LYS  35           2HZ      LYS  35  -0.832   0.835  15.255
  272    H    ILE  36           H        ILE  36  -1.900   5.020   9.997
  273    HA   ILE  36           HA       ILE  36  -0.026   6.031   7.985
  274    HB   ILE  36           HB       ILE  36  -2.857   6.904   8.580
  275   HG12  ILE  36          2HG1      ILE  36  -1.621   5.131   6.478
  276   HG13  ILE  36          1HG1      ILE  36  -2.972   4.778   7.549
  277   HG21  ILE  36          1HG2      ILE  36  -1.732   7.716   6.026
  278   HG22  ILE  36          2HG2      ILE  36  -0.847   8.392   7.392
  279   HG23  ILE  36          3HG2      ILE  36  -2.581   8.671   7.241
  280   HD11  ILE  36          3HD1      ILE  36  -2.920   6.472   5.085
  281   HD12  ILE  36          1HD1      ILE  36  -4.200   6.637   6.287
  282   HD13  ILE  36          2HD1      ILE  36  -3.951   5.094   5.469
  283    H    ILE  37           H        ILE  37   1.352   7.614   8.492
  284    HA   ILE  37           HA       ILE  37   1.198   8.965  11.030
  285    HB   ILE  37           HB       ILE  37   3.172   8.949   8.769
  286   HG12  ILE  37          2HG1      ILE  37   4.653   8.488  10.886
  287   HG13  ILE  37          1HG1      ILE  37   3.108   8.110  11.642
  288   HG21  ILE  37          1HG2      ILE  37   3.058  10.959  10.995
  289   HG22  ILE  37          2HG2      ILE  37   3.201  11.244   9.260
  290   HG23  ILE  37          3HG2      ILE  37   4.556  10.556  10.153
  291   HD11  ILE  37          3HD1      ILE  37   2.696   6.434   9.893
  292   HD12  ILE  37          1HD1      ILE  37   4.155   6.101  10.825
  293   HD13  ILE  37          2HD1      ILE  37   4.281   6.789   9.206
  294    H    GLU  38           H        GLU  38   0.969  11.202  11.371
  295    HA   GLU  38           HA       GLU  38  -0.929  12.511   9.742
  296    HB2  GLU  38           2HB      GLU  38   0.700  13.289  12.117
  297    HB3  GLU  38           1HB      GLU  38  -0.063  14.567  11.183
  298    HG2  GLU  38           2HG      GLU  38  -2.065  12.678  11.532
  299    HG3  GLU  38           1HG      GLU  38  -1.217  12.723  13.078
  300    H    GLY  39           H        GLY  39  -0.763  14.327   8.415
  301    HA2  GLY  39           2HA      GLY  39   0.148  15.655   6.795
  302    HA3  GLY  39           1HA      GLY  39   1.594  15.706   7.789
  303    H    GLY  40           H        GLY  40   0.597  12.558   6.780
  304    HA2  GLY  40           2HA      GLY  40   2.946  12.393   5.059
  305    HA3  GLY  40           1HA      GLY  40   1.996  11.043   5.657
  306    H    ALA  41           H        ALA  41   2.772  11.012   3.077
  307    HA   ALA  41           HA       ALA  41   1.321  12.181   1.088
  308    HB1  ALA  41           3HB      ALA  41   1.778  10.227  -0.276
  309    HB2  ALA  41           1HB      ALA  41   2.128   9.277   1.169
  310    HB3  ALA  41           2HB      ALA  41   3.179  10.621   0.720
  311    H    ALA  42           H        ALA  42   0.407   9.045   2.580
  312    HA   ALA  42           HA       ALA  42  -2.109   8.904   1.306
  313    HB1  ALA  42           3HB      ALA  42  -1.235   6.871   2.079
  314    HB2  ALA  42           1HB      ALA  42  -2.596   7.206   3.150
  315    HB3  ALA  42           2HB      ALA  42  -0.947   7.511   3.697
  316    H    HIS  43           H        HIS  43  -1.213   9.858   4.614
  317    HA   HIS  43           HA       HIS  43  -3.699  10.380   5.673
  318    HD1  HIS  43           1HD      HIS  43  -2.464  14.064   6.953
  319    HD2  HIS  43           2HD      HIS  43  -3.431  10.583   9.007
  320    HE1  HIS  43           1HE      HIS  43  -3.706  14.819   9.000
  321    HE2  HIS  43           2HE      HIS  43  -4.328  12.694  10.207
  322    HB2  HIS  43           2HB      HIS  43  -1.570  10.435   6.931
  323    HB3  HIS  43           1HB      HIS  43  -1.172  11.966   6.161
  324    H    LYS  44           H        LYS  44  -1.631  12.665   3.871
  325    HA   LYS  44           HA       LYS  44  -3.499  14.811   3.999
  326    HB2  LYS  44           2HB      LYS  44  -0.850  14.368   2.940
  327    HB3  LYS  44           1HB      LYS  44  -1.837  15.238   1.775
  328    HG2  LYS  44           2HG      LYS  44  -2.392  16.883   3.539
  329    HG3  LYS  44           1HG      LYS  44  -1.283  16.041   4.623
  330    HD2  LYS  44           2HD      LYS  44   0.075  16.547   2.173
  331    HD3  LYS  44           1HD      LYS  44  -0.699  18.045   2.694
  332    HE2  LYS  44           2HE      LYS  44   0.309  17.485   5.008
  333    HE3  LYS  44           1HE      LYS  44   1.355  16.386   4.112
  334    HZ1  LYS  44           3HZ      LYS  44   2.105  18.256   2.771
  335    HZ2  LYS  44           1HZ      LYS  44   2.397  18.540   4.414
  336    HZ3  LYS  44           2HZ      LYS  44   1.105  19.309   3.639
  337    H    ASP  45           H        ASP  45  -2.826  12.298   1.601
  338    HA   ASP  45           HA       ASP  45  -4.416  13.334  -0.481
  339    HB2  ASP  45           2HB      ASP  45  -2.693  11.342  -0.433
  340    HB3  ASP  45           1HB      ASP  45  -4.123  10.377  -0.088
  341    H    GLY  46           H        GLY  46  -5.173  10.894   2.011
  342    HA2  GLY  46           2HA      GLY  46  -7.242  10.713   3.130
  343    HA3  GLY  46           1HA      GLY  46  -7.986  11.686   1.873
  344    H    LYS  47           H        LYS  47  -6.722   9.966  -0.248
  345    HA   LYS  47           HA       LYS  47  -8.866   8.196  -0.648
  346    HB2  LYS  47           2HB      LYS  47  -6.131   8.337  -1.920
  347    HB3  LYS  47           1HB      LYS  47  -7.378   7.216  -2.449
  348    HG2  LYS  47           2HG      LYS  47  -7.926  10.154  -2.314
  349    HG3  LYS  47           1HG      LYS  47  -7.090   9.448  -3.697
  350    HD2  LYS  47           2HD      LYS  47  -8.973   8.556  -4.518
  351    HD3  LYS  47           1HD      LYS  47  -9.489   7.974  -2.934
  352    HE2  LYS  47           2HE      LYS  47 -11.101   9.563  -3.741
  353    HE3  LYS  47           1HE      LYS  47 -10.230  10.277  -2.385
  354    HZ1  LYS  47           3HZ      LYS  47 -10.621  11.661  -4.509
  355    HZ2  LYS  47           1HZ      LYS  47  -9.323  10.777  -5.144
  356    HZ3  LYS  47           2HZ      LYS  47  -9.106  11.725  -3.759
  357    H    LEU  48           H        LEU  48  -5.548   7.602   0.502
  358    HA   LEU  48           HA       LEU  48  -6.087   4.783   0.882
  359    HG   LEU  48           HG       LEU  48  -4.185   3.434   0.837
  360    HB2  LEU  48           2HB      LEU  48  -3.839   5.924   0.211
  361    HB3  LEU  48           1HB      LEU  48  -3.655   6.182   1.935
  362   HD11  LEU  48          1HD1      LEU  48  -1.853   3.013   0.643
  363   HD12  LEU  48          2HD1      LEU  48  -1.447   4.604   1.287
  364   HD13  LEU  48          3HD1      LEU  48  -2.200   4.460  -0.301
  365   HD21  LEU  48          3HD2      LEU  48  -3.723   2.698   2.907
  366   HD22  LEU  48          1HD2      LEU  48  -4.155   4.340   3.377
  367   HD23  LEU  48          2HD2      LEU  48  -2.460   3.901   3.176
  368    H    GLN  49           H        GLN  49  -6.947   3.932   2.631
  369    HA   GLN  49           HA       GLN  49  -6.631   5.271   5.221
  370    HB2  GLN  49           2HB      GLN  49  -8.912   4.900   5.790
  371    HB3  GLN  49           1HB      GLN  49  -8.907   5.674   4.217
  372    HG2  GLN  49           2HG      GLN  49  -9.125   2.698   4.537
  373    HG3  GLN  49           1HG      GLN  49 -10.531   3.758   4.576
  374   HE21  GLN  49          1HE2      GLN  49  -8.476   1.970   2.631
  375   HE22  GLN  49          2HE2      GLN  49  -8.958   2.599   1.096
  376    H    ILE  50           H        ILE  50  -6.419   3.897   7.005
  377    HA   ILE  50           HA       ILE  50  -5.099   1.512   6.718
  378    HB   ILE  50           HB       ILE  50  -6.927   2.180   9.033
  379   HG12  ILE  50          2HG1      ILE  50  -4.267   2.697   9.737
  380   HG13  ILE  50          1HG1      ILE  50  -4.440   3.375   8.121
  381   HG21  ILE  50          1HG2      ILE  50  -6.261  -0.127   9.103
  382   HG22  ILE  50          2HG2      ILE  50  -5.351   0.761  10.325
  383   HG23  ILE  50          3HG2      ILE  50  -4.576   0.306   8.807
  384   HD11  ILE  50          3HD1      ILE  50  -5.293   5.171   9.093
  385   HD12  ILE  50          1HD1      ILE  50  -5.421   4.353  10.649
  386   HD13  ILE  50          2HD1      ILE  50  -6.720   4.204   9.464
  387    H    GLY  51           H        GLY  51  -5.629  -0.494   6.054
  388    HA2  GLY  51           2HA      GLY  51  -7.188  -2.382   6.429
  389    HA3  GLY  51           1HA      GLY  51  -8.485  -1.251   6.095
  390    H    ASP  52           H        ASP  52  -6.692  -0.031   3.886
  391    HA   ASP  52           HA       ASP  52  -7.757  -1.601   1.792
  392    HB2  ASP  52           2HB      ASP  52  -6.297  -0.077   0.332
  393    HB3  ASP  52           1HB      ASP  52  -7.573   0.674   1.277
  394    H    LYS  53           H        LYS  53  -6.631  -2.715   0.135
  395    HA   LYS  53           HA       LYS  53  -4.112  -3.919   1.065
  396    HB2  LYS  53           2HB      LYS  53  -4.698  -5.816  -0.452
  397    HB3  LYS  53           1HB      LYS  53  -5.818  -5.586   0.878
  398    HG2  LYS  53           2HG      LYS  53  -6.683  -4.101  -1.422
  399    HG3  LYS  53           1HG      LYS  53  -6.423  -5.798  -1.831
  400    HD2  LYS  53           2HD      LYS  53  -7.738  -5.723   0.677
  401    HD3  LYS  53           1HD      LYS  53  -8.588  -4.609  -0.398
  402    HE2  LYS  53           2HE      LYS  53  -9.668  -6.549  -0.927
  403    HE3  LYS  53           1HE      LYS  53  -8.352  -6.617  -2.096
  404    HZ1  LYS  53           3HZ      LYS  53  -8.566  -8.732  -1.034
  405    HZ2  LYS  53           1HZ      LYS  53  -8.490  -8.037   0.508
  406    HZ3  LYS  53           2HZ      LYS  53  -7.128  -8.022  -0.496
  407    H    LEU  54           H        LEU  54  -2.449  -4.246  -0.376
  408    HA   LEU  54           HA       LEU  54  -2.452  -2.359  -2.613
  409    HG   LEU  54           HG       LEU  54  -1.064  -0.796  -1.957
  410    HB2  LEU  54           2HB      LEU  54  -0.550  -3.032  -0.644
  411    HB3  LEU  54           1HB      LEU  54   0.126  -3.522  -2.186
  412   HD11  LEU  54          1HD1      LEU  54   1.456  -0.196  -1.369
  413   HD12  LEU  54          2HD1      LEU  54   1.357  -1.750  -0.541
  414   HD13  LEU  54          3HD1      LEU  54   0.231  -0.457  -0.127
  415   HD21  LEU  54          3HD2      LEU  54   0.407  -0.265  -3.691
  416   HD22  LEU  54          1HD2      LEU  54  -0.144  -1.895  -4.078
  417   HD23  LEU  54          2HD2      LEU  54   1.447  -1.649  -3.359
  418    H    LEU  55           H        LEU  55  -2.952  -3.093  -4.502
  419    HA   LEU  55           HA       LEU  55  -2.640  -5.859  -5.242
  420    HG   LEU  55           HG       LEU  55  -2.942  -5.655  -8.180
  421    HB2  LEU  55           2HB      LEU  55  -4.586  -4.463  -5.949
  422    HB3  LEU  55           1HB      LEU  55  -3.498  -3.515  -6.945
  423   HD11  LEU  55          1HD1      LEU  55  -3.641  -7.544  -7.230
  424   HD12  LEU  55          2HD1      LEU  55  -5.252  -7.120  -7.807
  425   HD13  LEU  55          3HD1      LEU  55  -4.760  -6.693  -6.168
  426   HD21  LEU  55          3HD2      LEU  55  -5.206  -3.919  -8.366
  427   HD22  LEU  55          1HD2      LEU  55  -5.668  -5.538  -8.890
  428   HD23  LEU  55          2HD2      LEU  55  -4.308  -4.718  -9.655
  429    H    ALA  56           H        ALA  56  -1.355  -2.725  -6.452
  430    HA   ALA  56           HA       ALA  56   1.177  -4.049  -7.042
  431    HB1  ALA  56           3HB      ALA  56   0.095  -4.511  -9.110
  432    HB2  ALA  56           1HB      ALA  56   1.145  -3.124  -9.418
  433    HB3  ALA  56           2HB      ALA  56  -0.589  -2.888  -9.198
  434    H    VAL  57           H        VAL  57   2.918  -2.547  -7.526
  435    HA   VAL  57           HA       VAL  57   2.320   0.289  -7.055
  436    HB   VAL  57           HB       VAL  57   4.689   0.065  -5.717
  437   HG11  VAL  57          1HG1      VAL  57   3.135   1.443  -4.758
  438   HG12  VAL  57          2HG1      VAL  57   3.092   0.086  -3.633
  439   HG13  VAL  57          3HG1      VAL  57   1.842   0.249  -4.866
  440   HG21  VAL  57          3HG2      VAL  57   4.569  -2.389  -5.756
  441   HG22  VAL  57          1HG2      VAL  57   3.029  -2.317  -4.900
  442   HG23  VAL  57          2HG2      VAL  57   4.502  -1.747  -4.115
  443    H    ASN  58           H        ASN  58   3.100   1.366  -8.741
  444    HA   ASN  58           HA       ASN  58   4.457   2.088 -10.412
  445    HB2  ASN  58           2HB      ASN  58   6.535   0.702  -8.711
  446    HB3  ASN  58           1HB      ASN  58   6.938   1.615 -10.161
  447   HD21  ASN  58          1HD2      ASN  58   7.751   3.508  -9.624
  448   HD22  ASN  58          2HD2      ASN  58   7.177   4.544  -8.367
  449    H    ASN  59           H        ASN  59   2.971  -0.195 -10.910
  450    HA   ASN  59           HA       ASN  59   2.702  -1.570 -12.725
  451    HB2  ASN  59           2HB      ASN  59   4.927  -0.253 -13.533
  452    HB3  ASN  59           1HB      ASN  59   5.559  -1.892 -13.398
  453   HD21  ASN  59          1HD2      ASN  59   4.505  -3.569 -14.621
  454   HD22  ASN  59          2HD2      ASN  59   3.687  -3.173 -16.090
  455    H    VAL  60           H        VAL  60   4.845  -2.189 -10.104
  456    HA   VAL  60           HA       VAL  60   5.031  -5.039 -10.706
  457    HB   VAL  60           HB       VAL  60   6.475  -5.270  -8.847
  458   HG11  VAL  60          1HG1      VAL  60   6.976  -2.765 -10.406
  459   HG12  VAL  60          2HG1      VAL  60   7.745  -4.344 -10.554
  460   HG13  VAL  60          3HG1      VAL  60   8.116  -3.309  -9.174
  461   HG21  VAL  60          3HG2      VAL  60   4.999  -3.071  -7.755
  462   HG22  VAL  60          1HG2      VAL  60   6.729  -2.752  -7.646
  463   HG23  VAL  60          2HG2      VAL  60   6.056  -4.221  -6.941
  464    H    CYS  61           H        CYS  61   4.097  -6.674  -9.384
  465    HA   CYS  61           HA       CYS  61   1.646  -5.807  -8.084
  466    HG   CYS  61           HG       CYS  61   3.315  -9.443  -7.690
  467    HB2  CYS  61           2HB      CYS  61   1.081  -8.178  -7.962
  468    HB3  CYS  61           1HB      CYS  61   1.553  -7.729  -9.595
  469    H    LEU  62           H        LEU  62   1.312  -5.709  -5.944
  470    HA   LEU  62           HA       LEU  62   3.541  -6.471  -4.203
  471    HG   LEU  62           HG       LEU  62   3.542  -5.227  -1.924
  472    HB2  LEU  62           2HB      LEU  62   2.216  -4.110  -4.396
  473    HB3  LEU  62           1HB      LEU  62   1.342  -4.871  -3.083
  474   HD11  LEU  62          1HD1      LEU  62   4.491  -4.074  -4.431
  475   HD12  LEU  62          2HD1      LEU  62   5.340  -5.053  -3.233
  476   HD13  LEU  62          3HD1      LEU  62   5.169  -3.314  -2.992
  477   HD21  LEU  62          3HD2      LEU  62   3.649  -3.034  -1.041
  478   HD22  LEU  62          1HD2      LEU  62   1.968  -3.306  -1.494
  479   HD23  LEU  62          2HD2      LEU  62   3.012  -2.328  -2.525
  480    H    GLU  63           H        GLU  63   1.579  -8.417  -5.202
  481    HA   GLU  63           HA       GLU  63  -0.028  -9.053  -2.867
  482    HB2  GLU  63           2HB      GLU  63   0.196 -10.305  -5.602
  483    HB3  GLU  63           1HB      GLU  63  -0.775 -11.004  -4.315
  484    HG2  GLU  63           2HG      GLU  63  -2.377  -9.414  -4.461
  485    HG3  GLU  63           1HG      GLU  63  -1.238  -8.151  -4.930
  486    H    GLU  64           H        GLU  64   1.137 -11.829  -4.552
  487    HA   GLU  64           HA       GLU  64   2.145 -13.040  -2.265
  488    HB2  GLU  64           2HB      GLU  64   2.584 -13.717  -5.135
  489    HB3  GLU  64           1HB      GLU  64   3.027 -14.771  -3.809
  490    HG2  GLU  64           2HG      GLU  64   0.484 -14.397  -3.167
  491    HG3  GLU  64           1HG      GLU  64   0.355 -14.091  -4.898
  492    H    VAL  65           H        VAL  65   3.535 -11.088  -1.700
  493    HA   VAL  65           HA       VAL  65   6.322 -11.715  -2.424
  494    HB   VAL  65           HB       VAL  65   6.854  -9.257  -2.171
  495   HG11  VAL  65          1HG1      VAL  65   5.171 -10.190  -4.493
  496   HG12  VAL  65          2HG1      VAL  65   6.928 -10.241  -4.344
  497   HG13  VAL  65          3HG1      VAL  65   6.101  -8.692  -4.490
  498   HG21  VAL  65          3HG2      VAL  65   4.722  -8.631  -1.086
  499   HG22  VAL  65          1HG2      VAL  65   3.890  -8.911  -2.616
  500   HG23  VAL  65          2HG2      VAL  65   5.100  -7.635  -2.492
  501    H    THR  66           H        THR  66   7.902 -11.118  -0.783
  502    HA   THR  66           HA       THR  66   6.916 -11.565   1.865
  503    HB   THR  66           HB       THR  66   9.396 -11.022   2.435
  504    HG1  THR  66           1HG      THR  66   9.851 -11.583  -0.277
  505   HG21  THR  66          3HG2      THR  66  10.185 -13.218   1.540
  506   HG22  THR  66          1HG2      THR  66   8.624 -13.375   0.734
  507   HG23  THR  66          2HG2      THR  66   8.702 -13.286   2.493
  508    H    HIS  67           H        HIS  67   7.376 -10.101   3.684
  509    HA   HIS  67           HA       HIS  67   6.217  -7.620   3.319
  510    HD1  HIS  67           1HD      HIS  67   4.930  -7.008   6.544
  511    HD2  HIS  67           2HD      HIS  67   8.521  -5.304   5.346
  512    HE1  HIS  67           1HE      HIS  67   4.775  -4.589   7.169
  513    HE2  HIS  67           2HE      HIS  67   6.898  -3.554   6.326
  514    HB2  HIS  67           2HB      HIS  67   6.421  -8.665   5.539
  515    HB3  HIS  67           1HB      HIS  67   8.137  -8.284   5.569
  516    H    GLU  68           H        GLU  68   9.647  -8.434   3.155
  517    HA   GLU  68           HA       GLU  68  10.727  -5.878   3.110
  518    HB2  GLU  68           2HB      GLU  68  12.521  -6.933   1.605
  519    HB3  GLU  68           1HB      GLU  68  12.293  -7.613   3.209
  520    HG2  GLU  68           2HG      GLU  68  10.620  -8.935   1.262
  521    HG3  GLU  68           1HG      GLU  68  12.317  -8.976   0.791
  522    H    GLU  69           H        GLU  69   9.279  -7.743   0.458
  523    HA   GLU  69           HA       GLU  69   9.896  -5.911  -1.606
  524    HB2  GLU  69           2HB      GLU  69   8.657  -8.395  -1.474
  525    HB3  GLU  69           1HB      GLU  69   7.372  -7.323  -2.016
  526    HG2  GLU  69           2HG      GLU  69  10.075  -7.442  -3.318
  527    HG3  GLU  69           1HG      GLU  69   8.703  -8.427  -3.822
  528    H    ALA  70           H        ALA  70   7.203  -6.142   0.670
  529    HA   ALA  70           HA       ALA  70   5.482  -4.214  -0.457
  530    HB1  ALA  70           3HB      ALA  70   5.834  -4.681   2.495
  531    HB2  ALA  70           1HB      ALA  70   5.004  -5.827   1.445
  532    HB3  ALA  70           2HB      ALA  70   4.381  -4.189   1.631
  533    H    VAL  71           H        VAL  71   8.208  -3.946   1.761
  534    HA   VAL  71           HA       VAL  71   7.912  -1.103   2.134
  535    HB   VAL  71           HB       VAL  71  10.042  -3.059   2.992
  536   HG11  VAL  71          1HG1      VAL  71  10.018  -0.081   3.124
  537   HG12  VAL  71          2HG1      VAL  71  11.362  -1.187   2.843
  538   HG13  VAL  71          3HG1      VAL  71  10.708  -0.990   4.469
  539   HG21  VAL  71          3HG2      VAL  71   7.612  -2.725   4.046
  540   HG22  VAL  71          1HG2      VAL  71   8.460  -1.435   4.898
  541   HG23  VAL  71          2HG2      VAL  71   9.030  -3.099   5.026
  542    H    THR  72           H        THR  72  10.020  -3.242   0.263
  543    HA   THR  72           HA       THR  72  11.812  -1.278  -0.649
  544    HB   THR  72           HB       THR  72  11.036  -3.940  -1.844
  545    HG1  THR  72           1HG      THR  72  12.172  -4.577  -0.208
  546   HG21  THR  72          3HG2      THR  72  12.064  -2.732  -3.620
  547   HG22  THR  72          1HG2      THR  72  13.268  -3.838  -2.957
  548   HG23  THR  72          2HG2      THR  72  13.327  -2.123  -2.551
  549    H    ALA  73           H        ALA  73   8.720  -2.412  -1.942
  550    HA   ALA  73           HA       ALA  73   8.965  -0.975  -4.405
  551    HB1  ALA  73           3HB      ALA  73   6.468  -2.138  -3.188
  552    HB2  ALA  73           1HB      ALA  73   7.638  -3.069  -4.124
  553    HB3  ALA  73           2HB      ALA  73   6.756  -1.743  -4.883
  554    H    LEU  74           H        LEU  74   7.320  -0.432  -1.289
  555    HA   LEU  74           HA       LEU  74   5.969   1.932  -2.155
  556    HG   LEU  74           HG       LEU  74   3.982   1.873  -0.738
  557    HB2  LEU  74           2HB      LEU  74   6.391   0.467   0.382
  558    HB3  LEU  74           1HB      LEU  74   6.033   2.178   0.523
  559   HD11  LEU  74          1HD1      LEU  74   4.994  -0.215  -1.945
  560   HD12  LEU  74          2HD1      LEU  74   3.259  -0.097  -1.667
  561   HD13  LEU  74          3HD1      LEU  74   4.254  -1.089  -0.604
  562   HD21  LEU  74          3HD2      LEU  74   4.298  -0.019   1.576
  563   HD22  LEU  74          1HD2      LEU  74   2.755   0.540   0.931
  564   HD23  LEU  74          2HD2      LEU  74   3.875   1.690   1.661
  565    H    LYS  75           H        LYS  75   9.061   1.190  -0.750
  566    HA   LYS  75           HA       LYS  75   9.691   3.942  -0.122
  567    HB2  LYS  75           2HB      LYS  75  11.738   3.180   0.730
  568    HB3  LYS  75           1HB      LYS  75  10.594   1.904   1.111
  569    HG2  LYS  75           2HG      LYS  75  11.678   0.399  -0.136
  570    HG3  LYS  75           1HG      LYS  75  11.960   1.538  -1.450
  571    HD2  LYS  75           2HD      LYS  75  14.102   1.050  -0.664
  572    HD3  LYS  75           1HD      LYS  75  13.713   2.588   0.109
  573    HE2  LYS  75           2HE      LYS  75  12.899   0.213   1.629
  574    HE3  LYS  75           1HE      LYS  75  14.640   0.379   1.407
  575    HZ1  LYS  75           3HZ      LYS  75  14.047   1.489   3.402
  576    HZ2  LYS  75           1HZ      LYS  75  12.793   2.342   2.648
  577    HZ3  LYS  75           2HZ      LYS  75  14.405   2.689   2.263
  578    H    ASN  76           H        ASN  76  10.061   1.870  -2.882
  579    HA   ASN  76           HA       ASN  76  12.170   3.376  -4.116
  580    HB2  ASN  76           2HB      ASN  76  11.674   0.938  -4.558
  581    HB3  ASN  76           1HB      ASN  76  10.261   1.461  -5.469
  582   HD21  ASN  76          1HD2      ASN  76  10.514   1.959  -7.553
  583   HD22  ASN  76          2HD2      ASN  76  12.033   2.142  -8.355
  584    H    THR  77           H        THR  77  10.964   5.455  -3.679
  585    HA   THR  77           HA       THR  77   9.237   6.104  -5.978
  586    HB   THR  77           HB       THR  77   8.261   7.891  -4.432
  587    HG1  THR  77           1HG      THR  77   9.841   7.726  -2.789
  588   HG21  THR  77          3HG2      THR  77   7.717   5.088  -3.508
  589   HG22  THR  77          1HG2      THR  77   7.103   5.748  -5.024
  590   HG23  THR  77          2HG2      THR  77   6.627   6.474  -3.488
  591    H    SER  78           H        SER  78   9.882   7.739  -7.242
  592    HA   SER  78           HA       SER  78  12.193   9.330  -6.355
  593    HG   SER  78           HG       SER  78  13.537   9.609  -9.455
  594    HB2  SER  78           2HB      SER  78  12.637   8.002  -8.354
  595    HB3  SER  78           1HB      SER  78  11.237   8.704  -9.161
  596    H    ASP  79           H        ASP  79   9.863  10.028  -8.946
  597    HA   ASP  79           HA       ASP  79   9.426  12.668  -7.749
  598    HB2  ASP  79           2HB      ASP  79   8.803  11.654 -10.534
  599    HB3  ASP  79           1HB      ASP  79   8.552  13.303  -9.971
  600    H    PHE  80           H        PHE  80   7.611   9.977  -9.213
  601    HA   PHE  80           HA       PHE  80   5.296  10.741  -7.565
  602    HD1  PHE  80           1HD      PHE  80   4.968  13.080  -9.787
  603    HD2  PHE  80           2HD      PHE  80   2.241   9.917  -8.962
  604    HE1  PHE  80           1HE      PHE  80   3.181  14.726  -9.408
  605    HE2  PHE  80           2HE      PHE  80   0.452  11.562  -8.581
  606    HZ   PHE  80           HZ       PHE  80   0.921  13.966  -8.801
  607    HB2  PHE  80           2HB      PHE  80   5.451  10.757 -10.418
  608    HB3  PHE  80           1HB      PHE  80   4.365   9.458  -9.932
  609    H    VAL  81           H        VAL  81   3.670   8.852  -7.422
  610    HA   VAL  81           HA       VAL  81   4.936   6.244  -7.645
  611    HB   VAL  81           HB       VAL  81   5.449   6.990  -5.347
  612   HG11  VAL  81          1HG1      VAL  81   3.096   8.262  -5.325
  613   HG12  VAL  81          2HG1      VAL  81   3.950   7.789  -3.858
  614   HG13  VAL  81          3HG1      VAL  81   2.635   6.789  -4.475
  615   HG21  VAL  81          3HG2      VAL  81   4.601   5.018  -4.189
  616   HG22  VAL  81          1HG2      VAL  81   5.128   4.614  -5.822
  617   HG23  VAL  81          2HG2      VAL  81   3.409   4.771  -5.464
  618    H    TYR  82           H        TYR  82   3.540   4.965  -8.664
  619    HA   TYR  82           HA       TYR  82   0.699   5.676  -8.626
  620    HD1  TYR  82           1HD      TYR  82  -0.240   2.430 -10.408
  621    HD2  TYR  82           2HD      TYR  82   0.142   6.505 -11.568
  622    HE1  TYR  82           1HE      TYR  82  -2.444   2.328 -11.476
  623    HE2  TYR  82           2HE      TYR  82  -2.066   6.413 -12.636
  624    HH   TYR  82           HH       TYR  82  -3.528   4.034 -13.637
  625    HB2  TYR  82           2HB      TYR  82   2.054   5.261 -10.776
  626    HB3  TYR  82           1HB      TYR  82   1.921   3.553 -10.371
  627    H    LEU  83           H        LEU  83  -0.153   4.873  -6.828
  628    HA   LEU  83           HA       LEU  83   0.431   2.179  -5.941
  629    HG   LEU  83           HG       LEU  83  -1.064   1.541  -3.955
  630    HB2  LEU  83           2HB      LEU  83   0.111   4.217  -4.442
  631    HB3  LEU  83           1HB      LEU  83  -1.604   4.055  -4.768
  632   HD11  LEU  83          1HD1      LEU  83   0.766   3.276  -2.303
  633   HD12  LEU  83          2HD1      LEU  83   1.310   2.135  -3.533
  634   HD13  LEU  83          3HD1      LEU  83   0.460   1.551  -2.103
  635   HD21  LEU  83          3HD2      LEU  83  -1.464   3.129  -1.613
  636   HD22  LEU  83          1HD2      LEU  83  -2.623   2.139  -2.497
  637   HD23  LEU  83          2HD2      LEU  83  -2.374   3.824  -2.954
  638    H    LYS  84           H        LYS  84  -0.739   0.425  -6.308
  639    HA   LYS  84           HA       LYS  84  -3.422   0.725  -7.471
  640    HB2  LYS  84           2HB      LYS  84  -1.207  -1.170  -8.108
  641    HB3  LYS  84           1HB      LYS  84  -2.867  -1.693  -8.331
  642    HG2  LYS  84           2HG      LYS  84  -1.473   0.607  -9.675
  643    HG3  LYS  84           1HG      LYS  84  -2.062  -0.883 -10.416
  644    HD2  LYS  84           2HD      LYS  84  -3.726   1.328  -9.213
  645    HD3  LYS  84           1HD      LYS  84  -3.588   0.914 -10.922
  646    HE2  LYS  84           2HE      LYS  84  -4.488  -1.377 -10.273
  647    HE3  LYS  84           1HE      LYS  84  -4.903  -0.654  -8.719
  648    HZ1  LYS  84           3HZ      LYS  84  -6.797  -0.561 -10.149
  649    HZ2  LYS  84           1HZ      LYS  84  -5.908   0.173 -11.388
  650    HZ3  LYS  84           2HZ      LYS  84  -6.216   1.015  -9.954
  651    H    VAL  85           H        VAL  85  -5.013   0.098  -6.172
  652    HA   VAL  85           HA       VAL  85  -4.433  -2.022  -4.214
  653    HB   VAL  85           HB       VAL  85  -6.110  -0.951  -2.716
  654   HG11  VAL  85          1HG1      VAL  85  -4.605   0.581  -1.777
  655   HG12  VAL  85          2HG1      VAL  85  -3.917   1.001  -3.346
  656   HG13  VAL  85          3HG1      VAL  85  -3.587  -0.578  -2.633
  657   HG21  VAL  85          3HG2      VAL  85  -6.876   1.281  -3.087
  658   HG22  VAL  85          1HG2      VAL  85  -7.265   0.339  -4.526
  659   HG23  VAL  85          2HG2      VAL  85  -5.887   1.441  -4.539
  660    H    ALA  86           H        ALA  86  -5.799  -3.704  -4.105
  661    HA   ALA  86           HA       ALA  86  -7.959  -3.825  -6.058
  662    HB1  ALA  86           3HB      ALA  86  -6.530  -5.884  -4.414
  663    HB2  ALA  86           1HB      ALA  86  -6.624  -5.732  -6.168
  664    HB3  ALA  86           2HB      ALA  86  -8.034  -6.262  -5.253
  665    H    LYS  87           H        LYS  87 -10.085  -4.555  -5.524
  666    HA   LYS  87           HA       LYS  87 -10.937  -3.681  -2.860
  667    HB2  LYS  87           2HB      LYS  87 -12.185  -3.734  -5.541
  668    HB3  LYS  87           1HB      LYS  87 -13.260  -4.093  -4.196
  669    HG2  LYS  87           2HG      LYS  87 -11.498  -1.713  -3.974
  670    HG3  LYS  87           1HG      LYS  87 -12.882  -1.632  -5.065
  671    HD2  LYS  87           2HD      LYS  87 -13.764  -2.805  -2.636
  672    HD3  LYS  87           1HD      LYS  87 -12.827  -1.367  -2.228
  673    HE2  LYS  87           2HE      LYS  87 -14.967  -0.519  -2.499
  674    HE3  LYS  87           1HE      LYS  87 -14.229  -0.217  -4.071
  675    HZ1  LYS  87           3HZ      LYS  87 -15.289  -2.253  -4.889
  676    HZ2  LYS  87           1HZ      LYS  87 -16.428  -1.128  -4.342
  677    HZ3  LYS  87           2HZ      LYS  87 -16.042  -2.470  -3.389
  678    HA   PRO  88           HA       PRO  88 -11.519  -7.955  -1.716
  679    HB2  PRO  88           2HB      PRO  88 -12.785  -7.533   0.641
  680    HB3  PRO  88           1HB      PRO  88 -11.050  -7.269   0.431
  681    HG2  PRO  88           2HG      PRO  88 -13.284  -5.274   0.401
  682    HG3  PRO  88           1HG      PRO  88 -11.703  -5.169   1.199
  683    HD2  PRO  88           2HD      PRO  88 -12.226  -3.952  -1.162
  684    HD3  PRO  88           1HD      PRO  88 -10.619  -4.580  -0.748
  685    H    THR  89           H        THR  89 -13.186  -9.492  -1.578
  686    HA   THR  89           HA       THR  89 -15.945  -8.577  -1.817
  687    HB   THR  89           HB       THR  89 -16.201 -10.294  -3.754
  688    HG1  THR  89           1HG      THR  89 -13.479  -9.610  -4.134
  689   HG21  THR  89          3HG2      THR  89 -16.533  -7.899  -4.078
  690   HG22  THR  89          1HG2      THR  89 -15.732  -8.644  -5.460
  691   HG23  THR  89          2HG2      THR  89 -14.796  -7.692  -4.307
  692    H    GLY  90           H        GLY  90 -14.240 -11.677  -2.372
  693    HA2  GLY  90           2HA      GLY  90 -14.175 -13.308  -0.520
  694    HA3  GLY  90           1HA      GLY  90 -15.815 -12.809  -0.137
  695    H    SER  91           H        SER  91 -14.213 -15.319  -1.270
  696    HA   SER  91           HA       SER  91 -16.025 -15.953  -3.484
  697    HG   SER  91           HG       SER  91 -14.031 -16.601  -5.184
  698    HB2  SER  91           2HB      SER  91 -13.438 -17.159  -2.521
  699    HB3  SER  91           1HB      SER  91 -14.486 -18.018  -3.649
  700    H    HIS  92           H        HIS  92 -14.947 -17.258  -0.356
  701    HA   HIS  92           HA       HIS  92 -16.835 -19.425  -0.413
  702    HD1  HIS  92           1HD      HIS  92 -12.939 -18.133   0.921
  703    HD2  HIS  92           2HD      HIS  92 -14.716 -21.794   0.078
  704    HE1  HIS  92           1HE      HIS  92 -11.127 -19.539  -0.109
  705    HE2  HIS  92           2HE      HIS  92 -12.247 -21.720  -0.687
  706    HB2  HIS  92           2HB      HIS  92 -15.248 -18.376   1.940
  707    HB3  HIS  92           1HB      HIS  92 -16.033 -19.946   1.818
  708    HA   ARG 301           HA       ARG 301   2.230 -10.751  10.197
  709    HE   ARG 301           HE       ARG 301  -2.887 -11.670  12.376
  710    H1   ARG 301           1HT      ARG 301   3.065 -12.271  12.574
  711    H2   ARG 301           2HT      ARG 301   3.879 -12.330  11.065
  712    H3   ARG 301           3HT      ARG 301   2.246 -12.844  11.180
  713    HB2  ARG 301           2HB      ARG 301   1.546 -10.619  13.143
  714    HB3  ARG 301           1HB      ARG 301   1.006  -9.450  11.946
  715    HG2  ARG 301           2HG      ARG 301   0.211 -11.809  10.828
  716    HG3  ARG 301           1HG      ARG 301   0.003 -12.124  12.552
  717    HD2  ARG 301           2HD      ARG 301  -0.984  -9.522  12.049
  718    HD3  ARG 301           1HD      ARG 301  -1.631 -10.574  10.792
  719   HH11  ARG 301          1HH1      ARG 301  -0.585  -9.574  13.989
  720   HH12  ARG 301          2HH1      ARG 301  -1.317  -9.768  15.545
  721   HH21  ARG 301          1HH2      ARG 301  -3.841 -11.919  14.433
  722   HH22  ARG 301          2HH2      ARG 301  -3.162 -11.098  15.798
  723    H    ARG 302           H        ARG 302   3.438  -9.051   9.647
  724    HA   ARG 302           HA       ARG 302   5.179  -7.818  11.666
  725    HE   ARG 302           HE       ARG 302   9.735  -6.405  10.367
  726    HB2  ARG 302           2HB      ARG 302   6.470  -9.409  10.215
  727    HB3  ARG 302           1HB      ARG 302   6.057  -8.396   8.837
  728    HG2  ARG 302           2HG      ARG 302   7.146  -6.480  10.108
  729    HG3  ARG 302           1HG      ARG 302   7.786  -7.708  11.199
  730    HD2  ARG 302           2HD      ARG 302   8.823  -8.819   9.199
  731    HD3  ARG 302           1HD      ARG 302   8.318  -7.428   8.238
  732   HH11  ARG 302          1HH1      ARG 302  10.382  -8.598   7.716
  733   HH12  ARG 302          2HH1      ARG 302  12.063  -8.191   7.629
  734   HH21  ARG 302          1HH2      ARG 302  11.951  -5.883  10.258
  735   HH22  ARG 302          2HH2      ARG 302  12.955  -6.652   9.074
  736    H    GLU 303           H        GLU 303   5.099  -5.666  11.699
  737    HA   GLU 303           HA       GLU 303   3.924  -4.265   9.387
  738    HB2  GLU 303           2HB      GLU 303   3.501  -3.650  12.321
  739    HB3  GLU 303           1HB      GLU 303   2.892  -2.684  10.985
  740    HG2  GLU 303           2HG      GLU 303   1.044  -3.918  11.516
  741    HG3  GLU 303           1HG      GLU 303   1.762  -4.911  10.248
  742    H    THR 304           H        THR 304   5.248  -2.816   8.513
  743    HA   THR 304           HA       THR 304   7.212  -1.465  10.234
  744    HB   THR 304           HB       THR 304   7.738  -3.311   8.057
  745    HG1  THR 304           1HG      THR 304   9.393  -1.949   9.914
  746   HG21  THR 304          3HG2      THR 304   7.990  -1.338   6.671
  747   HG22  THR 304          1HG2      THR 304   9.542  -2.117   6.977
  748   HG23  THR 304          2HG2      THR 304   9.107  -0.646   7.848
  749    H    GLN 305           H        GLN 305   7.793   0.634   9.633
  750    HA   GLN 305           HA       GLN 305   5.790   2.027   8.097
  751    HB2  GLN 305           2HB      GLN 305   8.049   2.815   9.864
  752    HB3  GLN 305           1HB      GLN 305   7.499   3.986   8.673
  753    HG2  GLN 305           2HG      GLN 305   5.368   4.126   9.619
  754    HG3  GLN 305           1HG      GLN 305   5.582   2.638  10.540
  755   HE21  GLN 305          1HE2      GLN 305   6.560   6.003  10.279
  756   HE22  GLN 305          2HE2      GLN 305   7.038   6.185  11.929
  757    H    VAL 306           H        VAL 306   6.157   3.347   6.296
  758    HA   VAL 306           HA       VAL 306   8.673   2.986   4.844
  759    HB   VAL 306           HB       VAL 306   7.393   2.523   2.739
  760   HG11  VAL 306          1HG1      VAL 306   8.562   0.758   3.970
  761   HG12  VAL 306          2HG1      VAL 306   7.103   0.146   3.193
  762   HG13  VAL 306          3HG1      VAL 306   7.112   0.464   4.927
  763   HG21  VAL 306          3HG2      VAL 306   5.133   2.334   4.708
  764   HG22  VAL 306          1HG2      VAL 306   5.098   1.448   3.184
  765   HG23  VAL 306          2HG2      VAL 306   5.200   3.208   3.177
  Start of MODEL   20
    1    HA   MET   1           HA       MET   1  -8.448   1.350  -9.695
    2    H1   MET   1           1HT      MET   1  -9.007  -0.764  -8.797
    3    H2   MET   1           2HT      MET   1  -7.671  -0.694  -7.722
    4    H3   MET   1           3HT      MET   1  -7.410  -0.772  -9.416
    5    HB2  MET   1           2HB      MET   1  -9.517   0.767  -7.197
    6    HB3  MET   1           1HB      MET   1  -8.373   2.059  -6.864
    7    HG2  MET   1           2HG      MET   1 -10.145   2.464  -9.184
    8    HG3  MET   1           1HG      MET   1 -10.917   2.468  -7.600
    9    HE1  MET   1           3HE      MET   1  -9.447   3.847  -5.535
   10    HE2  MET   1           1HE      MET   1 -11.008   4.462  -6.081
   11    HE3  MET   1           2HE      MET   1  -9.653   5.569  -5.855
   12    H    GLU   2           H        GLU   2  -7.180   3.271  -9.624
   13    HA   GLU   2           HA       GLU   2  -4.486   2.895  -8.485
   14    HB2  GLU   2           2HB      GLU   2  -3.589   4.138 -10.401
   15    HB3  GLU   2           1HB      GLU   2  -4.422   2.679 -10.911
   16    HG2  GLU   2           2HG      GLU   2  -6.015   5.168 -10.851
   17    HG3  GLU   2           1HG      GLU   2  -4.767   5.044 -12.088
   18    H    ILE   3           H        ILE   3  -3.325   4.836  -7.918
   19    HA   ILE   3           HA       ILE   3  -4.855   7.296  -7.648
   20    HB   ILE   3           HB       ILE   3  -3.678   5.798  -5.295
   21   HG12  ILE   3          2HG1      ILE   3  -6.154   6.573  -4.526
   22   HG13  ILE   3          1HG1      ILE   3  -6.420   6.387  -6.255
   23   HG21  ILE   3          1HG2      ILE   3  -4.378   7.796  -3.963
   24   HG22  ILE   3          2HG2      ILE   3  -4.612   8.651  -5.487
   25   HG23  ILE   3          3HG2      ILE   3  -3.010   8.065  -5.042
   26   HD11  ILE   3          3HD1      ILE   3  -4.973   4.130  -5.283
   27   HD12  ILE   3          1HD1      ILE   3  -6.574   4.197  -6.020
   28   HD13  ILE   3          2HD1      ILE   3  -6.397   4.397  -4.277
   29    H    LYS   4           H        LYS   4  -3.509   8.799  -8.514
   30    HA   LYS   4           HA       LYS   4  -0.674   8.309  -8.632
   31    HB2  LYS   4           2HB      LYS   4  -2.200  10.775  -9.485
   32    HB3  LYS   4           1HB      LYS   4  -0.562  10.341  -9.952
   33    HG2  LYS   4           2HG      LYS   4  -1.419   9.379 -11.753
   34    HG3  LYS   4           1HG      LYS   4  -2.112   8.151 -10.692
   35    HD2  LYS   4           2HD      LYS   4  -4.048   9.822 -10.379
   36    HD3  LYS   4           1HD      LYS   4  -3.399  10.620 -11.813
   37    HE2  LYS   4           2HE      LYS   4  -3.501   8.311 -12.914
   38    HE3  LYS   4           1HE      LYS   4  -4.522   7.847 -11.553
   39    HZ1  LYS   4           3HZ      LYS   4  -6.053   9.624 -12.146
   40    HZ2  LYS   4           1HZ      LYS   4  -5.844   8.554 -13.440
   41    HZ3  LYS   4           2HZ      LYS   4  -5.076  10.061 -13.456
   42    H    LEU   5           H        LEU   5   0.032   8.344  -6.548
   43    HA   LEU   5           HA       LEU   5  -0.409  10.671  -4.875
   44    HG   LEU   5           HG       LEU   5  -1.595   8.922  -3.697
   45    HB2  LEU   5           2HB      LEU   5   0.735   7.968  -4.507
   46    HB3  LEU   5           1HB      LEU   5   1.366   9.225  -3.460
   47   HD11  LEU   5          1HD1      LEU   5  -0.928   6.647  -3.359
   48   HD12  LEU   5          2HD1      LEU   5  -1.525   7.285  -1.827
   49   HD13  LEU   5          3HD1      LEU   5   0.210   7.117  -2.096
   50   HD21  LEU   5          3HD2      LEU   5  -0.600  10.782  -2.432
   51   HD22  LEU   5          1HD2      LEU   5   0.230   9.619  -1.398
   52   HD23  LEU   5          2HD2      LEU   5  -1.532   9.697  -1.400
   53    H    ILE   6           H        ILE   6   0.972  12.232  -4.354
   54    HA   ILE   6           HA       ILE   6   3.389  12.536  -5.945
   55    HB   ILE   6           HB       ILE   6   1.509  14.324  -5.386
   56   HG12  ILE   6          2HG1      ILE   6   4.332  15.343  -5.245
   57   HG13  ILE   6          1HG1      ILE   6   3.738  14.552  -6.704
   58   HG21  ILE   6          1HG2      ILE   6   1.939  15.736  -3.537
   59   HG22  ILE   6          2HG2      ILE   6   3.449  14.906  -3.164
   60   HG23  ILE   6          3HG2      ILE   6   1.907  14.084  -2.922
   61   HD11  ILE   6          3HD1      ILE   6   3.470  16.870  -7.023
   62   HD12  ILE   6          1HD1      ILE   6   2.747  17.080  -5.429
   63   HD13  ILE   6          2HD1      ILE   6   1.860  16.229  -6.693
   64    H    LYS   7           H        LYS   7   5.474  13.045  -4.951
   65    HA   LYS   7           HA       LYS   7   5.897  11.593  -2.485
   66    HB2  LYS   7           2HB      LYS   7   7.482  11.213  -4.252
   67    HB3  LYS   7           1HB      LYS   7   7.772  12.935  -4.433
   68    HG2  LYS   7           2HG      LYS   7   9.579  12.537  -3.184
   69    HG3  LYS   7           1HG      LYS   7   8.448  12.567  -1.832
   70    HD2  LYS   7           2HD      LYS   7   8.225   9.985  -2.672
   71    HD3  LYS   7           1HD      LYS   7   9.923  10.321  -3.013
   72    HE2  LYS   7           2HE      LYS   7   9.977  11.289  -0.622
   73    HE3  LYS   7           1HE      LYS   7   8.472  10.400  -0.392
   74    HZ1  LYS   7           3HZ      LYS   7  11.037   9.187  -1.271
   75    HZ2  LYS   7           1HZ      LYS   7   9.600   8.361  -0.931
   76    HZ3  LYS   7           2HZ      LYS   7  10.440   9.144   0.311
   77    H    GLY   8           H        GLY   8   6.297  12.471  -0.517
   78    HA2  GLY   8           2HA      GLY   8   6.086  15.385  -0.286
   79    HA3  GLY   8           1HA      GLY   8   5.881  14.224   1.017
   80    HA   PRO   9           HA       PRO   9  10.097  16.274   1.344
   81    HB2  PRO   9           2HB      PRO   9   9.341  16.378   4.199
   82    HB3  PRO   9           1HB      PRO   9   9.986  17.649   3.159
   83    HG2  PRO   9           2HG      PRO   9   7.427  17.654   3.958
   84    HG3  PRO   9           1HG      PRO   9   7.906  18.234   2.352
   85    HD2  PRO   9           2HD      PRO   9   6.667  15.623   3.136
   86    HD3  PRO   9           1HD      PRO   9   6.340  16.647   1.722
   87    H    LYS  10           H        LYS  10   9.046  14.568   4.305
   88    HA   LYS  10           HA       LYS  10  11.421  13.086   4.525
   89    HB2  LYS  10           2HB      LYS  10   8.722  12.466   5.741
   90    HB3  LYS  10           1HB      LYS  10  10.268  11.824   6.278
   91    HG2  LYS  10           2HG      LYS  10  10.992  14.077   6.889
   92    HG3  LYS  10           1HG      LYS  10   9.438  14.718   6.354
   93    HD2  LYS  10           2HD      LYS  10   8.384  14.051   8.223
   94    HD3  LYS  10           1HD      LYS  10   9.225  12.500   8.255
   95    HE2  LYS  10           2HE      LYS  10  10.717  14.992   8.939
   96    HE3  LYS  10           1HE      LYS  10   9.633  14.280  10.133
   97    HZ1  LYS  10           3HZ      LYS  10  11.866  12.848   8.795
   98    HZ2  LYS  10           1HZ      LYS  10  10.862  12.225  10.006
   99    HZ3  LYS  10           2HZ      LYS  10  11.924  13.492  10.357
  100    H    GLY  11           H        GLY  11   8.151  11.809   3.816
  101    HA2  GLY  11           2HA      GLY  11   9.002  10.250   1.607
  102    HA3  GLY  11           1HA      GLY  11   8.957   9.255   3.052
  103    H    LEU  12           H        LEU  12   7.236   7.973   2.728
  104    HA   LEU  12           HA       LEU  12   4.823   8.879   1.495
  105    HG   LEU  12           HG       LEU  12   6.434   6.924   0.581
  106    HB2  LEU  12           2HB      LEU  12   5.448   6.348   3.012
  107    HB3  LEU  12           1HB      LEU  12   3.943   6.644   2.168
  108   HD11  LEU  12          1HD1      LEU  12   7.146   4.821   0.713
  109   HD12  LEU  12          2HD1      LEU  12   5.507   4.175   0.624
  110   HD13  LEU  12          3HD1      LEU  12   6.170   4.687   2.175
  111   HD21  LEU  12          3HD2      LEU  12   3.887   5.482  -0.093
  112   HD22  LEU  12          1HD2      LEU  12   5.082   6.176  -1.187
  113   HD23  LEU  12          2HD2      LEU  12   4.041   7.233  -0.233
  114    H    GLY  13           H        GLY  13   5.828   8.294   4.846
  115    HA2  GLY  13           2HA      GLY  13   4.989   9.302   6.759
  116    HA3  GLY  13           1HA      GLY  13   3.726  10.038   5.792
  117    H    PHE  14           H        PHE  14   4.413   6.574   5.913
  118    HA   PHE  14           HA       PHE  14   2.371   6.000   7.826
  119    HD1  PHE  14           2HD      PHE  14   2.431   3.230   4.975
  120    HD2  PHE  14           1HD      PHE  14   1.154   7.086   3.709
  121    HE1  PHE  14           2HE      PHE  14   2.885   2.605   2.644
  122    HE2  PHE  14           1HE      PHE  14   1.600   6.468   1.370
  123    HZ   PHE  14           HZ       PHE  14   2.465   4.226   0.835
  124    HB2  PHE  14           2HB      PHE  14   0.827   4.811   6.343
  125    HB3  PHE  14           1HB      PHE  14   0.925   6.513   5.920
  126    H    SER  15           H        SER  15   1.813   3.385   7.371
  127    HA   SER  15           HA       SER  15   4.406   2.091   6.954
  128    HG   SER  15           HG       SER  15   2.622   2.960   9.842
  129    HB2  SER  15           2HB      SER  15   3.409   0.471   8.827
  130    HB3  SER  15           1HB      SER  15   4.400   1.864   9.241
  131    H    ILE  16           H        ILE  16   4.018  -0.391   6.824
  132    HA   ILE  16           HA       ILE  16   1.442  -1.171   5.750
  133    HB   ILE  16           HB       ILE  16   2.016  -1.635   3.569
  134   HG12  ILE  16          2HG1      ILE  16   4.055  -2.901   3.981
  135   HG13  ILE  16          1HG1      ILE  16   4.276  -1.777   2.646
  136   HG21  ILE  16          1HG2      ILE  16   1.884   0.755   3.798
  137   HG22  ILE  16          2HG2      ILE  16   3.086   0.340   2.576
  138   HG23  ILE  16          3HG2      ILE  16   3.602   0.839   4.185
  139   HD11  ILE  16          3HD1      ILE  16   5.045  -0.443   4.995
  140   HD12  ILE  16          1HD1      ILE  16   6.055  -0.969   3.651
  141   HD13  ILE  16          2HD1      ILE  16   5.790  -2.043   5.024
  142    H    ALA  17           H        ALA  17   1.544  -3.466   4.982
  143    HA   ALA  17           HA       ALA  17   3.601  -5.092   6.274
  144    HB1  ALA  17           3HB      ALA  17   2.065  -5.379   7.950
  145    HB2  ALA  17           1HB      ALA  17   1.515  -6.634   6.843
  146    HB3  ALA  17           2HB      ALA  17   0.688  -5.076   6.895
  147    H    GLY  18           H        GLY  18   3.334  -7.462   5.377
  148    HA2  GLY  18           2HA      GLY  18   1.805  -8.095   3.211
  149    HA3  GLY  18           1HA      GLY  18   3.111  -7.167   2.518
  150    H    GLY  19           H        GLY  19   2.115 -10.268   2.799
  151    HA2  GLY  19           2HA      GLY  19   3.627 -11.907   1.875
  152    HA3  GLY  19           1HA      GLY  19   4.920 -11.170   2.799
  153    H    VAL  20           H        VAL  20   4.230 -13.929   2.694
  154    HA   VAL  20           HA       VAL  20   2.765 -14.766   4.963
  155    HB   VAL  20           HB       VAL  20   5.034 -16.319   3.703
  156   HG11  VAL  20          1HG1      VAL  20   2.581 -17.096   5.263
  157   HG12  VAL  20          2HG1      VAL  20   4.272 -17.388   5.670
  158   HG13  VAL  20          3HG1      VAL  20   3.527 -18.250   4.324
  159   HG21  VAL  20          3HG2      VAL  20   3.812 -15.872   1.804
  160   HG22  VAL  20          1HG2      VAL  20   2.285 -15.770   2.679
  161   HG23  VAL  20          2HG2      VAL  20   3.022 -17.342   2.377
  162    H    GLY  21           H        GLY  21   3.511 -15.500   7.011
  163    HA2  GLY  21           2HA      GLY  21   5.001 -15.700   8.803
  164    HA3  GLY  21           1HA      GLY  21   6.293 -15.132   7.757
  165    H    ASN  22           H        ASN  22   4.422 -12.804   7.042
  166    HA   ASN  22           HA       ASN  22   4.561 -11.247   9.515
  167    HB2  ASN  22           2HB      ASN  22   5.666  -9.398   8.450
  168    HB3  ASN  22           1HB      ASN  22   6.640 -10.812   8.069
  169   HD21  ASN  22          1HD2      ASN  22   4.554  -8.377   6.870
  170   HD22  ASN  22          2HD2      ASN  22   4.824  -8.691   5.197
  171    H    GLN  23           H        GLN  23   2.497 -12.530   7.590
  172    HA   GLN  23           HA       GLN  23   1.098 -10.776   6.078
  173    HB2  GLN  23           2HB      GLN  23   0.546 -13.284   7.417
  174    HB3  GLN  23           1HB      GLN  23  -0.892 -12.279   7.309
  175    HG2  GLN  23           2HG      GLN  23  -0.344 -12.013   4.849
  176    HG3  GLN  23           1HG      GLN  23   0.822 -13.316   5.077
  177   HE21  GLN  23          1HE2      GLN  23  -0.167 -15.270   6.268
  178   HE22  GLN  23          2HE2      GLN  23  -1.712 -15.784   5.691
  179    H    HIS  24           H        HIS  24  -0.440  -9.265   6.277
  180    HA   HIS  24           HA       HIS  24  -0.826  -8.043   8.899
  181    HD1  HIS  24           1HD      HIS  24  -0.179  -5.122   8.970
  182    HD2  HIS  24           2HD      HIS  24  -3.840  -5.572   7.074
  183    HE1  HIS  24           1HE      HIS  24  -1.594  -3.236   9.799
  184    HE2  HIS  24           2HE      HIS  24  -3.777  -3.456   8.565
  185    HB2  HIS  24           2HB      HIS  24  -0.191  -6.693   6.875
  186    HB3  HIS  24           1HB      HIS  24  -1.754  -7.073   6.187
  187    H    ILE  25           H        ILE  25  -2.608  -9.716   6.401
  188    HA   ILE  25           HA       ILE  25  -4.980  -9.737   8.135
  189    HB   ILE  25           HB       ILE  25  -5.097  -9.427   5.131
  190   HG12  ILE  25          2HG1      ILE  25  -4.256  -7.381   6.267
  191   HG13  ILE  25          1HG1      ILE  25  -5.822  -7.144   5.500
  192   HG21  ILE  25          1HG2      ILE  25  -6.966 -10.582   6.612
  193   HG22  ILE  25          2HG2      ILE  25  -7.366  -9.530   5.256
  194   HG23  ILE  25          3HG2      ILE  25  -7.414  -8.902   6.904
  195   HD11  ILE  25          3HD1      ILE  25  -6.342  -7.940   8.145
  196   HD12  ILE  25          1HD1      ILE  25  -6.587  -6.354   7.414
  197   HD13  ILE  25          2HD1      ILE  25  -5.063  -6.730   8.216
  198    HA   PRO  26           HA       PRO  26  -4.499 -14.144   7.632
  199    HB2  PRO  26           2HB      PRO  26  -7.073 -14.808   8.389
  200    HB3  PRO  26           1HB      PRO  26  -5.739 -14.514   9.508
  201    HG2  PRO  26           2HG      PRO  26  -7.922 -12.667   8.635
  202    HG3  PRO  26           1HG      PRO  26  -7.226 -12.896  10.250
  203    HD2  PRO  26           2HD      PRO  26  -6.550 -10.799   8.737
  204    HD3  PRO  26           1HD      PRO  26  -5.348 -11.616   9.757
  205    H    GLY  27           H        GLY  27  -4.491 -15.085   5.695
  206    HA2  GLY  27           2HA      GLY  27  -5.678 -16.263   3.982
  207    HA3  GLY  27           1HA      GLY  27  -6.972 -15.082   4.112
  208    H    ASP  28           H        ASP  28  -5.621 -12.692   3.912
  209    HA   ASP  28           HA       ASP  28  -4.690 -12.819   1.136
  210    HB2  ASP  28           2HB      ASP  28  -6.505 -11.124   2.422
  211    HB3  ASP  28           1HB      ASP  28  -5.074 -10.133   2.167
  212    H    ASN  29           H        ASN  29  -2.574 -12.894   0.869
  213    HA   ASN  29           HA       ASN  29  -0.754 -11.827   2.867
  214    HB2  ASN  29           2HB      ASN  29   0.045 -13.046   0.230
  215    HB3  ASN  29           1HB      ASN  29   0.977 -12.962   1.722
  216   HD21  ASN  29          1HD2      ASN  29   0.765 -14.544   3.215
  217   HD22  ASN  29          2HD2      ASN  29  -0.259 -15.922   3.028
  218    H    SER  30           H        SER  30  -2.465 -10.090   0.953
  219    HA   SER  30           HA       SER  30  -0.689  -8.742  -0.792
  220    HG   SER  30           HG       SER  30  -4.530  -8.448  -0.525
  221    HB2  SER  30           2HB      SER  30  -2.917  -7.129   0.248
  222    HB3  SER  30           1HB      SER  30  -2.517  -7.558  -1.413
  223    H    ILE  31           H        ILE  31  -0.624  -6.163  -0.449
  224    HA   ILE  31           HA       ILE  31   0.796  -5.831   2.095
  225    HB   ILE  31           HB       ILE  31   0.931  -4.000  -0.304
  226   HG12  ILE  31          2HG1      ILE  31   2.173  -5.608  -1.251
  227   HG13  ILE  31          1HG1      ILE  31   3.404  -5.163  -0.084
  228   HG21  ILE  31          1HG2      ILE  31   1.449  -3.049   1.972
  229   HG22  ILE  31          2HG2      ILE  31   2.721  -2.904   0.760
  230   HG23  ILE  31          3HG2      ILE  31   2.832  -4.140   2.010
  231   HD11  ILE  31          3HD1      ILE  31   3.388  -7.358   0.368
  232   HD12  ILE  31          1HD1      ILE  31   1.769  -7.587  -0.284
  233   HD13  ILE  31          2HD1      ILE  31   1.979  -6.960   1.346
  234    H    TYR  32           H        TYR  32  -0.396  -5.055   3.684
  235    HA   TYR  32           HA       TYR  32  -2.486  -3.061   3.100
  236    HD1  TYR  32           2HD      TYR  32  -2.226  -6.559   3.200
  237    HD2  TYR  32           1HD      TYR  32  -5.480  -4.216   4.610
  238    HE1  TYR  32           2HE      TYR  32  -3.787  -8.015   1.988
  239    HE2  TYR  32           1HE      TYR  32  -7.058  -5.658   3.412
  240    HH   TYR  32           HH       TYR  32  -6.208  -7.713   1.010
  241    HB2  TYR  32           2HB      TYR  32  -2.168  -5.032   5.357
  242    HB3  TYR  32           1HB      TYR  32  -3.366  -3.744   5.377
  243    H    VAL  33           H        VAL  33  -2.649  -1.172   4.253
  244    HA   VAL  33           HA       VAL  33  -0.249  -0.179   5.494
  245    HB   VAL  33           HB       VAL  33  -2.947   1.092   5.010
  246   HG11  VAL  33          1HG1      VAL  33  -2.360   2.350   6.816
  247   HG12  VAL  33          2HG1      VAL  33  -1.444   3.210   5.581
  248   HG13  VAL  33          3HG1      VAL  33  -0.637   2.035   6.617
  249   HG21  VAL  33          3HG2      VAL  33  -0.345   1.037   3.605
  250   HG22  VAL  33          1HG2      VAL  33  -1.197   2.580   3.638
  251   HG23  VAL  33          2HG2      VAL  33  -1.982   1.154   2.960
  252    H    THR  34           H        THR  34   0.193  -0.191   7.621
  253    HA   THR  34           HA       THR  34  -1.894  -1.135   9.447
  254    HB   THR  34           HB       THR  34   0.173  -2.432   9.343
  255    HG1  THR  34           1HG      THR  34  -0.063  -1.077  11.825
  256   HG21  THR  34          3HG2      THR  34   2.218  -1.603   9.407
  257   HG22  THR  34          1HG2      THR  34   1.867  -0.667  10.861
  258   HG23  THR  34          2HG2      THR  34   1.498  -0.000   9.270
  259    H    LYS  35           H        LYS  35   0.164   1.681   8.955
  260    HA   LYS  35           HA       LYS  35  -1.382   3.140  10.920
  261    HB2  LYS  35           2HB      LYS  35   1.537   2.539  11.357
  262    HB3  LYS  35           1HB      LYS  35   0.780   3.957  12.057
  263    HG2  LYS  35           2HG      LYS  35  -0.116   1.125  12.547
  264    HG3  LYS  35           1HG      LYS  35   0.949   2.045  13.606
  265    HD2  LYS  35           2HD      LYS  35  -0.913   3.787  13.689
  266    HD3  LYS  35           1HD      LYS  35  -1.946   2.549  12.972
  267    HE2  LYS  35           2HE      LYS  35  -2.292   2.369  15.290
  268    HE3  LYS  35           1HE      LYS  35  -1.205   1.043  14.882
  269    HZ1  LYS  35           3HZ      LYS  35  -0.318   3.657  15.978
  270    HZ2  LYS  35           1HZ      LYS  35   0.644   2.291  15.714
  271    HZ3  LYS  35           2HZ      LYS  35  -0.554   2.264  16.907
  272    H    ILE  36           H        ILE  36  -1.804   5.057  10.008
  273    HA   ILE  36           HA       ILE  36   0.100   6.122   8.049
  274    HB   ILE  36           HB       ILE  36  -2.755   6.961   8.569
  275   HG12  ILE  36          2HG1      ILE  36  -1.482   5.156   6.515
  276   HG13  ILE  36          1HG1      ILE  36  -2.819   4.795   7.601
  277   HG21  ILE  36          1HG2      ILE  36  -2.578   8.352   6.641
  278   HG22  ILE  36          2HG2      ILE  36  -0.976   7.723   6.260
  279   HG23  ILE  36          3HG2      ILE  36  -1.211   8.733   7.687
  280   HD11  ILE  36          3HD1      ILE  36  -4.071   6.634   6.305
  281   HD12  ILE  36          1HD1      ILE  36  -3.844   5.056   5.548
  282   HD13  ILE  36          2HD1      ILE  36  -2.812   6.410   5.090
  283    H    ILE  37           H        ILE  37   1.423   7.732   8.617
  284    HA   ILE  37           HA       ILE  37   1.197   9.027  11.167
  285    HB   ILE  37           HB       ILE  37   3.143   9.299   8.880
  286   HG12  ILE  37          2HG1      ILE  37   4.701   8.584  10.824
  287   HG13  ILE  37          1HG1      ILE  37   3.215   8.117  11.643
  288   HG21  ILE  37          1HG2      ILE  37   4.476  10.742  10.501
  289   HG22  ILE  37          2HG2      ILE  37   2.955  10.972  11.364
  290   HG23  ILE  37          3HG2      ILE  37   3.106  11.497   9.686
  291   HD11  ILE  37          3HD1      ILE  37   4.414   6.290  10.424
  292   HD12  ILE  37          1HD1      ILE  37   3.987   7.107   8.922
  293   HD13  ILE  37          2HD1      ILE  37   2.719   6.500   9.988
  294    H    GLU  38           H        GLU  38   0.835  11.221  11.587
  295    HA   GLU  38           HA       GLU  38  -1.128  12.508  10.048
  296    HB2  GLU  38           2HB      GLU  38  -0.391  12.852  12.554
  297    HB3  GLU  38           1HB      GLU  38   0.654  14.089  11.867
  298    HG2  GLU  38           2HG      GLU  38  -1.087  15.446  11.303
  299    HG3  GLU  38           1HG      GLU  38  -2.216  14.105  11.110
  300    H    GLY  39           H        GLY  39  -1.068  14.299   8.672
  301    HA2  GLY  39           2HA      GLY  39  -0.245  15.637   7.009
  302    HA3  GLY  39           1HA      GLY  39   1.203  15.780   7.987
  303    H    GLY  40           H        GLY  40   0.293  12.589   6.981
  304    HA2  GLY  40           2HA      GLY  40   2.683  12.448   5.321
  305    HA3  GLY  40           1HA      GLY  40   1.698  11.093   5.849
  306    H    ALA  41           H        ALA  41   2.587  11.180   3.272
  307    HA   ALA  41           HA       ALA  41   1.123  12.425   1.317
  308    HB1  ALA  41           3HB      ALA  41   2.034   9.555   1.178
  309    HB2  ALA  41           1HB      ALA  41   3.088  10.950   0.948
  310    HB3  ALA  41           2HB      ALA  41   1.759  10.655  -0.173
  311    H    ALA  42           H        ALA  42   0.309   9.286   2.834
  312    HA   ALA  42           HA       ALA  42  -2.155   9.005   1.431
  313    HB1  ALA  42           3HB      ALA  42  -1.233   6.996   2.179
  314    HB2  ALA  42           1HB      ALA  42  -2.591   7.267   3.271
  315    HB3  ALA  42           2HB      ALA  42  -0.948   7.621   3.803
  316    H    HIS  43           H        HIS  43  -1.396   9.886   4.801
  317    HA   HIS  43           HA       HIS  43  -3.933  10.307   5.783
  318    HD1  HIS  43           1HD      HIS  43  -2.738  14.013   7.166
  319    HD2  HIS  43           2HD      HIS  43  -3.859  10.525   9.128
  320    HE1  HIS  43           1HE      HIS  43  -4.094  14.763   9.144
  321    HE2  HIS  43           2HE      HIS  43  -4.681  12.641  10.370
  322    HB2  HIS  43           2HB      HIS  43  -1.891  10.377   7.151
  323    HB3  HIS  43           1HB      HIS  43  -1.444  11.908   6.411
  324    H    LYS  44           H        LYS  44  -1.869  12.672   4.101
  325    HA   LYS  44           HA       LYS  44  -3.745  14.802   4.237
  326    HB2  LYS  44           2HB      LYS  44  -1.291  14.320   2.558
  327    HB3  LYS  44           1HB      LYS  44  -2.276  15.764   2.369
  328    HG2  LYS  44           2HG      LYS  44  -1.831  16.444   4.618
  329    HG3  LYS  44           1HG      LYS  44  -1.016  14.918   4.968
  330    HD2  LYS  44           2HD      LYS  44   0.835  15.467   3.660
  331    HD3  LYS  44           1HD      LYS  44  -0.044  16.712   2.771
  332    HE2  LYS  44           2HE      LYS  44   0.051  17.231   5.632
  333    HE3  LYS  44           1HE      LYS  44   1.656  17.120   4.911
  334    HZ1  LYS  44           3HZ      LYS  44   1.010  18.790   3.292
  335    HZ2  LYS  44           1HZ      LYS  44   0.807  19.382   4.864
  336    HZ3  LYS  44           2HZ      LYS  44  -0.538  18.886   3.967
  337    H    ASP  45           H        ASP  45  -3.064  12.316   1.815
  338    HA   ASP  45           HA       ASP  45  -4.651  13.364  -0.263
  339    HB2  ASP  45           2HB      ASP  45  -2.920  11.426  -0.303
  340    HB3  ASP  45           1HB      ASP  45  -4.279  10.408   0.163
  341    H    GLY  46           H        GLY  46  -5.407  10.862   2.176
  342    HA2  GLY  46           2HA      GLY  46  -7.488  10.696   3.299
  343    HA3  GLY  46           1HA      GLY  46  -8.228  11.646   2.022
  344    H    LYS  47           H        LYS  47  -6.897   9.924  -0.058
  345    HA   LYS  47           HA       LYS  47  -9.012   8.095  -0.442
  346    HB2  LYS  47           2HB      LYS  47  -6.414   8.646  -1.797
  347    HB3  LYS  47           1HB      LYS  47  -7.226   7.131  -2.160
  348    HG2  LYS  47           2HG      LYS  47  -9.119   8.234  -3.029
  349    HG3  LYS  47           1HG      LYS  47  -8.606   9.790  -2.370
  350    HD2  LYS  47           2HD      LYS  47  -6.918  10.044  -3.960
  351    HD3  LYS  47           1HD      LYS  47  -6.905   8.327  -4.358
  352    HE2  LYS  47           2HE      LYS  47  -8.118   8.946  -6.139
  353    HE3  LYS  47           1HE      LYS  47  -9.460   9.007  -4.999
  354    HZ1  LYS  47           3HZ      LYS  47  -9.011  11.370  -4.674
  355    HZ2  LYS  47           1HZ      LYS  47  -9.344  11.027  -6.297
  356    HZ3  LYS  47           2HZ      LYS  47  -7.751  11.301  -5.799
  357    H    LEU  48           H        LEU  48  -5.697   7.675   0.764
  358    HA   LEU  48           HA       LEU  48  -6.119   4.821   1.107
  359    HG   LEU  48           HG       LEU  48  -4.227   3.542   0.939
  360    HB2  LEU  48           2HB      LEU  48  -3.916   6.076   0.404
  361    HB3  LEU  48           1HB      LEU  48  -3.703   6.243   2.135
  362   HD11  LEU  48          1HD1      LEU  48  -2.332   4.645  -0.279
  363   HD12  LEU  48          2HD1      LEU  48  -1.908   3.167   0.584
  364   HD13  LEU  48          3HD1      LEU  48  -1.484   4.739   1.264
  365   HD21  LEU  48          3HD2      LEU  48  -4.159   4.241   3.479
  366   HD22  LEU  48          1HD2      LEU  48  -2.418   4.089   3.233
  367   HD23  LEU  48          2HD2      LEU  48  -3.480   2.713   2.922
  368    H    GLN  49           H        GLN  49  -6.810   3.903   2.893
  369    HA   GLN  49           HA       GLN  49  -6.542   5.295   5.462
  370    HB2  GLN  49           2HB      GLN  49  -8.798   4.536   6.087
  371    HB3  GLN  49           1HB      GLN  49  -8.836   5.621   4.707
  372    HG2  GLN  49           2HG      GLN  49  -8.794   2.669   4.268
  373    HG3  GLN  49           1HG      GLN  49 -10.293   3.468   4.732
  374   HE21  GLN  49          1HE2      GLN  49  -8.374   2.546   2.175
  375   HE22  GLN  49          2HE2      GLN  49  -9.072   3.536   0.943
  376    H    ILE  50           H        ILE  50  -6.151   3.960   7.238
  377    HA   ILE  50           HA       ILE  50  -4.702   1.653   6.903
  378    HB   ILE  50           HB       ILE  50  -6.395   2.389   9.298
  379   HG12  ILE  50          2HG1      ILE  50  -3.449   2.666   9.337
  380   HG13  ILE  50          1HG1      ILE  50  -4.301   3.783   8.276
  381   HG21  ILE  50          1HG2      ILE  50  -4.809   0.926  10.555
  382   HG22  ILE  50          2HG2      ILE  50  -4.197   0.348   9.005
  383   HG23  ILE  50          3HG2      ILE  50  -5.878   0.058   9.453
  384   HD11  ILE  50          3HD1      ILE  50  -4.466   3.506  11.245
  385   HD12  ILE  50          1HD1      ILE  50  -5.773   4.261  10.332
  386   HD13  ILE  50          2HD1      ILE  50  -4.148   4.941  10.268
  387    H    GLY  51           H        GLY  51  -5.165  -0.332   6.223
  388    HA2  GLY  51           2HA      GLY  51  -6.525  -2.351   6.701
  389    HA3  GLY  51           1HA      GLY  51  -7.936  -1.327   6.532
  390    H    ASP  52           H        ASP  52  -6.497   0.047   4.154
  391    HA   ASP  52           HA       ASP  52  -7.694  -1.544   2.160
  392    HB2  ASP  52           2HB      ASP  52  -6.392   0.011   0.578
  393    HB3  ASP  52           1HB      ASP  52  -7.591   0.737   1.634
  394    H    LYS  53           H        LYS  53  -6.597  -2.505   0.284
  395    HA   LYS  53           HA       LYS  53  -4.033  -3.710   1.091
  396    HB2  LYS  53           2HB      LYS  53  -4.655  -5.576  -0.477
  397    HB3  LYS  53           1HB      LYS  53  -5.665  -5.432   0.951
  398    HG2  LYS  53           2HG      LYS  53  -6.761  -3.906  -1.231
  399    HG3  LYS  53           1HG      LYS  53  -6.499  -5.587  -1.696
  400    HD2  LYS  53           2HD      LYS  53  -7.639  -5.385   0.958
  401    HD3  LYS  53           1HD      LYS  53  -8.643  -4.568  -0.242
  402    HE2  LYS  53           2HE      LYS  53  -9.148  -6.495  -1.339
  403    HE3  LYS  53           1HE      LYS  53  -7.596  -7.243  -0.965
  404    HZ1  LYS  53           3HZ      LYS  53  -9.304  -8.387   0.217
  405    HZ2  LYS  53           1HZ      LYS  53  -9.916  -6.948   0.862
  406    HZ3  LYS  53           2HZ      LYS  53  -8.398  -7.513   1.346
  407    H    LEU  54           H        LEU  54  -2.446  -3.935  -0.375
  408    HA   LEU  54           HA       LEU  54  -2.569  -2.062  -2.620
  409    HG   LEU  54           HG       LEU  54  -1.289  -0.447  -1.513
  410    HB2  LEU  54           2HB      LEU  54  -0.542  -2.774  -0.726
  411    HB3  LEU  54           1HB      LEU  54   0.069  -2.993  -2.354
  412   HD11  LEU  54          1HD1      LEU  54   1.159   0.372  -1.321
  413   HD12  LEU  54          2HD1      LEU  54   1.523  -1.326  -1.018
  414   HD13  LEU  54          3HD1      LEU  54   0.415  -0.460   0.044
  415   HD21  LEU  54          3HD2      LEU  54  -1.099  -0.287  -3.765
  416   HD22  LEU  54          1HD2      LEU  54   0.253  -1.416  -3.845
  417   HD23  LEU  54          2HD2      LEU  54   0.525   0.252  -3.339
  418    H    LEU  55           H        LEU  55  -3.335  -2.989  -4.371
  419    HA   LEU  55           HA       LEU  55  -2.947  -5.681  -5.130
  420    HG   LEU  55           HG       LEU  55  -4.630  -6.293  -6.682
  421    HB2  LEU  55           2HB      LEU  55  -4.699  -3.873  -5.906
  422    HB3  LEU  55           1HB      LEU  55  -3.504  -3.537  -7.142
  423   HD11  LEU  55          1HD1      LEU  55  -5.548  -4.552  -8.918
  424   HD12  LEU  55          2HD1      LEU  55  -6.283  -4.364  -7.326
  425   HD13  LEU  55          3HD1      LEU  55  -6.350  -5.922  -8.150
  426   HD21  LEU  55          3HD2      LEU  55  -3.929  -6.370  -9.183
  427   HD22  LEU  55          1HD2      LEU  55  -2.701  -6.539  -7.930
  428   HD23  LEU  55          2HD2      LEU  55  -2.912  -4.995  -8.754
  429    H    ALA  56           H        ALA  56  -1.462  -2.623  -6.287
  430    HA   ALA  56           HA       ALA  56   0.996  -4.095  -6.851
  431    HB1  ALA  56           3HB      ALA  56  -0.725  -2.900  -9.012
  432    HB2  ALA  56           1HB      ALA  56   0.030  -4.492  -8.954
  433    HB3  ALA  56           2HB      ALA  56   1.018  -3.055  -9.228
  434    H    VAL  57           H        VAL  57   2.818  -2.698  -7.375
  435    HA   VAL  57           HA       VAL  57   2.424   0.163  -6.816
  436    HB   VAL  57           HB       VAL  57   4.428  -1.607  -5.406
  437   HG11  VAL  57          1HG1      VAL  57   5.642   0.346  -5.883
  438   HG12  VAL  57          2HG1      VAL  57   5.038   0.583  -4.244
  439   HG13  VAL  57          3HG1      VAL  57   4.247   1.386  -5.599
  440   HG21  VAL  57          3HG2      VAL  57   3.324  -0.673  -3.374
  441   HG22  VAL  57          1HG2      VAL  57   2.277  -1.693  -4.361
  442   HG23  VAL  57          2HG2      VAL  57   2.118   0.061  -4.430
  443    H    ASN  58           H        ASN  58   3.089   1.105  -8.636
  444    HA   ASN  58           HA       ASN  58   4.396   1.777 -10.361
  445    HB2  ASN  58           2HB      ASN  58   6.395   0.708  -8.424
  446    HB3  ASN  58           1HB      ASN  58   6.943   1.050 -10.062
  447   HD21  ASN  58          1HD2      ASN  58   5.279   2.476  -7.291
  448   HD22  ASN  58          2HD2      ASN  58   5.799   4.096  -7.592
  449    H    ASN  59           H        ASN  59   2.919  -0.368 -10.936
  450    HA   ASN  59           HA       ASN  59   2.666  -1.816 -12.684
  451    HB2  ASN  59           2HB      ASN  59   5.046  -0.598 -13.368
  452    HB3  ASN  59           1HB      ASN  59   5.466  -2.309 -13.353
  453   HD21  ASN  59          1HD2      ASN  59   4.294  -3.739 -14.728
  454   HD22  ASN  59          2HD2      ASN  59   3.516  -3.142 -16.150
  455    H    VAL  60           H        VAL  60   4.666  -2.452  -9.968
  456    HA   VAL  60           HA       VAL  60   4.807  -5.317 -10.542
  457    HB   VAL  60           HB       VAL  60   6.243  -5.565  -8.697
  458   HG11  VAL  60          1HG1      VAL  60   7.657  -3.219  -9.004
  459   HG12  VAL  60          2HG1      VAL  60   6.760  -3.361 -10.516
  460   HG13  VAL  60          3HG1      VAL  60   7.818  -4.671  -9.993
  461   HG21  VAL  60          3HG2      VAL  60   5.662  -4.572  -6.791
  462   HG22  VAL  60          1HG2      VAL  60   4.827  -3.266  -7.629
  463   HG23  VAL  60          2HG2      VAL  60   6.568  -3.174  -7.371
  464    H    CYS  61           H        CYS  61   3.763  -6.903  -9.240
  465    HA   CYS  61           HA       CYS  61   1.339  -5.923  -7.984
  466    HG   CYS  61           HG       CYS  61   3.377  -9.239  -8.986
  467    HB2  CYS  61           2HB      CYS  61   0.676  -8.249  -7.801
  468    HB3  CYS  61           1HB      CYS  61   1.208  -7.887  -9.437
  469    H    LEU  62           H        LEU  62   0.945  -5.786  -5.868
  470    HA   LEU  62           HA       LEU  62   3.100  -6.554  -4.045
  471    HG   LEU  62           HG       LEU  62   3.578  -4.993  -2.234
  472    HB2  LEU  62           2HB      LEU  62   1.609  -4.183  -4.372
  473    HB3  LEU  62           1HB      LEU  62   1.133  -4.861  -2.832
  474   HD11  LEU  62          1HD1      LEU  62   4.418  -2.960  -4.084
  475   HD12  LEU  62          2HD1      LEU  62   3.912  -4.415  -4.941
  476   HD13  LEU  62          3HD1      LEU  62   5.164  -4.510  -3.703
  477   HD21  LEU  62          3HD2      LEU  62   3.673  -2.286  -2.317
  478   HD22  LEU  62          1HD2      LEU  62   2.778  -3.217  -1.119
  479   HD23  LEU  62          2HD2      LEU  62   1.948  -2.573  -2.534
  480    H    GLU  63           H        GLU  63   1.091  -8.444  -5.039
  481    HA   GLU  63           HA       GLU  63  -0.309  -9.070  -2.521
  482    HB2  GLU  63           2HB      GLU  63  -1.374  -8.741  -5.058
  483    HB3  GLU  63           1HB      GLU  63  -1.290 -10.486  -4.869
  484    HG2  GLU  63           2HG      GLU  63  -2.466  -8.804  -2.703
  485    HG3  GLU  63           1HG      GLU  63  -3.416  -9.196  -4.134
  486    H    GLU  64           H        GLU  64   2.059 -10.225  -4.762
  487    HA   GLU  64           HA       GLU  64   2.034 -12.838  -3.399
  488    HB2  GLU  64           2HB      GLU  64   1.785 -12.291  -6.161
  489    HB3  GLU  64           1HB      GLU  64   3.363 -13.019  -5.916
  490    HG2  GLU  64           2HG      GLU  64   1.238 -14.383  -4.471
  491    HG3  GLU  64           1HG      GLU  64   0.997 -14.363  -6.217
  492    H    VAL  65           H        VAL  65   3.419 -10.866  -2.210
  493    HA   VAL  65           HA       VAL  65   6.188 -11.741  -2.606
  494    HB   VAL  65           HB       VAL  65   7.013  -9.402  -2.347
  495   HG11  VAL  65          1HG1      VAL  65   6.875 -10.606  -4.529
  496   HG12  VAL  65          2HG1      VAL  65   6.818  -8.848  -4.663
  497   HG13  VAL  65          3HG1      VAL  65   5.336  -9.794  -4.818
  498   HG21  VAL  65          3HG2      VAL  65   5.133  -7.745  -3.281
  499   HG22  VAL  65          1HG2      VAL  65   5.408  -8.009  -1.559
  500   HG23  VAL  65          2HG2      VAL  65   4.103  -8.861  -2.386
  501    H    THR  66           H        THR  66   7.624 -11.250  -0.857
  502    HA   THR  66           HA       THR  66   6.426 -11.637   1.713
  503    HB   THR  66           HB       THR  66   9.109 -10.911   2.125
  504    HG1  THR  66           1HG      THR  66   9.033 -12.638  -0.104
  505   HG21  THR  66          3HG2      THR  66   8.110 -12.770   3.247
  506   HG22  THR  66          1HG2      THR  66   9.520 -13.333   2.351
  507   HG23  THR  66          2HG2      THR  66   7.899 -13.633   1.724
  508    H    HIS  67           H        HIS  67   7.953 -10.040   3.458
  509    HA   HIS  67           HA       HIS  67   6.541  -7.556   3.111
  510    HD1  HIS  67           1HD      HIS  67   5.210  -6.666   5.944
  511    HD2  HIS  67           2HD      HIS  67   9.082  -5.341   5.276
  512    HE1  HIS  67           1HE      HIS  67   5.188  -4.235   6.498
  513    HE2  HIS  67           2HE      HIS  67   7.490  -3.420   5.915
  514    HB2  HIS  67           2HB      HIS  67   6.763  -8.541   5.356
  515    HB3  HIS  67           1HB      HIS  67   8.482  -8.218   5.343
  516    H    GLU  68           H        GLU  68   9.904  -8.608   2.897
  517    HA   GLU  68           HA       GLU  68  11.189  -6.174   2.687
  518    HB2  GLU  68           2HB      GLU  68  12.853  -7.330   1.256
  519    HB3  GLU  68           1HB      GLU  68  12.440  -8.252   2.694
  520    HG2  GLU  68           2HG      GLU  68  10.711  -9.393   1.084
  521    HG3  GLU  68           1HG      GLU  68  11.805  -8.796  -0.161
  522    H    GLU  69           H        GLU  69   9.344  -7.918   0.237
  523    HA   GLU  69           HA       GLU  69   9.912  -6.083  -1.891
  524    HB2  GLU  69           2HB      GLU  69   8.070  -8.400  -1.502
  525    HB3  GLU  69           1HB      GLU  69   7.760  -7.296  -2.835
  526    HG2  GLU  69           2HG      GLU  69   9.175  -8.523  -4.018
  527    HG3  GLU  69           1HG      GLU  69  10.460  -7.815  -3.044
  528    H    ALA  70           H        ALA  70   7.303  -6.482   0.459
  529    HA   ALA  70           HA       ALA  70   5.482  -4.579  -0.592
  530    HB1  ALA  70           3HB      ALA  70   4.403  -4.698   1.537
  531    HB2  ALA  70           1HB      ALA  70   5.861  -5.316   2.309
  532    HB3  ALA  70           2HB      ALA  70   4.988  -6.315   1.150
  533    H    VAL  71           H        VAL  71   8.002  -4.367   1.882
  534    HA   VAL  71           HA       VAL  71   7.627  -1.602   2.431
  535    HB   VAL  71           HB       VAL  71   8.717  -3.464   3.893
  536   HG11  VAL  71          1HG1      VAL  71  11.173  -2.408   2.501
  537   HG12  VAL  71          2HG1      VAL  71  10.507  -4.029   2.310
  538   HG13  VAL  71          3HG1      VAL  71  11.136  -3.515   3.873
  539   HG21  VAL  71          3HG2      VAL  71   8.363  -1.159   4.599
  540   HG22  VAL  71          1HG2      VAL  71   9.871  -0.683   3.820
  541   HG23  VAL  71          2HG2      VAL  71   9.898  -1.788   5.194
  542    H    THR  72           H        THR  72   9.938  -3.381   0.393
  543    HA   THR  72           HA       THR  72  11.493  -1.120  -0.292
  544    HB   THR  72           HB       THR  72  11.184  -3.833  -1.573
  545    HG1  THR  72           1HG      THR  72  12.375  -4.131   0.165
  546   HG21  THR  72          3HG2      THR  72  11.899  -2.446  -3.374
  547   HG22  THR  72          1HG2      THR  72  13.310  -3.316  -2.772
  548   HG23  THR  72          2HG2      THR  72  13.071  -1.621  -2.347
  549    H    ALA  73           H        ALA  73   8.608  -2.568  -1.724
  550    HA   ALA  73           HA       ALA  73   8.677  -1.178  -4.179
  551    HB1  ALA  73           3HB      ALA  73   6.289  -1.786  -4.341
  552    HB2  ALA  73           1HB      ALA  73   6.340  -2.355  -2.673
  553    HB3  ALA  73           2HB      ALA  73   7.308  -3.157  -3.910
  554    H    LEU  74           H        LEU  74   7.202  -0.484  -1.028
  555    HA   LEU  74           HA       LEU  74   5.958   1.955  -1.882
  556    HG   LEU  74           HG       LEU  74   4.091   1.003   1.135
  557    HB2  LEU  74           2HB      LEU  74   6.458   0.576   0.719
  558    HB3  LEU  74           1HB      LEU  74   6.080   2.286   0.752
  559   HD11  LEU  74          1HD1      LEU  74   2.814   2.391  -0.057
  560   HD12  LEU  74          2HD1      LEU  74   3.422   1.774  -1.593
  561   HD13  LEU  74          3HD1      LEU  74   4.327   3.009  -0.718
  562   HD21  LEU  74          3HD2      LEU  74   3.239  -0.351  -0.927
  563   HD22  LEU  74          1HD2      LEU  74   4.352  -1.088   0.224
  564   HD23  LEU  74          2HD2      LEU  74   4.955  -0.463  -1.310
  565    H    LYS  75           H        LYS  75   8.956   0.981  -0.332
  566    HA   LYS  75           HA       LYS  75   9.935   3.543   0.326
  567    HB2  LYS  75           2HB      LYS  75  11.130   1.936   1.422
  568    HB3  LYS  75           1HB      LYS  75  11.063   0.812   0.073
  569    HG2  LYS  75           2HG      LYS  75  12.820   2.017  -1.069
  570    HG3  LYS  75           1HG      LYS  75  12.846   3.237   0.207
  571    HD2  LYS  75           2HD      LYS  75  13.231   0.385   0.969
  572    HD3  LYS  75           1HD      LYS  75  14.564   1.226   0.175
  573    HE2  LYS  75           2HE      LYS  75  13.548   2.965   2.155
  574    HE3  LYS  75           1HE      LYS  75  13.703   1.375   2.900
  575    HZ1  LYS  75           3HZ      LYS  75  16.004   1.297   2.177
  576    HZ2  LYS  75           1HZ      LYS  75  15.731   2.670   3.127
  577    HZ3  LYS  75           2HZ      LYS  75  15.857   2.815   1.446
  578    H    ASN  76           H        ASN  76  10.011   1.725  -2.675
  579    HA   ASN  76           HA       ASN  76  12.016   3.296  -3.949
  580    HB2  ASN  76           2HB      ASN  76  11.238   0.923  -4.547
  581    HB3  ASN  76           1HB      ASN  76   9.905   1.703  -5.391
  582   HD21  ASN  76          1HD2      ASN  76  10.265   2.683  -7.331
  583   HD22  ASN  76          2HD2      ASN  76  11.784   2.645  -8.153
  584    H    THR  77           H        THR  77  10.943   5.368  -3.167
  585    HA   THR  77           HA       THR  77   9.115   6.356  -5.256
  586    HB   THR  77           HB       THR  77   8.433   8.039  -3.380
  587    HG1  THR  77           1HG      THR  77   9.201   5.845  -1.763
  588   HG21  THR  77          3HG2      THR  77   7.111   5.784  -2.394
  589   HG22  THR  77          1HG2      THR  77   7.397   5.472  -4.106
  590   HG23  THR  77          2HG2      THR  77   6.540   6.930  -3.605
  591    H    SER  78           H        SER  78   9.743   8.098  -6.348
  592    HA   SER  78           HA       SER  78  12.092   9.590  -5.364
  593    HG   SER  78           HG       SER  78  13.916   8.729  -7.170
  594    HB2  SER  78           2HB      SER  78  11.316   8.771  -8.160
  595    HB3  SER  78           1HB      SER  78  12.436  10.102  -7.870
  596    H    ASP  79           H        ASP  79   9.856  10.284  -8.039
  597    HA   ASP  79           HA       ASP  79   9.269  12.870  -6.766
  598    HB2  ASP  79           2HB      ASP  79   8.585  13.614  -9.048
  599    HB3  ASP  79           1HB      ASP  79  10.276  13.138  -8.950
  600    H    PHE  80           H        PHE  80   7.740  10.229  -8.600
  601    HA   PHE  80           HA       PHE  80   5.235  10.782  -7.167
  602    HD1  PHE  80           1HD      PHE  80   4.932  13.230  -9.058
  603    HD2  PHE  80           2HD      PHE  80   2.400   9.809  -9.115
  604    HE1  PHE  80           1HE      PHE  80   2.973  14.681  -8.749
  605    HE2  PHE  80           2HE      PHE  80   0.436  11.259  -8.804
  606    HZ   PHE  80           HZ       PHE  80   0.721  13.696  -8.618
  607    HB2  PHE  80           2HB      PHE  80   5.673  11.031  -9.965
  608    HB3  PHE  80           1HB      PHE  80   4.665   9.610  -9.716
  609    H    VAL  81           H        VAL  81   3.732   8.850  -7.208
  610    HA   VAL  81           HA       VAL  81   5.095   6.296  -7.513
  611    HB   VAL  81           HB       VAL  81   5.474   6.849  -5.165
  612   HG11  VAL  81          1HG1      VAL  81   2.486   6.977  -4.814
  613   HG12  VAL  81          2HG1      VAL  81   3.522   8.396  -4.950
  614   HG13  VAL  81          3HG1      VAL  81   3.729   7.281  -3.600
  615   HG21  VAL  81          3HG2      VAL  81   3.361   4.728  -5.541
  616   HG22  VAL  81          1HG2      VAL  81   4.405   4.886  -4.128
  617   HG23  VAL  81          2HG2      VAL  81   5.105   4.519  -5.704
  618    H    TYR  82           H        TYR  82   3.770   4.902  -8.543
  619    HA   TYR  82           HA       TYR  82   0.953   5.640  -8.798
  620    HD1  TYR  82           1HD      TYR  82   0.343   2.120 -10.358
  621    HD2  TYR  82           2HD      TYR  82   0.505   6.104 -11.836
  622    HE1  TYR  82           1HE      TYR  82  -1.731   1.735 -11.603
  623    HE2  TYR  82           2HE      TYR  82  -1.577   5.732 -13.083
  624    HH   TYR  82           HH       TYR  82  -3.365   4.327 -13.336
  625    HB2  TYR  82           2HB      TYR  82   2.434   5.094 -10.789
  626    HB3  TYR  82           1HB      TYR  82   2.394   3.423 -10.243
  627    H    LEU  83           H        LEU  83  -0.049   4.990  -7.010
  628    HA   LEU  83           HA       LEU  83   0.407   2.375  -5.867
  629    HG   LEU  83           HG       LEU  83  -1.339   1.968  -3.962
  630    HB2  LEU  83           2HB      LEU  83   0.028   4.529  -4.580
  631    HB3  LEU  83           1HB      LEU  83  -1.658   4.400  -5.042
  632   HD11  LEU  83          1HD1      LEU  83   1.006   2.315  -3.402
  633   HD12  LEU  83          2HD1      LEU  83   0.031   2.146  -1.943
  634   HD13  LEU  83          3HD1      LEU  83   0.580   3.741  -2.456
  635   HD21  LEU  83          3HD2      LEU  83  -1.937   4.574  -2.584
  636   HD22  LEU  83          1HD2      LEU  83  -2.210   2.996  -1.842
  637   HD23  LEU  83          2HD2      LEU  83  -3.080   3.446  -3.310
  638    H    LYS  84           H        LYS  84  -0.676   0.607  -6.337
  639    HA   LYS  84           HA       LYS  84  -3.308   0.827  -7.631
  640    HB2  LYS  84           2HB      LYS  84  -1.186  -1.295  -7.889
  641    HB3  LYS  84           1HB      LYS  84  -2.831  -1.515  -8.460
  642    HG2  LYS  84           2HG      LYS  84  -1.764   0.952  -9.466
  643    HG3  LYS  84           1HG      LYS  84  -0.674  -0.385  -9.835
  644    HD2  LYS  84           2HD      LYS  84  -2.157  -0.302 -11.654
  645    HD3  LYS  84           1HD      LYS  84  -2.750  -1.627 -10.653
  646    HE2  LYS  84           2HE      LYS  84  -4.669  -0.558 -10.152
  647    HE3  LYS  84           1HE      LYS  84  -3.876   1.009 -10.009
  648    HZ1  LYS  84           3HZ      LYS  84  -5.448   0.916 -11.866
  649    HZ2  LYS  84           1HZ      LYS  84  -4.547  -0.327 -12.578
  650    HZ3  LYS  84           2HZ      LYS  84  -3.871   1.214 -12.398
  651    H    VAL  85           H        VAL  85  -4.838   0.567  -6.128
  652    HA   VAL  85           HA       VAL  85  -4.365  -1.373  -3.978
  653    HB   VAL  85           HB       VAL  85  -6.501   0.767  -4.142
  654   HG11  VAL  85          1HG1      VAL  85  -5.628  -0.420  -1.568
  655   HG12  VAL  85          2HG1      VAL  85  -6.650  -1.406  -2.613
  656   HG13  VAL  85          3HG1      VAL  85  -7.214   0.173  -2.066
  657   HG21  VAL  85          3HG2      VAL  85  -4.969   1.720  -2.233
  658   HG22  VAL  85          1HG2      VAL  85  -4.617   2.056  -3.929
  659   HG23  VAL  85          2HG2      VAL  85  -3.720   0.802  -3.075
  660    H    ALA  86           H        ALA  86  -5.568  -3.169  -3.750
  661    HA   ALA  86           HA       ALA  86  -7.450  -3.838  -5.862
  662    HB1  ALA  86           3HB      ALA  86  -6.980  -6.002  -5.431
  663    HB2  ALA  86           1HB      ALA  86  -6.993  -5.770  -3.683
  664    HB3  ALA  86           2HB      ALA  86  -5.571  -5.318  -4.622
  665    H    LYS  87           H        LYS  87  -9.599  -4.412  -5.568
  666    HA   LYS  87           HA       LYS  87 -10.850  -3.268  -3.190
  667    HB2  LYS  87           2HB      LYS  87 -11.553  -3.438  -5.950
  668    HB3  LYS  87           1HB      LYS  87 -12.789  -4.274  -5.022
  669    HG2  LYS  87           2HG      LYS  87 -13.645  -2.171  -4.988
  670    HG3  LYS  87           1HG      LYS  87 -12.651  -2.100  -3.533
  671    HD2  LYS  87           2HD      LYS  87 -10.801  -1.246  -5.135
  672    HD3  LYS  87           1HD      LYS  87 -12.139  -0.912  -6.236
  673    HE2  LYS  87           2HE      LYS  87 -13.208   0.359  -4.319
  674    HE3  LYS  87           1HE      LYS  87 -11.656   0.226  -3.494
  675    HZ1  LYS  87           3HZ      LYS  87 -11.880   2.325  -4.686
  676    HZ2  LYS  87           1HZ      LYS  87 -12.082   1.495  -6.146
  677    HZ3  LYS  87           2HZ      LYS  87 -10.612   1.401  -5.315
  678    HA   PRO  88           HA       PRO  88 -11.264  -7.278  -1.274
  679    HB2  PRO  88           2HB      PRO  88 -13.519  -5.928   0.118
  680    HB3  PRO  88           1HB      PRO  88 -12.138  -6.797   0.793
  681    HG2  PRO  88           2HG      PRO  88 -12.247  -4.140   0.890
  682    HG3  PRO  88           1HG      PRO  88 -10.717  -4.979   0.576
  683    HD2  PRO  88           2HD      PRO  88 -12.527  -3.555  -1.331
  684    HD3  PRO  88           1HD      PRO  88 -10.752  -3.608  -1.285
  685    H    THR  89           H        THR  89 -12.518  -9.067  -1.608
  686    HA   THR  89           HA       THR  89 -15.258  -8.760  -2.568
  687    HB   THR  89           HB       THR  89 -14.747 -10.450  -4.412
  688    HG1  THR  89           1HG      THR  89 -12.095  -9.526  -4.027
  689   HG21  THR  89          3HG2      THR  89 -14.148  -8.840  -6.025
  690   HG22  THR  89          1HG2      THR  89 -13.362  -7.820  -4.822
  691   HG23  THR  89          2HG2      THR  89 -15.116  -8.000  -4.813
  692    H    GLY  90           H        GLY  90 -16.419 -10.862  -2.666
  693    HA2  GLY  90           2HA      GLY  90 -15.341 -13.216  -1.524
  694    HA3  GLY  90           1HA      GLY  90 -16.166 -12.290  -0.280
  695    H    SER  91           H        SER  91 -16.591 -14.849  -2.136
  696    HA   SER  91           HA       SER  91 -19.186 -14.363  -3.264
  697    HG   SER  91           HG       SER  91 -17.834 -16.761  -5.244
  698    HB2  SER  91           2HB      SER  91 -17.536 -16.855  -2.856
  699    HB3  SER  91           1HB      SER  91 -19.173 -16.915  -3.507
  700    H    HIS  92           H        HIS  92 -17.974 -16.103  -0.404
  701    HA   HIS  92           HA       HIS  92 -20.634 -16.744   0.508
  702    HD1  HIS  92           1HD      HIS  92 -19.321 -17.251   4.375
  703    HD2  HIS  92           2HD      HIS  92 -20.829 -19.697   1.373
  704    HE1  HIS  92           1HE      HIS  92 -20.898 -18.833   5.527
  705    HE2  HIS  92           2HE      HIS  92 -21.867 -20.245   3.679
  706    HB2  HIS  92           2HB      HIS  92 -18.477 -18.107   0.900
  707    HB3  HIS  92           1HB      HIS  92 -18.132 -16.942   2.173
  708    HA   ARG 301           HA       ARG 301   2.848 -11.048  10.349
  709    HE   ARG 301           HE       ARG 301   2.071 -12.689  14.673
  710    H1   ARG 301           1HT      ARG 301   2.401 -12.929  11.868
  711    H2   ARG 301           2HT      ARG 301   3.474 -12.183  12.981
  712    H3   ARG 301           3HT      ARG 301   4.039 -12.668  11.436
  713    HB2  ARG 301           2HB      ARG 301   1.251  -9.581  11.571
  714    HB3  ARG 301           1HB      ARG 301   0.754 -11.265  11.518
  715    HG2  ARG 301           2HG      ARG 301   2.307 -10.739  13.885
  716    HG3  ARG 301           1HG      ARG 301   0.948  -9.621  13.759
  717    HD2  ARG 301           2HD      ARG 301  -0.351 -11.235  14.566
  718    HD3  ARG 301           1HD      ARG 301  -0.100 -12.105  13.053
  719   HH11  ARG 301          1HH1      ARG 301  -1.398 -13.170  14.754
  720   HH12  ARG 301          2HH1      ARG 301  -1.298 -14.615  15.701
  721   HH21  ARG 301          1HH2      ARG 301   2.195 -14.594  15.920
  722   HH22  ARG 301          2HH2      ARG 301   0.740 -15.423  16.365
  723    H    ARG 302           H        ARG 302   3.843  -9.133   9.976
  724    HA   ARG 302           HA       ARG 302   5.152  -7.701  12.139
  725    HE   ARG 302           HE       ARG 302   8.656  -8.656  12.927
  726    HB2  ARG 302           2HB      ARG 302   6.933  -9.170  11.578
  727    HB3  ARG 302           1HB      ARG 302   6.645  -8.983   9.854
  728    HG2  ARG 302           2HG      ARG 302   7.655  -6.906   9.773
  729    HG3  ARG 302           1HG      ARG 302   7.426  -6.614  11.497
  730    HD2  ARG 302           2HD      ARG 302   9.227  -8.798  10.487
  731    HD3  ARG 302           1HD      ARG 302   9.790  -7.139  10.669
  732   HH11  ARG 302          1HH1      ARG 302  11.220  -6.674  11.572
  733   HH12  ARG 302          2HH1      ARG 302  12.065  -6.539  13.075
  734   HH21  ARG 302          1HH2      ARG 302   9.783  -8.466  14.892
  735   HH22  ARG 302          2HH2      ARG 302  11.254  -7.555  14.954
  736    H    GLU 303           H        GLU 303   4.983  -5.581  11.852
  737    HA   GLU 303           HA       GLU 303   4.298  -4.584   9.164
  738    HB2  GLU 303           2HB      GLU 303   3.392  -3.744  11.906
  739    HB3  GLU 303           1HB      GLU 303   3.280  -2.644  10.540
  740    HG2  GLU 303           2HG      GLU 303   1.172  -3.755  10.882
  741    HG3  GLU 303           1HG      GLU 303   1.881  -4.270   9.355
  742    H    THR 304           H        THR 304   5.242  -2.662   8.435
  743    HA   THR 304           HA       THR 304   7.284  -1.410  10.098
  744    HB   THR 304           HB       THR 304   7.808  -3.078   7.711
  745    HG1  THR 304           1HG      THR 304   8.819  -3.877   9.388
  746   HG21  THR 304          3HG2      THR 304   9.879  -1.884   7.164
  747   HG22  THR 304          1HG2      THR 304   9.355  -0.548   8.191
  748   HG23  THR 304          2HG2      THR 304   8.427  -0.970   6.751
  749    H    GLN 305           H        GLN 305   7.876   0.691   9.452
  750    HA   GLN 305           HA       GLN 305   5.844   2.057   7.928
  751    HB2  GLN 305           2HB      GLN 305   7.753   2.775   9.944
  752    HB3  GLN 305           1HB      GLN 305   7.924   3.852   8.565
  753    HG2  GLN 305           2HG      GLN 305   6.069   4.945   9.078
  754    HG3  GLN 305           1HG      GLN 305   5.148   3.453   9.230
  755   HE21  GLN 305          1HE2      GLN 305   5.190   2.343  11.266
  756   HE22  GLN 305          2HE2      GLN 305   5.463   3.226  12.725
  757    H    VAL 306           H        VAL 306   6.353   3.624   6.259
  758    HA   VAL 306           HA       VAL 306   8.785   3.117   4.723
  759    HB   VAL 306           HB       VAL 306   7.364   2.953   2.614
  760   HG11  VAL 306          1HG1      VAL 306   7.112   0.558   2.811
  761   HG12  VAL 306          2HG1      VAL 306   7.156   0.665   4.572
  762   HG13  VAL 306          3HG1      VAL 306   8.592   1.061   3.627
  763   HG21  VAL 306          3HG2      VAL 306   5.233   2.338   4.661
  764   HG22  VAL 306          1HG2      VAL 306   5.093   2.022   2.930
  765   HG23  VAL 306          2HG2      VAL 306   5.241   3.678   3.516
  Start of MODEL   21
    1    HA   MET   1           HA       MET   1  -8.267   0.599  -8.111
    2    H1   MET   1           1HT      MET   1  -7.821  -0.271  -5.979
    3    H2   MET   1           2HT      MET   1  -9.476   0.168  -6.086
    4    H3   MET   1           3HT      MET   1  -8.376   1.164  -5.224
    5    HB2  MET   1           2HB      MET   1  -9.176   2.816  -8.419
    6    HB3  MET   1           1HB      MET   1 -10.262   1.900  -7.384
    7    HG2  MET   1           2HG      MET   1  -9.507   3.058  -5.441
    8    HG3  MET   1           1HG      MET   1  -8.209   3.836  -6.344
    9    HE1  MET   1           3HE      MET   1 -10.122   6.680  -5.268
   10    HE2  MET   1           1HE      MET   1  -9.135   6.915  -6.709
   11    HE3  MET   1           2HE      MET   1  -8.598   5.811  -5.442
   12    H    GLU   2           H        GLU   2  -7.005   2.486  -9.149
   13    HA   GLU   2           HA       GLU   2  -4.387   2.521  -7.954
   14    HB2  GLU   2           2HB      GLU   2  -5.413   3.883 -10.454
   15    HB3  GLU   2           1HB      GLU   2  -3.725   3.778  -9.976
   16    HG2  GLU   2           2HG      GLU   2  -3.688   1.980 -11.298
   17    HG3  GLU   2           1HG      GLU   2  -4.440   1.165  -9.930
   18    H    ILE   3           H        ILE   3  -3.240   4.306  -7.182
   19    HA   ILE   3           HA       ILE   3  -4.626   6.857  -6.956
   20    HB   ILE   3           HB       ILE   3  -3.620   5.271  -4.587
   21   HG12  ILE   3          2HG1      ILE   3  -6.293   6.565  -4.631
   22   HG13  ILE   3          1HG1      ILE   3  -6.079   5.173  -5.684
   23   HG21  ILE   3          1HG2      ILE   3  -4.274   8.182  -4.853
   24   HG22  ILE   3          2HG2      ILE   3  -2.860   7.421  -4.124
   25   HG23  ILE   3          3HG2      ILE   3  -4.422   7.344  -3.308
   26   HD11  ILE   3          3HD1      ILE   3  -5.169   3.996  -3.590
   27   HD12  ILE   3          1HD1      ILE   3  -6.907   4.259  -3.729
   28   HD13  ILE   3          2HD1      ILE   3  -5.935   5.316  -2.706
   29    H    LYS   4           H        LYS   4  -3.130   7.946  -8.157
   30    HA   LYS   4           HA       LYS   4  -0.285   7.684  -7.499
   31    HB2  LYS   4           2HB      LYS   4  -1.098   9.632  -9.571
   32    HB3  LYS   4           1HB      LYS   4   0.200   8.451  -9.590
   33    HG2  LYS   4           2HG      LYS   4  -1.071   7.493 -11.169
   34    HG3  LYS   4           1HG      LYS   4  -1.917   6.804  -9.783
   35    HD2  LYS   4           2HD      LYS   4  -3.737   8.154 -10.056
   36    HD3  LYS   4           1HD      LYS   4  -2.787   9.481 -10.728
   37    HE2  LYS   4           2HE      LYS   4  -2.500   8.105 -12.801
   38    HE3  LYS   4           1HE      LYS   4  -3.646   6.950 -12.122
   39    HZ1  LYS   4           3HZ      LYS   4  -5.309   8.707 -12.047
   40    HZ2  LYS   4           1HZ      LYS   4  -4.736   8.488 -13.624
   41    HZ3  LYS   4           2HZ      LYS   4  -4.209   9.808 -12.708
   42    H    LEU   5           H        LEU   5   0.989   9.551  -6.831
   43    HA   LEU   5           HA       LEU   5  -0.483  11.984  -6.242
   44    HG   LEU   5           HG       LEU   5  -1.968  10.999  -4.678
   45    HB2  LEU   5           2HB      LEU   5   0.527  10.057  -4.214
   46    HB3  LEU   5           1HB      LEU   5   0.776  11.761  -3.889
   47   HD11  LEU   5          1HD1      LEU   5  -2.474   9.623  -2.996
   48   HD12  LEU   5          2HD1      LEU   5  -1.507  10.535  -1.839
   49   HD13  LEU   5          3HD1      LEU   5  -0.739   9.337  -2.878
   50   HD21  LEU   5          3HD2      LEU   5  -2.575  12.690  -3.147
   51   HD22  LEU   5          1HD2      LEU   5  -1.145  13.292  -3.984
   52   HD23  LEU   5          2HD2      LEU   5  -1.002  12.641  -2.351
   53    H    ILE   6           H        ILE   6   1.079  13.639  -5.252
   54    HA   ILE   6           HA       ILE   6   3.587  13.489  -6.755
   55    HB   ILE   6           HB       ILE   6   2.057  15.465  -7.051
   56   HG12  ILE   6          2HG1      ILE   6   4.762  16.249  -5.970
   57   HG13  ILE   6          1HG1      ILE   6   4.558  15.414  -7.507
   58   HG21  ILE   6          1HG2      ILE   6   1.558  15.573  -4.538
   59   HG22  ILE   6          2HG2      ILE   6   1.770  17.092  -5.409
   60   HG23  ILE   6          3HG2      ILE   6   3.080  16.457  -4.415
   61   HD11  ILE   6          3HD1      ILE   6   2.934  17.367  -8.046
   62   HD12  ILE   6          1HD1      ILE   6   4.677  17.611  -8.160
   63   HD13  ILE   6          2HD1      ILE   6   3.795  18.191  -6.746
   64    H    LYS   7           H        LYS   7   5.447  13.103  -5.761
   65    HA   LYS   7           HA       LYS   7   5.689  12.446  -3.082
   66    HB2  LYS   7           2HB      LYS   7   7.263  11.872  -4.972
   67    HB3  LYS   7           1HB      LYS   7   7.951  13.478  -4.786
   68    HG2  LYS   7           2HG      LYS   7   9.391  12.188  -3.545
   69    HG3  LYS   7           1HG      LYS   7   8.277  12.773  -2.310
   70    HD2  LYS   7           2HD      LYS   7   6.965  10.605  -2.773
   71    HD3  LYS   7           1HD      LYS   7   8.442  10.053  -3.564
   72    HE2  LYS   7           2HE      LYS   7   8.620  11.218  -0.831
   73    HE3  LYS   7           1HE      LYS   7   8.000   9.579  -1.016
   74    HZ1  LYS   7           3HZ      LYS   7  10.011   8.868  -1.974
   75    HZ2  LYS   7           1HZ      LYS   7  10.461   9.799  -0.635
   76    HZ3  LYS   7           2HZ      LYS   7  10.577  10.448  -2.192
   77    H    GLY   8           H        GLY   8   5.897  13.536  -1.252
   78    HA2  GLY   8           2HA      GLY   8   6.185  16.455  -1.372
   79    HA3  GLY   8           1HA      GLY   8   5.583  15.531  -0.003
   80    HA   PRO   9           HA       PRO   9   9.888  16.688   1.116
   81    HB2  PRO   9           2HB      PRO   9   8.871  16.607   3.863
   82    HB3  PRO   9           1HB      PRO   9   9.615  17.943   2.987
   83    HG2  PRO   9           2HG      PRO   9   6.990  17.909   3.634
   84    HG3  PRO   9           1HG      PRO   9   7.608  18.707   2.176
   85    HD2  PRO   9           2HD      PRO   9   6.271  16.041   2.459
   86    HD3  PRO   9           1HD      PRO   9   6.058  17.281   1.204
   87    H    LYS  10           H        LYS  10   8.377  14.884   3.793
   88    HA   LYS  10           HA       LYS  10  10.513  13.054   3.972
   89    HB2  LYS  10           2HB      LYS  10   7.714  12.739   5.075
   90    HB3  LYS  10           1HB      LYS  10   9.147  11.875   5.610
   91    HG2  LYS  10           2HG      LYS  10   9.384  13.445   7.158
   92    HG3  LYS  10           1HG      LYS  10   9.843  14.546   5.858
   93    HD2  LYS  10           2HD      LYS  10   8.104  15.594   7.116
   94    HD3  LYS  10           1HD      LYS  10   7.416  15.088   5.572
   95    HE2  LYS  10           2HE      LYS  10   5.806  14.105   6.764
   96    HE3  LYS  10           1HE      LYS  10   7.012  12.900   7.208
   97    HZ1  LYS  10           3HZ      LYS  10   5.907  13.796   9.155
   98    HZ2  LYS  10           1HZ      LYS  10   6.382  15.366   8.741
   99    HZ3  LYS  10           2HZ      LYS  10   7.546  14.215   9.168
  100    H    GLY  11           H        GLY  11   7.121  12.453   2.985
  101    HA2  GLY  11           2HA      GLY  11   7.150  11.246   0.690
  102    HA3  GLY  11           1HA      GLY  11   8.040  10.032   1.596
  103    H    LEU  12           H        LEU  12   6.562   8.410   1.366
  104    HA   LEU  12           HA       LEU  12   3.895   8.299   1.415
  105    HG   LEU  12           HG       LEU  12   3.805   5.927   0.548
  106    HB2  LEU  12           2HB      LEU  12   5.960   6.502   2.587
  107    HB3  LEU  12           1HB      LEU  12   4.277   6.151   2.925
  108   HD11  LEU  12          1HD1      LEU  12   5.669   5.961  -1.085
  109   HD12  LEU  12          2HD1      LEU  12   6.716   6.616   0.174
  110   HD13  LEU  12          3HD1      LEU  12   5.322   7.542  -0.385
  111   HD21  LEU  12          3HD2      LEU  12   5.012   3.896   0.128
  112   HD22  LEU  12          1HD2      LEU  12   4.642   3.991   1.850
  113   HD23  LEU  12          2HD2      LEU  12   6.270   4.355   1.277
  114    H    GLY  13           H        GLY  13   5.708   7.987   4.491
  115    HA2  GLY  13           2HA      GLY  13   5.219   8.820   6.588
  116    HA3  GLY  13           1HA      GLY  13   3.943   9.780   5.863
  117    H    PHE  14           H        PHE  14   4.419   6.256   5.955
  118    HA   PHE  14           HA       PHE  14   2.395   5.826   7.911
  119    HD1  PHE  14           2HD      PHE  14   2.144   3.043   4.998
  120    HD2  PHE  14           1HD      PHE  14   1.215   7.047   3.887
  121    HE1  PHE  14           2HE      PHE  14   2.515   2.468   2.641
  122    HE2  PHE  14           1HE      PHE  14   1.584   6.478   1.524
  123    HZ   PHE  14           HZ       PHE  14   2.234   4.187   0.897
  124    HB2  PHE  14           2HB      PHE  14   0.770   4.660   6.461
  125    HB3  PHE  14           1HB      PHE  14   0.896   6.370   6.083
  126    H    SER  15           H        SER  15   1.700   3.219   7.500
  127    HA   SER  15           HA       SER  15   4.246   1.812   7.104
  128    HG   SER  15           HG       SER  15   2.482   2.782  10.008
  129    HB2  SER  15           2HB      SER  15   3.161   0.269   9.000
  130    HB3  SER  15           1HB      SER  15   4.194   1.637   9.400
  131    H    ILE  16           H        ILE  16   3.758  -0.677   7.041
  132    HA   ILE  16           HA       ILE  16   1.177  -1.408   5.985
  133    HB   ILE  16           HB       ILE  16   1.683  -1.891   3.789
  134   HG12  ILE  16          2HG1      ILE  16   3.801  -3.116   4.286
  135   HG13  ILE  16          1HG1      ILE  16   3.825  -2.198   2.788
  136   HG21  ILE  16          1HG2      ILE  16   1.544   0.481   3.947
  137   HG22  ILE  16          2HG2      ILE  16   2.779   0.074   2.757
  138   HG23  ILE  16          3HG2      ILE  16   3.251   0.599   4.371
  139   HD11  ILE  16          3HD1      ILE  16   4.789  -0.616   4.977
  140   HD12  ILE  16          1HD1      ILE  16   5.570  -1.034   3.453
  141   HD13  ILE  16          2HD1      ILE  16   5.689  -2.129   4.835
  142    H    ALA  17           H        ALA  17   1.306  -3.694   5.085
  143    HA   ALA  17           HA       ALA  17   3.335  -5.374   6.354
  144    HB1  ALA  17           3HB      ALA  17   1.887  -6.066   7.915
  145    HB2  ALA  17           1HB      ALA  17   0.998  -6.849   6.612
  146    HB3  ALA  17           2HB      ALA  17   0.540  -5.228   7.145
  147    H    GLY  18           H        GLY  18   3.062  -7.724   5.318
  148    HA2  GLY  18           2HA      GLY  18   1.573  -8.181   3.069
  149    HA3  GLY  18           1HA      GLY  18   2.923  -7.248   2.470
  150    H    GLY  19           H        GLY  19   1.800 -10.315   2.627
  151    HA2  GLY  19           2HA      GLY  19   3.166 -12.018   1.641
  152    HA3  GLY  19           1HA      GLY  19   4.550 -11.345   2.478
  153    H    VAL  20           H        VAL  20   3.928 -14.045   2.464
  154    HA   VAL  20           HA       VAL  20   2.488 -14.904   4.734
  155    HB   VAL  20           HB       VAL  20   3.123 -16.363   2.795
  156   HG11  VAL  20          1HG1      VAL  20   5.278 -17.312   2.597
  157   HG12  VAL  20          2HG1      VAL  20   5.799 -16.641   4.142
  158   HG13  VAL  20          3HG1      VAL  20   5.524 -15.574   2.765
  159   HG21  VAL  20          3HG2      VAL  20   4.016 -17.506   5.434
  160   HG22  VAL  20          1HG2      VAL  20   3.279 -18.360   4.078
  161   HG23  VAL  20          2HG2      VAL  20   2.327 -17.212   5.020
  162    H    GLY  21           H        GLY  21   3.183 -15.515   6.796
  163    HA2  GLY  21           2HA      GLY  21   4.663 -15.707   8.604
  164    HA3  GLY  21           1HA      GLY  21   5.960 -15.121   7.575
  165    H    ASN  22           H        ASN  22   4.073 -12.827   6.805
  166    HA   ASN  22           HA       ASN  22   4.187 -11.253   9.276
  167    HB2  ASN  22           2HB      ASN  22   5.229  -9.395   8.204
  168    HB3  ASN  22           1HB      ASN  22   6.201 -10.792   7.754
  169   HD21  ASN  22          1HD2      ASN  22   6.011 -11.638   5.647
  170   HD22  ASN  22          2HD2      ASN  22   5.423 -10.658   4.353
  171    H    GLN  23           H        GLN  23   2.130 -12.570   7.269
  172    HA   GLN  23           HA       GLN  23   0.646 -10.834   5.862
  173    HB2  GLN  23           2HB      GLN  23  -0.019 -13.240   7.471
  174    HB3  GLN  23           1HB      GLN  23  -1.357 -12.273   6.867
  175    HG2  GLN  23           2HG      GLN  23  -0.213 -12.462   4.586
  176    HG3  GLN  23           1HG      GLN  23   0.731 -13.757   5.320
  177   HE21  GLN  23          1HE2      GLN  23  -2.565 -12.688   4.654
  178   HE22  GLN  23          2HE2      GLN  23  -3.250 -14.270   4.559
  179    H    HIS  24           H        HIS  24  -0.847  -9.286   6.137
  180    HA   HIS  24           HA       HIS  24  -1.118  -8.097   8.777
  181    HD1  HIS  24           1HD      HIS  24  -0.484  -5.239   8.879
  182    HD2  HIS  24           2HD      HIS  24  -4.227  -5.579   7.126
  183    HE1  HIS  24           1HE      HIS  24  -1.823  -3.345   9.803
  184    HE2  HIS  24           2HE      HIS  24  -4.047  -3.476   8.631
  185    HB2  HIS  24           2HB      HIS  24  -0.626  -6.742   6.711
  186    HB3  HIS  24           1HB      HIS  24  -2.238  -7.123   6.144
  187    H    ILE  25           H        ILE  25  -2.995  -9.973   6.536
  188    HA   ILE  25           HA       ILE  25  -5.179 -10.052   8.444
  189    HB   ILE  25           HB       ILE  25  -5.379  -8.277   6.380
  190   HG12  ILE  25          2HG1      ILE  25  -7.676  -9.748   7.681
  191   HG13  ILE  25          1HG1      ILE  25  -6.765  -8.435   8.420
  192   HG21  ILE  25          1HG2      ILE  25  -6.965  -9.118   4.758
  193   HG22  ILE  25          2HG2      ILE  25  -6.893 -10.724   5.487
  194   HG23  ILE  25          3HG2      ILE  25  -5.467 -10.045   4.699
  195   HD11  ILE  25          3HD1      ILE  25  -8.350  -8.189   5.875
  196   HD12  ILE  25          1HD1      ILE  25  -7.548  -6.891   6.758
  197   HD13  ILE  25          2HD1      ILE  25  -8.926  -7.726   7.476
  198    HA   PRO  26           HA       PRO  26  -4.784 -14.381   7.485
  199    HB2  PRO  26           2HB      PRO  26  -7.629 -14.409   8.378
  200    HB3  PRO  26           1HB      PRO  26  -6.273 -15.414   8.903
  201    HG2  PRO  26           2HG      PRO  26  -7.171 -13.439  10.442
  202    HG3  PRO  26           1HG      PRO  26  -5.434 -13.780  10.316
  203    HD2  PRO  26           2HD      PRO  26  -7.031 -11.578   9.088
  204    HD3  PRO  26           1HD      PRO  26  -5.369 -11.561   9.712
  205    H    GLY  27           H        GLY  27  -4.928 -15.269   5.530
  206    HA2  GLY  27           2HA      GLY  27  -6.250 -16.258   3.789
  207    HA3  GLY  27           1HA      GLY  27  -7.433 -14.980   4.010
  208    H    ASP  28           H        ASP  28  -6.057 -12.689   3.827
  209    HA   ASP  28           HA       ASP  28  -5.096 -12.751   1.062
  210    HB2  ASP  28           2HB      ASP  28  -6.779 -10.992   2.515
  211    HB3  ASP  28           1HB      ASP  28  -5.330 -10.086   2.094
  212    H    ASN  29           H        ASN  29  -2.966 -12.971   0.843
  213    HA   ASN  29           HA       ASN  29  -1.136 -11.986   2.871
  214    HB2  ASN  29           2HB      ASN  29  -0.557 -13.393   0.256
  215    HB3  ASN  29           1HB      ASN  29   0.619 -13.054   1.522
  216   HD21  ASN  29          1HD2      ASN  29   1.104 -14.781   2.647
  217   HD22  ASN  29          2HD2      ASN  29   0.020 -16.052   3.090
  218    H    SER  30           H        SER  30  -2.735 -10.169   0.962
  219    HA   SER  30           HA       SER  30  -0.815  -8.878  -0.701
  220    HG   SER  30           HG       SER  30  -3.996  -9.477  -1.100
  221    HB2  SER  30           2HB      SER  30  -3.516  -7.920   0.287
  222    HB3  SER  30           1HB      SER  30  -2.545  -7.106  -0.938
  223    H    ILE  31           H        ILE  31  -0.792  -6.277  -0.336
  224    HA   ILE  31           HA       ILE  31   0.493  -5.997   2.282
  225    HB   ILE  31           HB       ILE  31   0.872  -4.548  -0.299
  226   HG12  ILE  31          2HG1      ILE  31   3.235  -4.874   0.203
  227   HG13  ILE  31          1HG1      ILE  31   2.833  -5.519   1.786
  228   HG21  ILE  31          1HG2      ILE  31   0.495  -2.682   1.097
  229   HG22  ILE  31          2HG2      ILE  31   2.245  -2.844   0.963
  230   HG23  ILE  31          3HG2      ILE  31   1.418  -3.395   2.419
  231   HD11  ILE  31          3HD1      ILE  31   2.613  -6.778  -0.894
  232   HD12  ILE  31          1HD1      ILE  31   1.499  -7.281   0.375
  233   HD13  ILE  31          2HD1      ILE  31   3.237  -7.435   0.617
  234    H    TYR  32           H        TYR  32  -0.613  -5.110   3.867
  235    HA   TYR  32           HA       TYR  32  -2.731  -3.164   3.227
  236    HD1  TYR  32           2HD      TYR  32  -2.519  -6.652   3.286
  237    HD2  TYR  32           1HD      TYR  32  -5.761  -4.315   4.734
  238    HE1  TYR  32           2HE      TYR  32  -4.088  -8.094   2.063
  239    HE2  TYR  32           1HE      TYR  32  -7.348  -5.742   3.525
  240    HH   TYR  32           HH       TYR  32  -6.554  -7.730   1.095
  241    HB2  TYR  32           2HB      TYR  32  -2.465  -5.146   5.477
  242    HB3  TYR  32           1HB      TYR  32  -3.649  -3.848   5.492
  243    H    VAL  33           H        VAL  33  -2.854  -1.249   4.344
  244    HA   VAL  33           HA       VAL  33  -0.457  -0.322   5.638
  245    HB   VAL  33           HB       VAL  33  -3.101   1.047   5.113
  246   HG11  VAL  33          1HG1      VAL  33  -0.778   1.888   6.727
  247   HG12  VAL  33          2HG1      VAL  33  -2.465   2.394   6.813
  248   HG13  VAL  33          3HG1      VAL  33  -1.399   3.083   5.589
  249   HG21  VAL  33          3HG2      VAL  33  -0.480   0.907   3.711
  250   HG22  VAL  33          1HG2      VAL  33  -1.392   2.414   3.639
  251   HG23  VAL  33          2HG2      VAL  33  -2.116   0.916   3.052
  252    H    THR  34           H        THR  34  -0.054  -0.320   7.761
  253    HA   THR  34           HA       THR  34  -2.206  -1.129   9.578
  254    HB   THR  34           HB       THR  34  -0.183  -2.514   9.507
  255    HG1  THR  34           1HG      THR  34  -0.302  -1.209  12.010
  256   HG21  THR  34          3HG2      THR  34   1.737  -1.386   9.203
  257   HG22  THR  34          1HG2      THR  34   1.740  -1.375  10.966
  258   HG23  THR  34          2HG2      THR  34   1.171   0.037  10.077
  259    H    LYS  35           H        LYS  35  -0.036   1.589   9.043
  260    HA   LYS  35           HA       LYS  35  -1.518   3.127  11.004
  261    HB2  LYS  35           2HB      LYS  35   1.313   2.286  11.452
  262    HB3  LYS  35           1HB      LYS  35   0.834   3.896  11.955
  263    HG2  LYS  35           2HG      LYS  35  -0.794   1.555  12.809
  264    HG3  LYS  35           1HG      LYS  35   0.743   1.888  13.604
  265    HD2  LYS  35           2HD      LYS  35  -0.373   4.357  13.600
  266    HD3  LYS  35           1HD      LYS  35  -1.813   3.346  13.726
  267    HE2  LYS  35           2HE      LYS  35  -1.283   2.614  15.803
  268    HE3  LYS  35           1HE      LYS  35   0.450   2.623  15.481
  269    HZ1  LYS  35           3HZ      LYS  35  -0.169   4.295  17.116
  270    HZ2  LYS  35           1HZ      LYS  35  -1.217   5.027  16.006
  271    HZ3  LYS  35           2HZ      LYS  35   0.451   5.024  15.721
  272    H    ILE  36           H        ILE  36  -1.932   5.011  10.024
  273    HA   ILE  36           HA       ILE  36  -0.038   6.004   8.022
  274    HB   ILE  36           HB       ILE  36  -2.873   6.876   8.602
  275   HG12  ILE  36          2HG1      ILE  36  -1.611   5.100   6.525
  276   HG13  ILE  36          1HG1      ILE  36  -3.010   4.780   7.544
  277   HG21  ILE  36          1HG2      ILE  36  -1.372   8.693   7.776
  278   HG22  ILE  36          2HG2      ILE  36  -2.717   8.320   6.699
  279   HG23  ILE  36          3HG2      ILE  36  -1.097   7.733   6.322
  280   HD11  ILE  36          3HD1      ILE  36  -4.182   6.616   6.241
  281   HD12  ILE  36          1HD1      ILE  36  -3.861   5.104   5.389
  282   HD13  ILE  36          2HD1      ILE  36  -2.837   6.511   5.104
  283    H    ILE  37           H        ILE  37   1.363   7.562   8.558
  284    HA   ILE  37           HA       ILE  37   1.204   8.900  11.091
  285    HB   ILE  37           HB       ILE  37   3.166   8.933   8.821
  286   HG12  ILE  37          2HG1      ILE  37   4.648   8.437  10.947
  287   HG13  ILE  37          1HG1      ILE  37   3.099   8.000  11.659
  288   HG21  ILE  37          1HG2      ILE  37   4.556  10.501  10.253
  289   HG22  ILE  37          2HG2      ILE  37   3.052  10.895  11.087
  290   HG23  ILE  37          3HG2      ILE  37   3.211  11.211   9.358
  291   HD11  ILE  37          3HD1      ILE  37   4.199   6.825   9.118
  292   HD12  ILE  37          1HD1      ILE  37   2.749   6.318   9.986
  293   HD13  ILE  37          2HD1      ILE  37   4.338   6.087  10.714
  294    H    GLU  38           H        GLU  38   0.879  11.096  11.491
  295    HA   GLU  38           HA       GLU  38  -1.022  12.421   9.922
  296    HB2  GLU  38           2HB      GLU  38   0.695  13.208  12.234
  297    HB3  GLU  38           1HB      GLU  38  -0.146  14.473  11.350
  298    HG2  GLU  38           2HG      GLU  38  -1.413  13.719  13.293
  299    HG3  GLU  38           1HG      GLU  38  -2.275  13.411  11.788
  300    H    GLY  39           H        GLY  39  -0.925  14.283   8.644
  301    HA2  GLY  39           2HA      GLY  39  -0.110  15.589   6.957
  302    HA3  GLY  39           1HA      GLY  39   1.340  15.731   7.936
  303    H    GLY  40           H        GLY  40   0.413  12.551   6.885
  304    HA2  GLY  40           2HA      GLY  40   2.814  12.428   5.236
  305    HA3  GLY  40           1HA      GLY  40   1.841  11.066   5.766
  306    H    ALA  41           H        ALA  41   2.664  11.000   3.244
  307    HA   ALA  41           HA       ALA  41   1.266  12.252   1.232
  308    HB1  ALA  41           3HB      ALA  41   1.848  10.397  -0.189
  309    HB2  ALA  41           1HB      ALA  41   2.115   9.359   1.211
  310    HB3  ALA  41           2HB      ALA  41   3.187  10.726   0.909
  311    H    ALA  42           H        ALA  42   0.334   9.203   2.877
  312    HA   ALA  42           HA       ALA  42  -2.126   8.975   1.444
  313    HB1  ALA  42           3HB      ALA  42  -1.065   7.582   3.892
  314    HB2  ALA  42           1HB      ALA  42  -1.149   6.965   2.243
  315    HB3  ALA  42           2HB      ALA  42  -2.629   7.212   3.169
  316    H    HIS  43           H        HIS  43  -1.348   9.787   4.823
  317    HA   HIS  43           HA       HIS  43  -3.840  10.312   5.826
  318    HD1  HIS  43           1HD      HIS  43  -2.618  13.967   7.212
  319    HD2  HIS  43           2HD      HIS  43  -3.644  10.451   9.175
  320    HE1  HIS  43           1HE      HIS  43  -3.907  14.688   9.242
  321    HE2  HIS  43           2HE      HIS  43  -4.461  12.548  10.455
  322    HB2  HIS  43           2HB      HIS  43  -1.745  10.335   7.136
  323    HB3  HIS  43           1HB      HIS  43  -1.320  11.878   6.408
  324    H    LYS  44           H        LYS  44  -1.770  12.578   4.024
  325    HA   LYS  44           HA       LYS  44  -3.626  14.750   4.201
  326    HB2  LYS  44           2HB      LYS  44  -1.165  14.286   2.522
  327    HB3  LYS  44           1HB      LYS  44  -2.135  15.746   2.393
  328    HG2  LYS  44           2HG      LYS  44  -1.754  16.096   4.850
  329    HG3  LYS  44           1HG      LYS  44  -0.590  14.772   4.779
  330    HD2  LYS  44           2HD      LYS  44   0.919  15.980   3.550
  331    HD3  LYS  44           1HD      LYS  44  -0.328  16.984   2.807
  332    HE2  LYS  44           2HE      LYS  44  -0.563  17.684   5.425
  333    HE3  LYS  44           1HE      LYS  44   1.167  17.361   5.307
  334    HZ1  LYS  44           3HZ      LYS  44  -0.354  19.204   3.542
  335    HZ2  LYS  44           1HZ      LYS  44   1.313  18.922   3.482
  336    HZ3  LYS  44           2HZ      LYS  44   0.631  19.679   4.832
  337    H    ASP  45           H        ASP  45  -2.966  12.214   1.851
  338    HA   ASP  45           HA       ASP  45  -4.442  13.246  -0.309
  339    HB2  ASP  45           2HB      ASP  45  -2.820  11.320  -0.389
  340    HB3  ASP  45           1HB      ASP  45  -4.053  10.323   0.371
  341    H    GLY  46           H        GLY  46  -5.390  10.906   2.217
  342    HA2  GLY  46           2HA      GLY  46  -7.490  10.868   3.292
  343    HA3  GLY  46           1HA      GLY  46  -8.145  11.860   2.004
  344    H    LYS  47           H        LYS  47  -6.903   9.950  -0.024
  345    HA   LYS  47           HA       LYS  47  -9.201   8.280  -0.294
  346    HB2  LYS  47           2HB      LYS  47  -6.625   8.492  -1.836
  347    HB3  LYS  47           1HB      LYS  47  -7.840   7.283  -2.221
  348    HG2  LYS  47           2HG      LYS  47  -8.676   8.826  -3.594
  349    HG3  LYS  47           1HG      LYS  47  -9.329   9.571  -2.134
  350    HD2  LYS  47           2HD      LYS  47  -7.240  10.913  -1.959
  351    HD3  LYS  47           1HD      LYS  47  -6.730  10.243  -3.510
  352    HE2  LYS  47           2HE      LYS  47  -8.503  11.297  -4.659
  353    HE3  LYS  47           1HE      LYS  47  -9.342  11.690  -3.158
  354    HZ1  LYS  47           3HZ      LYS  47  -6.727  12.831  -3.989
  355    HZ2  LYS  47           1HZ      LYS  47  -7.612  13.252  -2.609
  356    HZ3  LYS  47           2HZ      LYS  47  -8.218  13.613  -4.146
  357    H    LEU  48           H        LEU  48  -5.873   7.734   0.806
  358    HA   LEU  48           HA       LEU  48  -6.368   4.879   1.078
  359    HG   LEU  48           HG       LEU  48  -4.690   3.588   0.753
  360    HB2  LEU  48           2HB      LEU  48  -4.120   6.241   0.433
  361    HB3  LEU  48           1HB      LEU  48  -3.875   6.038   2.157
  362   HD11  LEU  48          1HD1      LEU  48  -2.463   3.197  -0.202
  363   HD12  LEU  48          2HD1      LEU  48  -2.015   4.859   0.185
  364   HD13  LEU  48          3HD1      LEU  48  -3.296   4.540  -0.985
  365   HD21  LEU  48          3HD2      LEU  48  -3.120   2.579   2.205
  366   HD22  LEU  48          1HD2      LEU  48  -3.967   3.805   3.147
  367   HD23  LEU  48          2HD2      LEU  48  -2.337   4.123   2.549
  368    H    GLN  49           H        GLN  49  -6.940   3.900   2.905
  369    HA   GLN  49           HA       GLN  49  -6.610   5.283   5.468
  370    HB2  GLN  49           2HB      GLN  49  -8.850   4.602   6.146
  371    HB3  GLN  49           1HB      GLN  49  -8.928   5.611   4.712
  372    HG2  GLN  49           2HG      GLN  49  -8.937   2.626   4.490
  373    HG3  GLN  49           1HG      GLN  49 -10.413   3.513   4.857
  374   HE21  GLN  49          1HE2      GLN  49  -8.345   2.419   2.425
  375   HE22  GLN  49          2HE2      GLN  49  -9.048   3.273   1.098
  376    H    ILE  50           H        ILE  50  -6.160   3.946   7.218
  377    HA   ILE  50           HA       ILE  50  -4.766   1.618   6.856
  378    HB   ILE  50           HB       ILE  50  -5.342   1.041   9.254
  379   HG12  ILE  50          2HG1      ILE  50  -6.384   3.592   9.998
  380   HG13  ILE  50          1HG1      ILE  50  -7.435   2.922   8.756
  381   HG21  ILE  50          1HG2      ILE  50  -4.390   3.865   8.831
  382   HG22  ILE  50          2HG2      ILE  50  -3.408   2.433   8.520
  383   HG23  ILE  50          3HG2      ILE  50  -3.974   2.776  10.154
  384   HD11  ILE  50          3HD1      ILE  50  -8.080   1.156  10.066
  385   HD12  ILE  50          1HD1      ILE  50  -7.871   2.424  11.272
  386   HD13  ILE  50          2HD1      ILE  50  -6.615   1.206  11.047
  387    H    GLY  51           H        GLY  51  -5.262  -0.369   6.182
  388    HA2  GLY  51           2HA      GLY  51  -6.657  -2.359   6.688
  389    HA3  GLY  51           1HA      GLY  51  -8.047  -1.305   6.520
  390    H    ASP  52           H        ASP  52  -6.518  -0.004   4.111
  391    HA   ASP  52           HA       ASP  52  -7.783  -1.596   2.149
  392    HB2  ASP  52           2HB      ASP  52  -6.490  -0.109   0.521
  393    HB3  ASP  52           1HB      ASP  52  -7.627   0.684   1.600
  394    H    LYS  53           H        LYS  53  -6.668  -2.546   0.252
  395    HA   LYS  53           HA       LYS  53  -4.179  -3.863   1.107
  396    HB2  LYS  53           2HB      LYS  53  -4.921  -5.583  -0.713
  397    HB3  LYS  53           1HB      LYS  53  -5.650  -5.627   0.881
  398    HG2  LYS  53           2HG      LYS  53  -7.104  -3.907  -0.955
  399    HG3  LYS  53           1HG      LYS  53  -6.982  -5.571  -1.526
  400    HD2  LYS  53           2HD      LYS  53  -8.727  -6.003  -0.199
  401    HD3  LYS  53           1HD      LYS  53  -7.594  -5.870   1.145
  402    HE2  LYS  53           2HE      LYS  53  -8.108  -3.377   1.121
  403    HE3  LYS  53           1HE      LYS  53  -9.455  -3.775   0.060
  404    HZ1  LYS  53           3HZ      LYS  53  -9.086  -4.367   2.902
  405    HZ2  LYS  53           1HZ      LYS  53  -9.957  -5.482   1.972
  406    HZ3  LYS  53           2HZ      LYS  53 -10.476  -3.875   2.074
  407    H    LEU  54           H        LEU  54  -2.552  -4.124  -0.322
  408    HA   LEU  54           HA       LEU  54  -2.532  -2.205  -2.531
  409    HG   LEU  54           HG       LEU  54  -1.295  -0.715  -1.133
  410    HB2  LEU  54           2HB      LEU  54  -0.546  -3.123  -0.625
  411    HB3  LEU  54           1HB      LEU  54   0.061  -3.144  -2.270
  412   HD11  LEU  54          1HD1      LEU  54   0.393  -0.706   0.373
  413   HD12  LEU  54          2HD1      LEU  54   1.270  -0.009  -0.990
  414   HD13  LEU  54          3HD1      LEU  54   1.435  -1.724  -0.619
  415   HD21  LEU  54          3HD2      LEU  54  -1.082  -0.148  -3.284
  416   HD22  LEU  54          1HD2      LEU  54   0.072  -1.441  -3.611
  417   HD23  LEU  54          2HD2      LEU  54   0.625   0.077  -2.905
  418    H    LEU  55           H        LEU  55  -3.207  -3.033  -4.367
  419    HA   LEU  55           HA       LEU  55  -2.848  -5.749  -5.135
  420    HG   LEU  55           HG       LEU  55  -3.079  -5.881  -7.792
  421    HB2  LEU  55           2HB      LEU  55  -4.714  -4.285  -5.914
  422    HB3  LEU  55           1HB      LEU  55  -3.557  -3.384  -6.874
  423   HD11  LEU  55          1HD1      LEU  55  -5.197  -7.028  -8.120
  424   HD12  LEU  55          2HD1      LEU  55  -6.025  -5.803  -7.158
  425   HD13  LEU  55          3HD1      LEU  55  -4.837  -6.864  -6.401
  426   HD21  LEU  55          3HD2      LEU  55  -5.172  -3.930  -8.737
  427   HD22  LEU  55          1HD2      LEU  55  -4.546  -5.271  -9.695
  428   HD23  LEU  55          2HD2      LEU  55  -3.469  -3.968  -9.193
  429    H    ALA  56           H        ALA  56  -1.387  -2.669  -6.264
  430    HA   ALA  56           HA       ALA  56   1.084  -4.116  -6.827
  431    HB1  ALA  56           3HB      ALA  56  -0.567  -2.819  -8.993
  432    HB2  ALA  56           1HB      ALA  56   0.060  -4.467  -8.937
  433    HB3  ALA  56           2HB      ALA  56   1.163  -3.108  -9.176
  434    H    VAL  57           H        VAL  57   2.921  -2.745  -7.184
  435    HA   VAL  57           HA       VAL  57   2.519   0.121  -6.674
  436    HB   VAL  57           HB       VAL  57   4.532  -1.531  -5.138
  437   HG11  VAL  57          1HG1      VAL  57   4.735   0.559  -3.790
  438   HG12  VAL  57          2HG1      VAL  57   3.735   1.372  -4.993
  439   HG13  VAL  57          3HG1      VAL  57   5.304   0.713  -5.452
  440   HG21  VAL  57          3HG2      VAL  57   2.475  -2.159  -4.219
  441   HG22  VAL  57          1HG2      VAL  57   1.803  -0.536  -4.386
  442   HG23  VAL  57          2HG2      VAL  57   3.041  -0.857  -3.170
  443    H    ASN  58           H        ASN  58   3.455   1.122  -8.334
  444    HA   ASN  58           HA       ASN  58   4.974   1.771  -9.892
  445    HB2  ASN  58           2HB      ASN  58   6.908   0.075  -8.291
  446    HB3  ASN  58           1HB      ASN  58   7.358   1.224  -9.545
  447   HD21  ASN  58          1HD2      ASN  58   7.502   0.890  -6.412
  448   HD22  ASN  58          2HD2      ASN  58   7.215   2.506  -5.873
  449    H    ASN  59           H        ASN  59   3.301  -0.368 -10.509
  450    HA   ASN  59           HA       ASN  59   2.994  -1.665 -12.374
  451    HB2  ASN  59           2HB      ASN  59   5.307  -0.507 -13.089
  452    HB3  ASN  59           1HB      ASN  59   5.870  -2.165 -12.902
  453   HD21  ASN  59          1HD2      ASN  59   4.987  -3.789 -14.234
  454   HD22  ASN  59          2HD2      ASN  59   4.197  -3.397 -15.720
  455    H    VAL  60           H        VAL  60   4.948  -2.539  -9.681
  456    HA   VAL  60           HA       VAL  60   4.889  -5.383 -10.357
  457    HB   VAL  60           HB       VAL  60   6.242  -5.783  -8.433
  458   HG11  VAL  60          1HG1      VAL  60   7.710  -3.380  -9.060
  459   HG12  VAL  60          2HG1      VAL  60   7.051  -4.125 -10.518
  460   HG13  VAL  60          3HG1      VAL  60   8.087  -5.061  -9.439
  461   HG21  VAL  60          3HG2      VAL  60   6.051  -4.612  -6.565
  462   HG22  VAL  60          1HG2      VAL  60   5.011  -3.454  -7.390
  463   HG23  VAL  60          2HG2      VAL  60   6.757  -3.208  -7.365
  464    H    CYS  61           H        CYS  61   3.812  -6.954  -9.041
  465    HA   CYS  61           HA       CYS  61   1.399  -5.912  -7.813
  466    HG   CYS  61           HG       CYS  61   2.190 -10.197  -8.390
  467    HB2  CYS  61           2HB      CYS  61   0.721  -8.269  -7.613
  468    HB3  CYS  61           1HB      CYS  61   1.183  -7.851  -9.257
  469    H    LEU  62           H        LEU  62   1.018  -5.715  -5.694
  470    HA   LEU  62           HA       LEU  62   3.096  -6.623  -3.844
  471    HG   LEU  62           HG       LEU  62   3.225  -5.213  -1.639
  472    HB2  LEU  62           2HB      LEU  62   1.989  -4.137  -4.178
  473    HB3  LEU  62           1HB      LEU  62   1.086  -4.763  -2.816
  474   HD11  LEU  62          1HD1      LEU  62   4.737  -5.516  -3.453
  475   HD12  LEU  62          2HD1      LEU  62   5.268  -4.097  -2.553
  476   HD13  LEU  62          3HD1      LEU  62   4.404  -3.901  -4.078
  477   HD21  LEU  62          3HD2      LEU  62   3.661  -2.418  -2.180
  478   HD22  LEU  62          1HD2      LEU  62   3.035  -3.198  -0.729
  479   HD23  LEU  62          2HD2      LEU  62   1.939  -2.775  -2.044
  480    H    GLU  63           H        GLU  63   0.938  -8.337  -4.902
  481    HA   GLU  63           HA       GLU  63  -0.510  -8.894  -2.400
  482    HB2  GLU  63           2HB      GLU  63  -2.226  -9.986  -3.760
  483    HB3  GLU  63           1HB      GLU  63  -2.000  -8.309  -4.231
  484    HG2  GLU  63           2HG      GLU  63  -0.315  -9.510  -5.953
  485    HG3  GLU  63           1HG      GLU  63  -1.508 -10.789  -5.739
  486    H    GLU  64           H        GLU  64   1.809 -10.165  -4.609
  487    HA   GLU  64           HA       GLU  64   1.648 -12.770  -3.246
  488    HB2  GLU  64           2HB      GLU  64   1.358 -12.235  -6.007
  489    HB3  GLU  64           1HB      GLU  64   2.900 -13.046  -5.795
  490    HG2  GLU  64           2HG      GLU  64   1.372 -14.616  -4.263
  491    HG3  GLU  64           1HG      GLU  64   0.158 -14.053  -5.409
  492    H    VAL  65           H        VAL  65   3.214 -10.644  -2.298
  493    HA   VAL  65           HA       VAL  65   5.905 -11.769  -2.692
  494    HB   VAL  65           HB       VAL  65   6.868  -9.470  -2.476
  495   HG11  VAL  65          1HG1      VAL  65   6.674 -10.653  -4.637
  496   HG12  VAL  65          2HG1      VAL  65   6.582  -8.900  -4.807
  497   HG13  VAL  65          3HG1      VAL  65   5.115  -9.873  -4.898
  498   HG21  VAL  65          3HG2      VAL  65   4.017  -8.615  -2.979
  499   HG22  VAL  65          1HG2      VAL  65   5.425  -7.554  -3.030
  500   HG23  VAL  65          2HG2      VAL  65   4.956  -8.326  -1.515
  501    H    THR  66           H        THR  66   7.414 -11.313  -0.961
  502    HA   THR  66           HA       THR  66   6.245 -11.673   1.613
  503    HB   THR  66           HB       THR  66   9.096 -10.861   1.456
  504    HG1  THR  66           1HG      THR  66   9.500 -12.111  -0.166
  505   HG21  THR  66          3HG2      THR  66   9.107 -11.964   3.367
  506   HG22  THR  66          1HG2      THR  66   8.828 -13.454   2.466
  507   HG23  THR  66          2HG2      THR  66   7.462 -12.538   3.102
  508    H    HIS  67           H        HIS  67   7.704 -10.154   3.387
  509    HA   HIS  67           HA       HIS  67   6.366  -7.628   3.109
  510    HD1  HIS  67           1HD      HIS  67   4.970  -6.987   5.948
  511    HD2  HIS  67           2HD      HIS  67   8.805  -5.485   5.440
  512    HE1  HIS  67           1HE      HIS  67   4.860  -4.584   6.673
  513    HE2  HIS  67           2HE      HIS  67   7.149  -3.667   6.213
  514    HB2  HIS  67           2HB      HIS  67   6.641  -8.768   5.324
  515    HB3  HIS  67           1HB      HIS  67   8.340  -8.334   5.289
  516    H    GLU  68           H        GLU  68   9.698  -8.757   2.824
  517    HA   GLU  68           HA       GLU  68  11.061  -6.365   2.732
  518    HB2  GLU  68           2HB      GLU  68  11.522  -8.790   0.982
  519    HB3  GLU  68           1HB      GLU  68  12.678  -7.492   1.238
  520    HG2  GLU  68           2HG      GLU  68  13.178  -8.166   3.367
  521    HG3  GLU  68           1HG      GLU  68  11.615  -8.946   3.606
  522    H    GLU  69           H        GLU  69   9.331  -7.995   0.089
  523    HA   GLU  69           HA       GLU  69   9.883  -6.019  -1.881
  524    HB2  GLU  69           2HB      GLU  69   7.805  -8.193  -1.678
  525    HB3  GLU  69           1HB      GLU  69   7.886  -7.103  -3.054
  526    HG2  GLU  69           2HG      GLU  69   9.085  -8.904  -3.811
  527    HG3  GLU  69           1HG      GLU  69  10.363  -7.865  -3.186
  528    H    ALA  70           H        ALA  70   7.308  -6.484   0.477
  529    HA   ALA  70           HA       ALA  70   5.429  -4.615  -0.431
  530    HB1  ALA  70           3HB      ALA  70   4.943  -6.199   1.342
  531    HB2  ALA  70           1HB      ALA  70   4.669  -4.553   1.913
  532    HB3  ALA  70           2HB      ALA  70   6.123  -5.421   2.394
  533    H    VAL  71           H        VAL  71   8.233  -4.227   1.698
  534    HA   VAL  71           HA       VAL  71   7.790  -1.394   2.047
  535    HB   VAL  71           HB       VAL  71  10.007  -3.242   2.929
  536   HG11  VAL  71          1HG1      VAL  71   9.879  -0.255   3.038
  537   HG12  VAL  71          2HG1      VAL  71  11.242  -1.305   2.652
  538   HG13  VAL  71          3HG1      VAL  71  10.690  -1.156   4.320
  539   HG21  VAL  71          3HG2      VAL  71   8.285  -1.590   4.721
  540   HG22  VAL  71          1HG2      VAL  71   9.087  -3.127   5.037
  541   HG23  VAL  71          2HG2      VAL  71   7.646  -3.076   4.024
  542    H    THR  72           H        THR  72   9.799  -3.465   0.040
  543    HA   THR  72           HA       THR  72  11.607  -1.519  -0.874
  544    HB   THR  72           HB       THR  72  10.651  -4.122  -2.054
  545    HG1  THR  72           1HG      THR  72  12.102  -4.787  -0.711
  546   HG21  THR  72          3HG2      THR  72  12.752  -2.275  -3.158
  547   HG22  THR  72          1HG2      THR  72  11.322  -2.899  -3.982
  548   HG23  THR  72          2HG2      THR  72  12.642  -3.990  -3.555
  549    H    ALA  73           H        ALA  73   8.400  -2.488  -2.038
  550    HA   ALA  73           HA       ALA  73   8.507  -0.847  -4.375
  551    HB1  ALA  73           3HB      ALA  73   6.453  -1.722  -4.913
  552    HB2  ALA  73           1HB      ALA  73   5.942  -1.853  -3.229
  553    HB3  ALA  73           2HB      ALA  73   7.107  -3.002  -3.890
  554    H    LEU  74           H        LEU  74   7.204  -0.520  -1.081
  555    HA   LEU  74           HA       LEU  74   5.775   1.903  -1.633
  556    HG   LEU  74           HG       LEU  74   4.427  -0.039   1.264
  557    HB2  LEU  74           2HB      LEU  74   6.618   0.456   0.861
  558    HB3  LEU  74           1HB      LEU  74   5.930   2.063   0.954
  559   HD11  LEU  74          1HD1      LEU  74   3.472   2.141  -0.573
  560   HD12  LEU  74          2HD1      LEU  74   3.735   2.364   1.156
  561   HD13  LEU  74          3HD1      LEU  74   2.527   1.212   0.590
  562   HD21  LEU  74          3HD2      LEU  74   3.500  -1.008  -0.645
  563   HD22  LEU  74          1HD2      LEU  74   5.230  -0.963  -0.975
  564   HD23  LEU  74          2HD2      LEU  74   4.160   0.232  -1.709
  565    H    LYS  75           H        LYS  75   8.999   1.019  -0.628
  566    HA   LYS  75           HA       LYS  75   9.723   3.744   0.069
  567    HB2  LYS  75           2HB      LYS  75  11.760   2.907   0.822
  568    HB3  LYS  75           1HB      LYS  75  10.640   1.595   1.149
  569    HG2  LYS  75           2HG      LYS  75  11.400   0.658  -1.121
  570    HG3  LYS  75           1HG      LYS  75  12.747   1.786  -0.969
  571    HD2  LYS  75           2HD      LYS  75  12.000  -0.344   1.037
  572    HD3  LYS  75           1HD      LYS  75  13.321  -0.449  -0.126
  573    HE2  LYS  75           2HE      LYS  75  13.098   1.707   1.968
  574    HE3  LYS  75           1HE      LYS  75  13.998   0.209   2.197
  575    HZ1  LYS  75           3HZ      LYS  75  14.539   2.346   0.212
  576    HZ2  LYS  75           1HZ      LYS  75  15.299   0.834   0.179
  577    HZ3  LYS  75           2HZ      LYS  75  15.523   1.864   1.501
  578    H    ASN  76           H        ASN  76   9.749   1.806  -2.784
  579    HA   ASN  76           HA       ASN  76  11.831   3.310  -4.109
  580    HB2  ASN  76           2HB      ASN  76  11.353   0.875  -4.553
  581    HB3  ASN  76           1HB      ASN  76   9.861   1.374  -5.343
  582   HD21  ASN  76          1HD2      ASN  76   9.976   1.597  -7.460
  583   HD22  ASN  76          2HD2      ASN  76  11.406   1.932  -8.370
  584    H    THR  77           H        THR  77  10.438   5.314  -3.433
  585    HA   THR  77           HA       THR  77   8.688   5.989  -5.708
  586    HB   THR  77           HB       THR  77   7.522   7.566  -4.152
  587    HG1  THR  77           1HG      THR  77   7.998   7.603  -2.066
  588   HG21  THR  77          3HG2      THR  77   6.674   5.245  -4.621
  589   HG22  THR  77          1HG2      THR  77   6.118   5.987  -3.121
  590   HG23  THR  77          2HG2      THR  77   7.392   4.767  -3.081
  591    H    SER  78           H        SER  78   9.291   7.647  -6.916
  592    HA   SER  78           HA       SER  78  11.439   9.405  -5.933
  593    HG   SER  78           HG       SER  78  12.953   7.864  -7.659
  594    HB2  SER  78           2HB      SER  78  10.624   8.917  -8.812
  595    HB3  SER  78           1HB      SER  78  12.068   9.753  -8.243
  596    H    ASP  79           H        ASP  79  10.769  11.202  -8.342
  597    HA   ASP  79           HA       ASP  79   9.452  13.227  -7.061
  598    HB2  ASP  79           2HB      ASP  79   9.564  12.553  -9.999
  599    HB3  ASP  79           1HB      ASP  79   8.787  14.018  -9.410
  600    H    PHE  80           H        PHE  80   7.925  10.789  -9.194
  601    HA   PHE  80           HA       PHE  80   5.365  11.416  -7.877
  602    HD1  PHE  80           1HD      PHE  80   5.332  13.827  -9.952
  603    HD2  PHE  80           2HD      PHE  80   2.613  10.551  -9.864
  604    HE1  PHE  80           1HE      PHE  80   3.452  15.399  -9.797
  605    HE2  PHE  80           2HE      PHE  80   0.724  12.126  -9.707
  606    HZ   PHE  80           HZ       PHE  80   1.147  14.555  -9.667
  607    HB2  PHE  80           2HB      PHE  80   5.998  11.561 -10.652
  608    HB3  PHE  80           1HB      PHE  80   4.894  10.207 -10.423
  609    H    VAL  81           H        VAL  81   3.802   9.542  -7.880
  610    HA   VAL  81           HA       VAL  81   5.119   6.934  -8.048
  611    HB   VAL  81           HB       VAL  81   5.376   7.629  -5.705
  612   HG11  VAL  81          1HG1      VAL  81   3.401   9.128  -5.624
  613   HG12  VAL  81          2HG1      VAL  81   3.486   8.011  -4.262
  614   HG13  VAL  81          3HG1      VAL  81   2.363   7.702  -5.586
  615   HG21  VAL  81          3HG2      VAL  81   3.290   5.467  -5.963
  616   HG22  VAL  81          1HG2      VAL  81   4.479   5.651  -4.674
  617   HG23  VAL  81          2HG2      VAL  81   5.005   5.247  -6.308
  618    H    TYR  82           H        TYR  82   3.690   5.182  -8.365
  619    HA   TYR  82           HA       TYR  82   0.872   5.908  -8.810
  620    HD1  TYR  82           1HD      TYR  82   0.351   2.554 -10.260
  621    HD2  TYR  82           2HD      TYR  82   0.317   6.386 -12.099
  622    HE1  TYR  82           1HE      TYR  82  -1.759   1.995 -11.369
  623    HE2  TYR  82           2HE      TYR  82  -1.801   5.839 -13.213
  624    HH   TYR  82           HH       TYR  82  -2.918   3.094 -13.797
  625    HB2  TYR  82           2HB      TYR  82   2.224   5.681 -10.938
  626    HB3  TYR  82           1HB      TYR  82   2.432   3.983 -10.527
  627    H    LEU  83           H        LEU  83   0.075   5.010  -7.016
  628    HA   LEU  83           HA       LEU  83   0.810   2.307  -6.232
  629    HG   LEU  83           HG       LEU  83  -0.346   1.545  -4.206
  630    HB2  LEU  83           2HB      LEU  83   0.573   4.241  -4.623
  631    HB3  LEU  83           1HB      LEU  83  -1.156   4.157  -4.895
  632   HD11  LEU  83          1HD1      LEU  83   1.707   2.319  -3.284
  633   HD12  LEU  83          2HD1      LEU  83   0.614   2.007  -1.936
  634   HD13  LEU  83          3HD1      LEU  83   0.907   3.661  -2.469
  635   HD21  LEU  83          3HD2      LEU  83  -2.487   2.816  -3.750
  636   HD22  LEU  83          1HD2      LEU  83  -1.644   3.562  -2.393
  637   HD23  LEU  83          2HD2      LEU  83  -1.879   1.814  -2.432
  638    H    LYS  84           H        LYS  84  -0.491   0.542  -6.279
  639    HA   LYS  84           HA       LYS  84  -3.152   0.844  -7.503
  640    HB2  LYS  84           2HB      LYS  84  -1.060  -1.267  -7.927
  641    HB3  LYS  84           1HB      LYS  84  -2.753  -1.586  -8.261
  642    HG2  LYS  84           2HG      LYS  84  -2.439   0.714  -9.621
  643    HG3  LYS  84           1HG      LYS  84  -0.806   0.054  -9.738
  644    HD2  LYS  84           2HD      LYS  84  -2.071  -0.699 -11.636
  645    HD3  LYS  84           1HD      LYS  84  -1.790  -2.076 -10.569
  646    HE2  LYS  84           2HE      LYS  84  -3.976  -2.376 -10.213
  647    HE3  LYS  84           1HE      LYS  84  -4.257  -0.656  -9.955
  648    HZ1  LYS  84           3HZ      LYS  84  -4.189  -2.115 -12.534
  649    HZ2  LYS  84           1HZ      LYS  84  -4.141  -0.425 -12.439
  650    HZ3  LYS  84           2HZ      LYS  84  -5.485  -1.268 -11.853
  651    H    VAL  85           H        VAL  85  -4.740   0.417  -6.119
  652    HA   VAL  85           HA       VAL  85  -4.173  -1.376  -3.864
  653    HB   VAL  85           HB       VAL  85  -6.401   0.652  -4.187
  654   HG11  VAL  85          1HG1      VAL  85  -7.169   0.129  -2.094
  655   HG12  VAL  85          2HG1      VAL  85  -5.609  -0.498  -1.556
  656   HG13  VAL  85          3HG1      VAL  85  -6.625  -1.461  -2.627
  657   HG21  VAL  85          3HG2      VAL  85  -4.455   1.921  -3.969
  658   HG22  VAL  85          1HG2      VAL  85  -3.733   0.788  -2.826
  659   HG23  VAL  85          2HG2      VAL  85  -5.078   1.810  -2.322
  660    H    ALA  86           H        ALA  86  -5.410  -3.156  -3.460
  661    HA   ALA  86           HA       ALA  86  -7.043  -4.142  -5.643
  662    HB1  ALA  86           3HB      ALA  86  -7.190  -6.185  -4.078
  663    HB2  ALA  86           1HB      ALA  86  -5.957  -5.355  -3.128
  664    HB3  ALA  86           2HB      ALA  86  -5.631  -5.792  -4.804
  665    H    LYS  87           H        LYS  87  -9.226  -4.448  -5.631
  666    HA   LYS  87           HA       LYS  87 -10.682  -3.380  -3.307
  667    HB2  LYS  87           2HB      LYS  87 -10.839  -2.651  -5.976
  668    HB3  LYS  87           1HB      LYS  87 -12.241  -3.689  -5.755
  669    HG2  LYS  87           2HG      LYS  87 -13.084  -1.605  -5.258
  670    HG3  LYS  87           1HG      LYS  87 -12.685  -2.237  -3.659
  671    HD2  LYS  87           2HD      LYS  87 -10.341  -1.033  -4.426
  672    HD3  LYS  87           1HD      LYS  87 -11.562   0.036  -5.116
  673    HE2  LYS  87           2HE      LYS  87 -11.681  -0.892  -2.261
  674    HE3  LYS  87           1HE      LYS  87 -10.763   0.535  -2.741
  675    HZ1  LYS  87           3HZ      LYS  87 -13.684   0.103  -3.044
  676    HZ2  LYS  87           1HZ      LYS  87 -12.852   1.411  -3.722
  677    HZ3  LYS  87           2HZ      LYS  87 -12.915   1.228  -2.042
  678    HA   PRO  88           HA       PRO  88 -11.886  -7.716  -2.870
  679    HB2  PRO  88           2HB      PRO  88 -12.998  -7.439  -0.415
  680    HB3  PRO  88           1HB      PRO  88 -11.252  -7.542  -0.662
  681    HG2  PRO  88           2HG      PRO  88 -12.964  -5.122  -0.241
  682    HG3  PRO  88           1HG      PRO  88 -11.390  -5.517   0.475
  683    HD2  PRO  88           2HD      PRO  88 -11.658  -3.818  -1.617
  684    HD3  PRO  88           1HD      PRO  88 -10.229  -4.847  -1.398
  685    H    THR  89           H        THR  89 -13.793  -8.777  -3.261
  686    HA   THR  89           HA       THR  89 -16.310  -7.307  -3.007
  687    HB   THR  89           HB       THR  89 -15.505  -8.739  -5.550
  688    HG1  THR  89           1HG      THR  89 -15.693  -5.968  -4.971
  689   HG21  THR  89          3HG2      THR  89 -17.907  -7.014  -4.997
  690   HG22  THR  89          1HG2      THR  89 -17.921  -8.771  -5.146
  691   HG23  THR  89          2HG2      THR  89 -17.486  -7.771  -6.532
  692    H    GLY  90           H        GLY  90 -15.265 -10.418  -4.447
  693    HA2  GLY  90           2HA      GLY  90 -15.783 -12.251  -2.591
  694    HA3  GLY  90           1HA      GLY  90 -17.418 -11.767  -3.015
  695    H    SER  91           H        SER  91 -14.651 -13.594  -3.931
  696    HA   SER  91           HA       SER  91 -15.463 -14.113  -6.633
  697    HG   SER  91           HG       SER  91 -13.412 -16.541  -4.534
  698    HB2  SER  91           2HB      SER  91 -13.678 -15.877  -6.545
  699    HB3  SER  91           1HB      SER  91 -13.116 -14.265  -6.108
  700    H    HIS  92           H        HIS  92 -15.755 -15.824  -3.544
  701    HA   HIS  92           HA       HIS  92 -16.822 -18.226  -4.569
  702    HD1  HIS  92           1HD      HIS  92 -15.314 -15.860  -1.258
  703    HD2  HIS  92           2HD      HIS  92 -19.355 -16.800  -1.046
  704    HE1  HIS  92           1HE      HIS  92 -16.307 -14.197   0.345
  705    HE2  HIS  92           2HE      HIS  92 -18.776 -14.693   0.336
  706    HB2  HIS  92           2HB      HIS  92 -17.591 -18.636  -2.250
  707    HB3  HIS  92           1HB      HIS  92 -15.908 -18.125  -2.320
  708    HA   ARG 301           HA       ARG 301   2.699 -11.324  10.279
  709    HE   ARG 301           HE       ARG 301  -1.981 -10.160  12.537
  710    H1   ARG 301           1HT      ARG 301   4.037 -12.741  11.474
  711    H2   ARG 301           2HT      ARG 301   2.440 -13.343  11.661
  712    H3   ARG 301           3HT      ARG 301   3.185 -12.467  12.938
  713    HB2  ARG 301           2HB      ARG 301   0.696 -10.256  11.346
  714    HB3  ARG 301           1HB      ARG 301   0.547 -11.988  11.092
  715    HG2  ARG 301           2HG      ARG 301   1.278 -12.242  13.521
  716    HG3  ARG 301           1HG      ARG 301   0.975 -10.509  13.666
  717    HD2  ARG 301           2HD      ARG 301  -1.118 -12.292  12.498
  718    HD3  ARG 301           1HD      ARG 301  -0.904 -12.229  14.246
  719   HH11  ARG 301          1HH1      ARG 301  -0.618 -10.910  15.676
  720   HH12  ARG 301          2HH1      ARG 301  -1.318  -9.526  16.445
  721   HH21  ARG 301          1HH2      ARG 301  -2.898  -8.339  13.557
  722   HH22  ARG 301          2HH2      ARG 301  -2.611  -8.067  15.244
  723    H    ARG 302           H        ARG 302   3.744  -9.459  10.074
  724    HA   ARG 302           HA       ARG 302   4.196  -7.772  12.413
  725    HE   ARG 302           HE       ARG 302   8.089 -10.718  11.599
  726    HB2  ARG 302           2HB      ARG 302   6.519  -7.582  12.150
  727    HB3  ARG 302           1HB      ARG 302   6.206  -9.303  12.000
  728    HG2  ARG 302           2HG      ARG 302   6.082  -8.107   9.410
  729    HG3  ARG 302           1HG      ARG 302   7.573  -7.613  10.210
  730    HD2  ARG 302           2HD      ARG 302   6.606 -10.450   9.867
  731    HD3  ARG 302           1HD      ARG 302   7.871  -9.671   8.918
  732   HH11  ARG 302          1HH1      ARG 302   9.493  -8.561   9.223
  733   HH12  ARG 302          2HH1      ARG 302  11.066  -8.592   9.945
  734   HH21  ARG 302          1HH2      ARG 302  10.162 -10.753  12.545
  735   HH22  ARG 302          2HH2      ARG 302  11.447  -9.836  11.831
  736    H    GLU 303           H        GLU 303   4.801  -5.568  11.869
  737    HA   GLU 303           HA       GLU 303   4.190  -4.803   9.096
  738    HB2  GLU 303           2HB      GLU 303   2.978  -3.678  11.618
  739    HB3  GLU 303           1HB      GLU 303   2.946  -2.816  10.087
  740    HG2  GLU 303           2HG      GLU 303   1.013  -3.854   9.737
  741    HG3  GLU 303           1HG      GLU 303   1.992  -5.272   9.382
  742    H    THR 304           H        THR 304   5.283  -3.025   8.303
  743    HA   THR 304           HA       THR 304   7.138  -1.673  10.127
  744    HB   THR 304           HB       THR 304   7.819  -3.446   7.935
  745    HG1  THR 304           1HG      THR 304   8.968  -3.815   9.673
  746   HG21  THR 304          3HG2      THR 304   8.122  -1.410   6.634
  747   HG22  THR 304          1HG2      THR 304   9.662  -2.186   7.001
  748   HG23  THR 304          2HG2      THR 304   9.158  -0.754   7.901
  749    H    GLN 305           H        GLN 305   7.672   0.455   9.614
  750    HA   GLN 305           HA       GLN 305   5.694   1.871   8.105
  751    HB2  GLN 305           2HB      GLN 305   8.097   2.667   9.705
  752    HB3  GLN 305           1HB      GLN 305   7.327   3.842   8.646
  753    HG2  GLN 305           2HG      GLN 305   5.367   3.865   9.875
  754    HG3  GLN 305           1HG      GLN 305   5.700   2.303  10.622
  755   HE21  GLN 305          1HE2      GLN 305   6.525   5.708  10.609
  756   HE22  GLN 305          2HE2      GLN 305   7.217   5.741  12.191
  757    H    VAL 306           H        VAL 306   6.058   3.271   6.323
  758    HA   VAL 306           HA       VAL 306   8.515   2.895   4.792
  759    HB   VAL 306           HB       VAL 306   7.158   2.451   2.709
  760   HG11  VAL 306          1HG1      VAL 306   8.460   0.734   3.985
  761   HG12  VAL 306          2HG1      VAL 306   7.111   0.090   3.050
  762   HG13  VAL 306          3HG1      VAL 306   6.959   0.287   4.797
  763   HG21  VAL 306          3HG2      VAL 306   5.006   1.864   4.744
  764   HG22  VAL 306          1HG2      VAL 306   4.936   1.420   3.038
  765   HG23  VAL 306          2HG2      VAL 306   4.970   3.119   3.506
  Start of MODEL   22
    1    HA   MET   1           HA       MET   1  -8.733   1.344  -8.656
    2    H1   MET   1           1HT      MET   1  -9.201  -0.814  -7.776
    3    H2   MET   1           2HT      MET   1  -7.699  -0.821  -6.945
    4    H3   MET   1           3HT      MET   1  -7.734  -0.804  -8.660
    5    HB2  MET   1           2HB      MET   1  -9.480   0.635  -6.088
    6    HB3  MET   1           1HB      MET   1  -8.240   1.851  -5.814
    7    HG2  MET   1           2HG      MET   1 -10.444   2.376  -7.757
    8    HG3  MET   1           1HG      MET   1 -10.723   2.555  -6.026
    9    HE1  MET   1           3HE      MET   1 -10.937   5.003  -5.398
   10    HE2  MET   1           1HE      MET   1 -11.445   5.047  -7.086
   11    HE3  MET   1           2HE      MET   1 -10.345   6.277  -6.464
   12    H    GLU   2           H        GLU   2  -7.333   3.002  -9.055
   13    HA   GLU   2           HA       GLU   2  -4.547   2.598  -8.195
   14    HB2  GLU   2           2HB      GLU   2  -3.860   3.809 -10.154
   15    HB3  GLU   2           1HB      GLU   2  -4.994   2.561 -10.645
   16    HG2  GLU   2           2HG      GLU   2  -6.054   5.282 -10.096
   17    HG3  GLU   2           1HG      GLU   2  -5.136   5.020 -11.577
   18    H    ILE   3           H        ILE   3  -3.312   4.350  -7.443
   19    HA   ILE   3           HA       ILE   3  -4.681   6.865  -6.921
   20    HB   ILE   3           HB       ILE   3  -3.376   5.207  -4.751
   21   HG12  ILE   3          2HG1      ILE   3  -5.851   5.784  -3.826
   22   HG13  ILE   3          1HG1      ILE   3  -6.189   5.698  -5.551
   23   HG21  ILE   3          1HG2      ILE   3  -2.931   7.652  -4.620
   24   HG22  ILE   3          2HG2      ILE   3  -3.819   7.001  -3.244
   25   HG23  ILE   3          3HG2      ILE   3  -4.670   7.910  -4.492
   26   HD11  ILE   3          3HD1      ILE   3  -6.546   3.532  -4.983
   27   HD12  ILE   3          1HD1      ILE   3  -5.378   3.568  -3.662
   28   HD13  ILE   3          2HD1      ILE   3  -4.820   3.446  -5.330
   29    H    LYS   4           H        LYS   4  -3.285   7.954  -8.269
   30    HA   LYS   4           HA       LYS   4  -0.403   7.711  -7.823
   31    HB2  LYS   4           2HB      LYS   4  -0.166   9.116  -9.827
   32    HB3  LYS   4           1HB      LYS   4  -1.156   7.700 -10.149
   33    HG2  LYS   4           2HG      LYS   4  -2.786   8.989 -10.900
   34    HG3  LYS   4           1HG      LYS   4  -2.874   9.818  -9.345
   35    HD2  LYS   4           2HD      LYS   4  -1.816  11.631 -10.133
   36    HD3  LYS   4           1HD      LYS   4  -0.603  10.663 -10.973
   37    HE2  LYS   4           2HE      LYS   4  -2.388  10.190 -12.710
   38    HE3  LYS   4           1HE      LYS   4  -3.344  11.451 -11.932
   39    HZ1  LYS   4           3HZ      LYS   4  -1.557  13.021 -12.367
   40    HZ2  LYS   4           1HZ      LYS   4  -2.100  12.319 -13.807
   41    HZ3  LYS   4           2HZ      LYS   4  -0.643  11.811 -13.114
   42    H    LEU   5           H        LEU   5   0.893   9.446  -7.058
   43    HA   LEU   5           HA       LEU   5  -0.382  11.968  -6.445
   44    HG   LEU   5           HG       LEU   5  -1.430  12.460  -4.620
   45    HB2  LEU   5           2HB      LEU   5   0.027   9.889  -4.468
   46    HB3  LEU   5           1HB      LEU   5   0.957  11.320  -4.069
   47   HD11  LEU   5          1HD1      LEU   5  -2.165   9.891  -4.801
   48   HD12  LEU   5          2HD1      LEU   5  -3.237  11.166  -4.221
   49   HD13  LEU   5          3HD1      LEU   5  -2.384  10.138  -3.069
   50   HD21  LEU   5          3HD2      LEU   5  -1.727  12.660  -2.246
   51   HD22  LEU   5          1HD2      LEU   5  -0.002  12.729  -2.606
   52   HD23  LEU   5          2HD2      LEU   5  -0.708  11.250  -1.955
   53    H    ILE   6           H        ILE   6   1.340  13.447  -5.340
   54    HA   ILE   6           HA       ILE   6   3.809  13.134  -6.861
   55    HB   ILE   6           HB       ILE   6   2.483  15.322  -6.757
   56   HG12  ILE   6          2HG1      ILE   6   5.346  15.666  -5.895
   57   HG13  ILE   6          1HG1      ILE   6   4.943  14.948  -7.451
   58   HG21  ILE   6          1HG2      ILE   6   2.206  15.183  -4.247
   59   HG22  ILE   6          2HG2      ILE   6   2.698  16.749  -4.892
   60   HG23  ILE   6          3HG2      ILE   6   3.889  15.697  -4.127
   61   HD11  ILE   6          3HD1      ILE   6   3.527  17.067  -7.811
   62   HD12  ILE   6          1HD1      ILE   6   5.282  17.177  -7.958
   63   HD13  ILE   6          2HD1      ILE   6   4.484  17.737  -6.489
   64    H    LYS   7           H        LYS   7   5.819  12.839  -5.918
   65    HA   LYS   7           HA       LYS   7   5.766  12.117  -3.077
   66    HB2  LYS   7           2HB      LYS   7   6.828  10.833  -5.309
   67    HB3  LYS   7           1HB      LYS   7   8.232  11.490  -4.479
   68    HG2  LYS   7           2HG      LYS   7   6.280  10.131  -2.753
   69    HG3  LYS   7           1HG      LYS   7   7.107   9.102  -3.923
   70    HD2  LYS   7           2HD      LYS   7   8.959   9.112  -2.691
   71    HD3  LYS   7           1HD      LYS   7   8.995  10.876  -2.693
   72    HE2  LYS   7           2HE      LYS   7   8.927  10.016  -0.418
   73    HE3  LYS   7           1HE      LYS   7   7.456  10.911  -0.792
   74    HZ1  LYS   7           3HZ      LYS   7   7.769   8.173  -0.041
   75    HZ2  LYS   7           1HZ      LYS   7   6.870   8.325  -1.465
   76    HZ3  LYS   7           2HZ      LYS   7   6.374   9.127  -0.065
   77    H    GLY   8           H        GLY   8   6.941  13.133  -1.567
   78    HA2  GLY   8           2HA      GLY   8   8.605  15.407  -2.454
   79    HA3  GLY   8           1HA      GLY   8   7.733  15.343  -0.930
   80    HA   PRO   9           HA       PRO   9  12.208  13.797  -0.490
   81    HB2  PRO   9           2HB      PRO   9  12.835  16.299   0.876
   82    HB3  PRO   9           1HB      PRO   9  13.628  15.562  -0.516
   83    HG2  PRO   9           2HG      PRO   9  12.163  17.832  -0.699
   84    HG3  PRO   9           1HG      PRO   9  12.298  16.665  -2.026
   85    HD2  PRO   9           2HD      PRO   9  10.076  17.038  -0.049
   86    HD3  PRO   9           1HD      PRO   9   9.988  16.736  -1.798
   87    H    LYS  10           H        LYS  10  10.835  12.468   0.959
   88    HA   LYS  10           HA       LYS  10  11.713  12.626   3.629
   89    HB2  LYS  10           2HB      LYS  10  10.056  14.448   3.769
   90    HB3  LYS  10           1HB      LYS  10   8.798  13.344   3.235
   91    HG2  LYS  10           2HG      LYS  10   9.181  11.980   5.254
   92    HG3  LYS  10           1HG      LYS  10  10.378  13.158   5.793
   93    HD2  LYS  10           2HD      LYS  10   8.717  14.869   5.968
   94    HD3  LYS  10           1HD      LYS  10   7.508  13.850   5.187
   95    HE2  LYS  10           2HE      LYS  10   7.132  12.618   7.063
   96    HE3  LYS  10           1HE      LYS  10   8.787  12.794   7.643
   97    HZ1  LYS  10           3HZ      LYS  10   7.214  13.988   9.039
   98    HZ2  LYS  10           1HZ      LYS  10   6.704  14.911   7.716
   99    HZ3  LYS  10           2HZ      LYS  10   8.286  15.062   8.294
  100    H    GLY  11           H        GLY  11   8.469  11.597   2.558
  101    HA2  GLY  11           2HA      GLY  11   9.035   8.964   1.880
  102    HA3  GLY  11           1HA      GLY  11   8.805   8.986   3.621
  103    H    LEU  12           H        LEU  12   7.064   7.443   2.699
  104    HA   LEU  12           HA       LEU  12   4.759   8.598   1.489
  105    HG   LEU  12           HG       LEU  12   6.189   6.651   0.528
  106    HB2  LEU  12           2HB      LEU  12   5.009   5.996   2.994
  107    HB3  LEU  12           1HB      LEU  12   3.682   6.455   1.944
  108   HD11  LEU  12          1HD1      LEU  12   7.064   4.534   0.661
  109   HD12  LEU  12          2HD1      LEU  12   5.575   3.838   1.299
  110   HD13  LEU  12          3HD1      LEU  12   6.606   4.821   2.337
  111   HD21  LEU  12          3HD2      LEU  12   5.034   5.375  -1.107
  112   HD22  LEU  12          1HD2      LEU  12   3.854   6.469  -0.385
  113   HD23  LEU  12          2HD2      LEU  12   3.882   4.768   0.082
  114    H    GLY  13           H        GLY  13   5.656   7.869   4.839
  115    HA2  GLY  13           2HA      GLY  13   4.869   9.030   6.711
  116    HA3  GLY  13           1HA      GLY  13   3.560   9.675   5.741
  117    H    PHE  14           H        PHE  14   4.227   6.224   5.802
  118    HA   PHE  14           HA       PHE  14   2.317   5.694   7.884
  119    HD1  PHE  14           2HD      PHE  14   2.266   2.924   4.999
  120    HD2  PHE  14           1HD      PHE  14   0.913   6.799   3.863
  121    HE1  PHE  14           2HE      PHE  14   2.643   2.359   2.638
  122    HE2  PHE  14           1HE      PHE  14   1.285   6.236   1.498
  123    HZ   PHE  14           HZ       PHE  14   2.152   4.015   0.884
  124    HB2  PHE  14           2HB      PHE  14   0.724   4.450   6.466
  125    HB3  PHE  14           1HB      PHE  14   0.765   6.163   6.075
  126    H    SER  15           H        SER  15   1.731   3.119   7.612
  127    HA   SER  15           HA       SER  15   4.283   1.748   7.126
  128    HG   SER  15           HG       SER  15   2.342   2.683   9.918
  129    HB2  SER  15           2HB      SER  15   3.377   0.215   9.063
  130    HB3  SER  15           1HB      SER  15   4.235   1.701   9.448
  131    H    ILE  16           H        ILE  16   3.880  -0.734   7.079
  132    HA   ILE  16           HA       ILE  16   1.281  -1.542   6.060
  133    HB   ILE  16           HB       ILE  16   1.869  -2.142   3.901
  134   HG12  ILE  16          2HG1      ILE  16   4.114  -3.135   4.604
  135   HG13  ILE  16          1HG1      ILE  16   3.992  -2.480   2.978
  136   HG21  ILE  16          1HG2      ILE  16   3.293   0.459   4.374
  137   HG22  ILE  16          2HG2      ILE  16   1.581   0.242   4.014
  138   HG23  ILE  16          3HG2      ILE  16   2.794  -0.153   2.797
  139   HD11  ILE  16          3HD1      ILE  16   5.555  -0.957   3.358
  140   HD12  ILE  16          1HD1      ILE  16   5.964  -1.937   4.770
  141   HD13  ILE  16          2HD1      ILE  16   4.895  -0.541   4.941
  142    H    ALA  17           H        ALA  17   1.340  -3.866   5.393
  143    HA   ALA  17           HA       ALA  17   3.436  -5.485   6.649
  144    HB1  ALA  17           3HB      ALA  17   1.150  -6.949   7.127
  145    HB2  ALA  17           1HB      ALA  17   0.650  -5.299   7.508
  146    HB3  ALA  17           2HB      ALA  17   2.039  -6.014   8.326
  147    H    GLY  18           H        GLY  18   3.211  -7.873   5.711
  148    HA2  GLY  18           2HA      GLY  18   1.574  -8.463   3.600
  149    HA3  GLY  18           1HA      GLY  18   2.827  -7.496   2.871
  150    H    GLY  19           H        GLY  19   1.862 -10.520   2.904
  151    HA2  GLY  19           2HA      GLY  19   3.266 -12.158   1.866
  152    HA3  GLY  19           1HA      GLY  19   4.629 -11.510   2.764
  153    H    VAL  20           H        VAL  20   3.843 -14.255   2.605
  154    HA   VAL  20           HA       VAL  20   2.409 -15.093   4.885
  155    HB   VAL  20           HB       VAL  20   4.570 -16.631   3.424
  156   HG11  VAL  20          1HG1      VAL  20   3.237 -18.607   4.238
  157   HG12  VAL  20          2HG1      VAL  20   2.366 -17.490   5.289
  158   HG13  VAL  20          3HG1      VAL  20   4.105 -17.715   5.486
  159   HG21  VAL  20          3HG2      VAL  20   2.525 -17.680   2.294
  160   HG22  VAL  20          1HG2      VAL  20   3.011 -16.069   1.768
  161   HG23  VAL  20          2HG2      VAL  20   1.642 -16.264   2.863
  162    H    GLY  21           H        GLY  21   3.055 -15.616   6.967
  163    HA2  GLY  21           2HA      GLY  21   4.527 -15.933   8.764
  164    HA3  GLY  21           1HA      GLY  21   5.873 -15.555   7.701
  165    H    ASN  22           H        ASN  22   4.144 -13.101   6.924
  166    HA   ASN  22           HA       ASN  22   4.453 -11.428   9.284
  167    HB2  ASN  22           2HB      ASN  22   5.475  -9.700   7.506
  168    HB3  ASN  22           1HB      ASN  22   6.500 -10.770   8.439
  169   HD21  ASN  22          1HD2      ASN  22   4.632 -10.821   5.418
  170   HD22  ASN  22          2HD2      ASN  22   5.848 -11.626   4.494
  171    H    GLN  23           H        GLN  23   2.211 -12.525   7.558
  172    HA   GLN  23           HA       GLN  23   1.109 -10.544   5.933
  173    HB2  GLN  23           2HB      GLN  23  -0.302 -12.694   7.521
  174    HB3  GLN  23           1HB      GLN  23  -1.016 -11.769   6.210
  175    HG2  GLN  23           2HG      GLN  23   0.483 -12.752   4.622
  176    HG3  GLN  23           1HG      GLN  23   1.377 -13.563   5.908
  177   HE21  GLN  23          1HE2      GLN  23  -2.047 -13.238   4.974
  178   HE22  GLN  23          2HE2      GLN  23  -2.399 -14.926   5.060
  179    H    HIS  24           H        HIS  24  -0.631  -9.149   6.213
  180    HA   HIS  24           HA       HIS  24  -0.764  -7.888   8.833
  181    HD1  HIS  24           1HD      HIS  24  -0.418  -5.148   9.045
  182    HD2  HIS  24           2HD      HIS  24  -4.103  -5.485   7.165
  183    HE1  HIS  24           1HE      HIS  24  -1.824  -3.327  10.004
  184    HE2  HIS  24           2HE      HIS  24  -4.093  -3.610   8.953
  185    HB2  HIS  24           2HB      HIS  24  -0.503  -6.543   6.721
  186    HB3  HIS  24           1HB      HIS  24  -2.116  -7.051   6.259
  187    H    ILE  25           H        ILE  25  -2.725  -9.827   6.704
  188    HA   ILE  25           HA       ILE  25  -4.756 -10.072   8.781
  189    HB   ILE  25           HB       ILE  25  -5.641  -9.537   5.951
  190   HG12  ILE  25          2HG1      ILE  25  -5.456  -7.526   8.208
  191   HG13  ILE  25          1HG1      ILE  25  -4.442  -7.541   6.769
  192   HG21  ILE  25          1HG2      ILE  25  -6.935 -10.081   8.531
  193   HG22  ILE  25          2HG2      ILE  25  -7.499 -10.386   6.888
  194   HG23  ILE  25          3HG2      ILE  25  -7.658  -8.776   7.591
  195   HD11  ILE  25          3HD1      ILE  25  -6.011  -5.942   6.258
  196   HD12  ILE  25          1HD1      ILE  25  -7.321  -6.819   7.047
  197   HD13  ILE  25          2HD1      ILE  25  -6.693  -7.378   5.496
  198    HA   PRO  26           HA       PRO  26  -4.116 -14.366   7.709
  199    HB2  PRO  26           2HB      PRO  26  -6.874 -14.550   8.842
  200    HB3  PRO  26           1HB      PRO  26  -5.440 -15.519   9.204
  201    HG2  PRO  26           2HG      PRO  26  -6.251 -13.633  10.892
  202    HG3  PRO  26           1HG      PRO  26  -4.523 -13.889  10.580
  203    HD2  PRO  26           2HD      PRO  26  -6.329 -11.725   9.602
  204    HD3  PRO  26           1HD      PRO  26  -4.612 -11.651  10.042
  205    H    GLY  27           H        GLY  27  -4.435 -15.340   5.810
  206    HA2  GLY  27           2HA      GLY  27  -5.831 -16.318   4.142
  207    HA3  GLY  27           1HA      GLY  27  -7.047 -15.097   4.484
  208    H    ASP  28           H        ASP  28  -5.870 -12.745   4.224
  209    HA   ASP  28           HA       ASP  28  -5.138 -12.687   1.404
  210    HB2  ASP  28           2HB      ASP  28  -6.837 -11.123   2.827
  211    HB3  ASP  28           1HB      ASP  28  -5.376 -10.139   2.887
  212    H    ASN  29           H        ASN  29  -3.047 -12.987   1.021
  213    HA   ASN  29           HA       ASN  29  -1.014 -12.034   2.857
  214    HB2  ASN  29           2HB      ASN  29  -0.421 -13.256   0.181
  215    HB3  ASN  29           1HB      ASN  29   0.532 -13.315   1.661
  216   HD21  ASN  29          1HD2      ASN  29  -2.108 -14.696  -0.112
  217   HD22  ASN  29          2HD2      ASN  29  -2.344 -16.068   0.911
  218    H    SER  30           H        SER  30  -2.718 -10.156   1.072
  219    HA   SER  30           HA       SER  30  -0.678  -8.895  -0.569
  220    HG   SER  30           HG       SER  30  -2.464  -9.610  -2.042
  221    HB2  SER  30           2HB      SER  30  -3.501  -7.954   0.009
  222    HB3  SER  30           1HB      SER  30  -2.431  -7.356  -1.258
  223    H    ILE  31           H        ILE  31  -0.102  -6.602  -0.267
  224    HA   ILE  31           HA       ILE  31   0.550  -6.107   2.451
  225    HB   ILE  31           HB       ILE  31   0.877  -4.102   0.230
  226   HG12  ILE  31          2HG1      ILE  31   1.962  -5.785  -0.854
  227   HG13  ILE  31          1HG1      ILE  31   3.270  -5.261   0.192
  228   HG21  ILE  31          1HG2      ILE  31   2.772  -4.604   2.478
  229   HG22  ILE  31          2HG2      ILE  31   1.347  -3.591   2.700
  230   HG23  ILE  31          3HG2      ILE  31   2.559  -3.155   1.496
  231   HD11  ILE  31          3HD1      ILE  31   1.742  -7.243   1.557
  232   HD12  ILE  31          1HD1      ILE  31   3.423  -7.301   1.034
  233   HD13  ILE  31          2HD1      ILE  31   2.143  -7.829  -0.054
  234    H    TYR  32           H        TYR  32  -0.466  -4.963   3.963
  235    HA   TYR  32           HA       TYR  32  -2.594  -3.083   3.172
  236    HD1  TYR  32           2HD      TYR  32  -2.507  -6.630   3.464
  237    HD2  TYR  32           1HD      TYR  32  -5.742  -4.058   4.432
  238    HE1  TYR  32           2HE      TYR  32  -4.020  -8.085   2.187
  239    HE2  TYR  32           1HE      TYR  32  -7.279  -5.499   3.176
  240    HH   TYR  32           HH       TYR  32  -6.452  -7.583   0.960
  241    HB2  TYR  32           2HB      TYR  32  -2.526  -5.003   5.501
  242    HB3  TYR  32           1HB      TYR  32  -3.667  -3.670   5.393
  243    H    VAL  33           H        VAL  33  -2.835  -1.223   4.484
  244    HA   VAL  33           HA       VAL  33  -0.388  -0.297   5.694
  245    HB   VAL  33           HB       VAL  33  -3.043   1.076   5.248
  246   HG11  VAL  33          1HG1      VAL  33  -1.935   3.154   5.914
  247   HG12  VAL  33          2HG1      VAL  33  -0.489   2.247   6.351
  248   HG13  VAL  33          3HG1      VAL  33  -1.989   2.001   7.245
  249   HG21  VAL  33          3HG2      VAL  33  -2.106   0.998   3.168
  250   HG22  VAL  33          1HG2      VAL  33  -0.457   0.947   3.791
  251   HG23  VAL  33          2HG2      VAL  33  -1.345   2.469   3.773
  252    H    THR  34           H        THR  34   0.088  -0.613   7.746
  253    HA   THR  34           HA       THR  34  -1.971  -1.406   9.634
  254    HB   THR  34           HB       THR  34   0.040  -2.734   9.563
  255    HG1  THR  34           1HG      THR  34  -0.631  -2.801  11.589
  256   HG21  THR  34          3HG2      THR  34   1.419  -0.350   9.232
  257   HG22  THR  34          1HG2      THR  34   2.105  -1.963   9.419
  258   HG23  THR  34          2HG2      THR  34   1.887  -0.930  10.830
  259    H    LYS  35           H        LYS  35  -0.091   1.467   9.002
  260    HA   LYS  35           HA       LYS  35  -1.553   2.920  11.003
  261    HB2  LYS  35           2HB      LYS  35   1.347   2.274  11.457
  262    HB3  LYS  35           1HB      LYS  35   0.660   3.764  12.075
  263    HG2  LYS  35           2HG      LYS  35  -1.132   1.888  12.940
  264    HG3  LYS  35           1HG      LYS  35   0.409   1.031  13.038
  265    HD2  LYS  35           2HD      LYS  35   1.327   2.971  14.307
  266    HD3  LYS  35           1HD      LYS  35  -0.292   3.674  14.315
  267    HE2  LYS  35           2HE      LYS  35  -0.651   1.067  15.218
  268    HE3  LYS  35           1HE      LYS  35   0.837   1.604  15.995
  269    HZ1  LYS  35           3HZ      LYS  35  -1.796   2.975  16.097
  270    HZ2  LYS  35           1HZ      LYS  35  -0.368   3.579  16.777
  271    HZ3  LYS  35           2HZ      LYS  35  -1.045   2.146  17.366
  272    H    ILE  36           H        ILE  36  -1.874   4.934  10.254
  273    HA   ILE  36           HA       ILE  36  -0.016   5.937   8.208
  274    HB   ILE  36           HB       ILE  36  -2.895   6.696   8.715
  275   HG12  ILE  36          2HG1      ILE  36  -1.483   4.974   6.704
  276   HG13  ILE  36          1HG1      ILE  36  -2.966   4.652   7.595
  277   HG21  ILE  36          1HG2      ILE  36  -0.999   7.716   6.598
  278   HG22  ILE  36          2HG2      ILE  36  -1.565   8.629   7.996
  279   HG23  ILE  36          3HG2      ILE  36  -2.707   8.128   6.751
  280   HD11  ILE  36          3HD1      ILE  36  -2.598   6.453   5.222
  281   HD12  ILE  36          1HD1      ILE  36  -4.062   6.424   6.202
  282   HD13  ILE  36          2HD1      ILE  36  -3.554   4.976   5.328
  283    H    ILE  37           H        ILE  37   1.194   7.681   8.613
  284    HA   ILE  37           HA       ILE  37   1.027   8.982  11.191
  285    HB   ILE  37           HB       ILE  37   2.974   9.102   8.900
  286   HG12  ILE  37          2HG1      ILE  37   4.546   8.512  10.823
  287   HG13  ILE  37          1HG1      ILE  37   3.098   8.252  11.788
  288   HG21  ILE  37          1HG2      ILE  37   4.320  10.691  10.317
  289   HG22  ILE  37          2HG2      ILE  37   2.841  10.987  11.234
  290   HG23  ILE  37          3HG2      ILE  37   2.906  11.373   9.514
  291   HD11  ILE  37          3HD1      ILE  37   4.179   6.227  10.693
  292   HD12  ILE  37          1HD1      ILE  37   3.525   6.846   9.177
  293   HD13  ILE  37          2HD1      ILE  37   2.437   6.420  10.498
  294    H    GLU  38           H        GLU  38   0.775  11.234  11.518
  295    HA   GLU  38           HA       GLU  38  -1.251  12.467  10.025
  296    HB2  GLU  38           2HB      GLU  38   0.643  13.399  12.145
  297    HB3  GLU  38           1HB      GLU  38  -0.315  14.592  11.278
  298    HG2  GLU  38           2HG      GLU  38  -1.801  14.211  12.908
  299    HG3  GLU  38           1HG      GLU  38  -2.235  12.816  11.920
  300    H    GLY  39           H        GLY  39  -1.234  14.284   8.646
  301    HA2  GLY  39           2HA      GLY  39  -0.527  15.465   6.817
  302    HA3  GLY  39           1HA      GLY  39   0.955  15.698   7.723
  303    H    GLY  40           H        GLY  40   0.144  12.418   6.949
  304    HA2  GLY  40           2HA      GLY  40   2.472  12.247   5.231
  305    HA3  GLY  40           1HA      GLY  40   1.487  10.907   5.795
  306    H    ALA  41           H        ALA  41   2.325  10.853   3.234
  307    HA   ALA  41           HA       ALA  41   0.890  12.076   1.238
  308    HB1  ALA  41           3HB      ALA  41   1.778   9.193   1.253
  309    HB2  ALA  41           1HB      ALA  41   2.796  10.577   0.851
  310    HB3  ALA  41           2HB      ALA  41   1.418  10.170  -0.171
  311    H    ALA  42           H        ALA  42   0.030   8.984   2.816
  312    HA   ALA  42           HA       ALA  42  -2.461   8.727   1.475
  313    HB1  ALA  42           3HB      ALA  42  -1.457   6.750   2.311
  314    HB2  ALA  42           1HB      ALA  42  -2.928   7.006   3.251
  315    HB3  ALA  42           2HB      ALA  42  -1.357   7.409   3.944
  316    H    HIS  43           H        HIS  43  -1.653   9.668   4.816
  317    HA   HIS  43           HA       HIS  43  -4.176  10.181   5.796
  318    HD1  HIS  43           1HD      HIS  43  -2.880  13.833   7.232
  319    HD2  HIS  43           2HD      HIS  43  -4.102  10.328   9.097
  320    HE1  HIS  43           1HE      HIS  43  -4.228  14.569   9.221
  321    HE2  HIS  43           2HE      HIS  43  -4.901  12.432  10.375
  322    HB2  HIS  43           2HB      HIS  43  -2.104  10.189   7.140
  323    HB3  HIS  43           1HB      HIS  43  -1.651  11.724   6.413
  324    H    LYS  44           H        LYS  44  -2.093  12.366   3.930
  325    HA   LYS  44           HA       LYS  44  -3.907  14.583   4.121
  326    HB2  LYS  44           2HB      LYS  44  -1.461  14.097   2.423
  327    HB3  LYS  44           1HB      LYS  44  -2.390  15.588   2.367
  328    HG2  LYS  44           2HG      LYS  44  -1.488  14.687   5.034
  329    HG3  LYS  44           1HG      LYS  44  -0.246  15.257   3.919
  330    HD2  LYS  44           2HD      LYS  44  -2.162  17.172   3.626
  331    HD3  LYS  44           1HD      LYS  44  -2.351  16.744   5.326
  332    HE2  LYS  44           2HE      LYS  44  -0.223  17.441   5.877
  333    HE3  LYS  44           1HE      LYS  44   0.383  17.231   4.236
  334    HZ1  LYS  44           3HZ      LYS  44  -0.890  19.172   3.558
  335    HZ2  LYS  44           1HZ      LYS  44   0.180  19.566   4.809
  336    HZ3  LYS  44           2HZ      LYS  44  -1.468  19.374   5.135
  337    H    ASP  45           H        ASP  45  -3.191  12.114   1.690
  338    HA   ASP  45           HA       ASP  45  -4.738  13.218  -0.396
  339    HB2  ASP  45           2HB      ASP  45  -3.014  11.451  -0.703
  340    HB3  ASP  45           1HB      ASP  45  -4.084  10.303   0.091
  341    H    GLY  46           H        GLY  46  -5.511  10.552   1.858
  342    HA2  GLY  46           2HA      GLY  46  -7.625  10.411   2.980
  343    HA3  GLY  46           1HA      GLY  46  -8.344  11.330   1.670
  344    H    LYS  47           H        LYS  47  -7.075   9.705  -0.429
  345    HA   LYS  47           HA       LYS  47  -9.094   7.800  -0.802
  346    HB2  LYS  47           2HB      LYS  47  -6.498   8.394  -2.127
  347    HB3  LYS  47           1HB      LYS  47  -7.247   6.843  -2.470
  348    HG2  LYS  47           2HG      LYS  47  -8.494   7.841  -3.997
  349    HG3  LYS  47           1HG      LYS  47  -9.292   8.741  -2.706
  350    HD2  LYS  47           2HD      LYS  47  -7.980  10.617  -3.023
  351    HD3  LYS  47           1HD      LYS  47  -6.668   9.700  -3.768
  352    HE2  LYS  47           2HE      LYS  47  -7.601  10.841  -5.564
  353    HE3  LYS  47           1HE      LYS  47  -8.350   9.249  -5.666
  354    HZ1  LYS  47           3HZ      LYS  47  -9.542  11.799  -4.785
  355    HZ2  LYS  47           1HZ      LYS  47 -10.207  10.327  -4.280
  356    HZ3  LYS  47           2HZ      LYS  47 -10.118  10.694  -5.927
  357    H    LEU  48           H        LEU  48  -5.756   7.409   0.395
  358    HA   LEU  48           HA       LEU  48  -6.206   4.571   0.855
  359    HG   LEU  48           HG       LEU  48  -4.378   3.269   0.792
  360    HB2  LEU  48           2HB      LEU  48  -4.024   5.778   0.010
  361    HB3  LEU  48           1HB      LEU  48  -3.743   6.024   1.722
  362   HD11  LEU  48          1HD1      LEU  48  -2.708   4.123  -0.821
  363   HD12  LEU  48          2HD1      LEU  48  -2.086   2.826   0.200
  364   HD13  LEU  48          3HD1      LEU  48  -1.639   4.499   0.532
  365   HD21  LEU  48          3HD2      LEU  48  -3.040   2.630   2.629
  366   HD22  LEU  48          1HD2      LEU  48  -4.090   3.931   3.186
  367   HD23  LEU  48          2HD2      LEU  48  -2.394   4.262   2.819
  368    H    GLN  49           H        GLN  49  -6.837   3.749   2.764
  369    HA   GLN  49           HA       GLN  49  -6.331   5.197   5.239
  370    HB2  GLN  49           2HB      GLN  49  -8.636   5.020   5.954
  371    HB3  GLN  49           1HB      GLN  49  -8.557   5.932   4.460
  372    HG2  GLN  49           2HG      GLN  49  -9.163   2.996   4.480
  373    HG3  GLN  49           1HG      GLN  49 -10.420   4.203   4.733
  374   HE21  GLN  49          1HE2      GLN  49  -8.468   2.576   2.457
  375   HE22  GLN  49          2HE2      GLN  49  -9.034   3.390   1.042
  376    H    ILE  50           H        ILE  50  -6.266   3.831   7.089
  377    HA   ILE  50           HA       ILE  50  -5.203   1.360   6.949
  378    HB   ILE  50           HB       ILE  50  -7.255   2.173   9.020
  379   HG12  ILE  50          2HG1      ILE  50  -4.631   2.351  10.038
  380   HG13  ILE  50          1HG1      ILE  50  -4.586   3.121   8.457
  381   HG21  ILE  50          1HG2      ILE  50  -6.928  -0.159   9.225
  382   HG22  ILE  50          2HG2      ILE  50  -5.921   0.584  10.468
  383   HG23  ILE  50          3HG2      ILE  50  -5.188  -0.012   8.979
  384   HD11  ILE  50          3HD1      ILE  50  -6.497   4.532   9.148
  385   HD12  ILE  50          1HD1      ILE  50  -5.050   4.770  10.125
  386   HD13  ILE  50          2HD1      ILE  50  -6.394   3.818  10.757
  387    H    GLY  51           H        GLY  51  -5.815  -0.741   6.537
  388    HA2  GLY  51           2HA      GLY  51  -7.441  -2.485   6.472
  389    HA3  GLY  51           1HA      GLY  51  -8.684  -1.281   6.194
  390    H    ASP  52           H        ASP  52  -6.537  -0.119   4.132
  391    HA   ASP  52           HA       ASP  52  -7.712  -1.473   1.907
  392    HB2  ASP  52           2HB      ASP  52  -6.539   0.146   0.514
  393    HB3  ASP  52           1HB      ASP  52  -7.338   0.969   1.841
  394    H    LYS  53           H        LYS  53  -6.630  -2.616   0.278
  395    HA   LYS  53           HA       LYS  53  -4.098  -3.824   1.161
  396    HB2  LYS  53           2HB      LYS  53  -4.674  -5.666  -0.435
  397    HB3  LYS  53           1HB      LYS  53  -5.788  -5.496   0.909
  398    HG2  LYS  53           2HG      LYS  53  -6.597  -3.965  -1.422
  399    HG3  LYS  53           1HG      LYS  53  -6.469  -5.696  -1.736
  400    HD2  LYS  53           2HD      LYS  53  -7.741  -5.616   0.698
  401    HD3  LYS  53           1HD      LYS  53  -8.416  -4.216  -0.138
  402    HE2  LYS  53           2HE      LYS  53  -9.841  -5.990  -0.701
  403    HE3  LYS  53           1HE      LYS  53  -8.803  -5.784  -2.110
  404    HZ1  LYS  53           3HZ      LYS  53  -8.473  -7.836   0.015
  405    HZ2  LYS  53           1HZ      LYS  53  -7.439  -7.627  -1.310
  406    HZ3  LYS  53           2HZ      LYS  53  -9.042  -8.110  -1.555
  407    H    LEU  54           H        LEU  54  -2.423  -4.055  -0.264
  408    HA   LEU  54           HA       LEU  54  -2.405  -2.082  -2.414
  409    HG   LEU  54           HG       LEU  54  -0.970  -0.598  -1.703
  410    HB2  LEU  54           2HB      LEU  54  -0.517  -2.921  -0.496
  411    HB3  LEU  54           1HB      LEU  54   0.142  -3.337  -2.066
  412   HD11  LEU  54          1HD1      LEU  54   0.285  -0.312   0.143
  413   HD12  LEU  54          2HD1      LEU  54   1.595  -0.158  -1.025
  414   HD13  LEU  54          3HD1      LEU  54   1.319  -1.696  -0.208
  415   HD21  LEU  54          3HD2      LEU  54  -0.158  -0.635  -3.794
  416   HD22  LEU  54          1HD2      LEU  54   0.882  -2.024  -3.476
  417   HD23  LEU  54          2HD2      LEU  54   1.404  -0.405  -3.009
  418    H    LEU  55           H        LEU  55  -3.150  -2.816  -4.263
  419    HA   LEU  55           HA       LEU  55  -2.923  -5.487  -5.179
  420    HG   LEU  55           HG       LEU  55  -3.409  -5.732  -7.598
  421    HB2  LEU  55           2HB      LEU  55  -4.700  -3.909  -5.891
  422    HB3  LEU  55           1HB      LEU  55  -3.496  -2.974  -6.755
  423   HD11  LEU  55          1HD1      LEU  55  -5.595  -5.823  -8.689
  424   HD12  LEU  55          2HD1      LEU  55  -6.065  -4.334  -7.869
  425   HD13  LEU  55          3HD1      LEU  55  -5.746  -5.793  -6.932
  426   HD21  LEU  55          3HD2      LEU  55  -2.454  -4.061  -8.956
  427   HD22  LEU  55          1HD2      LEU  55  -3.915  -3.075  -8.908
  428   HD23  LEU  55          2HD2      LEU  55  -3.905  -4.592  -9.807
  429    H    ALA  56           H        ALA  56  -1.293  -2.448  -6.198
  430    HA   ALA  56           HA       ALA  56   1.169  -3.898  -6.648
  431    HB1  ALA  56           3HB      ALA  56   0.045  -4.484  -8.718
  432    HB2  ALA  56           1HB      ALA  56   1.336  -3.333  -9.071
  433    HB3  ALA  56           2HB      ALA  56  -0.341  -2.791  -9.026
  434    H    VAL  57           H        VAL  57   2.949  -2.468  -7.409
  435    HA   VAL  57           HA       VAL  57   2.471   0.395  -7.249
  436    HB   VAL  57           HB       VAL  57   4.629   0.308  -5.597
  437   HG11  VAL  57          1HG1      VAL  57   2.806   1.784  -5.245
  438   HG12  VAL  57          2HG1      VAL  57   2.993   0.836  -3.770
  439   HG13  VAL  57          3HG1      VAL  57   1.704   0.448  -4.909
  440   HG21  VAL  57          3HG2      VAL  57   4.408  -2.150  -5.352
  441   HG22  VAL  57          1HG2      VAL  57   2.815  -1.902  -4.636
  442   HG23  VAL  57          2HG2      VAL  57   4.253  -1.280  -3.826
  443    H    ASN  58           H        ASN  58   3.565   1.246  -8.888
  444    HA   ASN  58           HA       ASN  58   5.114   1.575 -10.524
  445    HB2  ASN  58           2HB      ASN  58   6.704   0.842  -8.124
  446    HB3  ASN  58           1HB      ASN  58   7.551   0.800  -9.667
  447   HD21  ASN  58          1HD2      ASN  58   5.348   2.890  -7.815
  448   HD22  ASN  58          2HD2      ASN  58   6.114   4.372  -8.261
  449    H    ASN  59           H        ASN  59   3.840  -0.243 -11.488
  450    HA   ASN  59           HA       ASN  59   3.743  -2.005 -12.904
  451    HB2  ASN  59           2HB      ASN  59   6.200  -0.956 -13.298
  452    HB3  ASN  59           1HB      ASN  59   6.630  -2.605 -12.855
  453   HD21  ASN  59          1HD2      ASN  59   5.932  -0.635 -15.382
  454   HD22  ASN  59          2HD2      ASN  59   5.423  -1.813 -16.538
  455    H    VAL  60           H        VAL  60   5.366  -2.561  -9.840
  456    HA   VAL  60           HA       VAL  60   5.206  -5.451 -10.213
  457    HB   VAL  60           HB       VAL  60   6.315  -5.645  -8.036
  458   HG11  VAL  60          1HG1      VAL  60   8.414  -4.169  -8.784
  459   HG12  VAL  60          2HG1      VAL  60   7.490  -4.133 -10.287
  460   HG13  VAL  60          3HG1      VAL  60   7.968  -5.678  -9.583
  461   HG21  VAL  60          3HG2      VAL  60   6.824  -2.717  -7.941
  462   HG22  VAL  60          1HG2      VAL  60   6.856  -3.912  -6.645
  463   HG23  VAL  60          2HG2      VAL  60   5.315  -3.346  -7.283
  464    H    CYS  61           H        CYS  61   3.867  -6.816  -9.109
  465    HA   CYS  61           HA       CYS  61   1.541  -5.609  -7.872
  466    HG   CYS  61           HG       CYS  61   2.624  -9.543  -9.168
  467    HB2  CYS  61           2HB      CYS  61   0.624  -7.861  -7.800
  468    HB3  CYS  61           1HB      CYS  61   1.270  -7.528  -9.401
  469    H    LEU  62           H        LEU  62   1.048  -5.629  -5.717
  470    HA   LEU  62           HA       LEU  62   3.162  -6.578  -3.930
  471    HG   LEU  62           HG       LEU  62   3.467  -5.208  -1.816
  472    HB2  LEU  62           2HB      LEU  62   1.836  -4.133  -4.120
  473    HB3  LEU  62           1HB      LEU  62   1.155  -4.894  -2.700
  474   HD11  LEU  62          1HD1      LEU  62   5.144  -3.589  -2.982
  475   HD12  LEU  62          2HD1      LEU  62   4.128  -3.869  -4.396
  476   HD13  LEU  62          3HD1      LEU  62   4.919  -5.227  -3.595
  477   HD21  LEU  62          3HD2      LEU  62   2.821  -2.342  -2.483
  478   HD22  LEU  62          1HD2      LEU  62   3.768  -2.932  -1.118
  479   HD23  LEU  62          2HD2      LEU  62   2.039  -3.269  -1.204
  480    H    GLU  63           H        GLU  63   0.869  -8.185  -5.120
  481    HA   GLU  63           HA       GLU  63  -0.602  -8.871  -2.684
  482    HB2  GLU  63           2HB      GLU  63  -1.061  -9.620  -5.570
  483    HB3  GLU  63           1HB      GLU  63  -2.036 -10.213  -4.232
  484    HG2  GLU  63           2HG      GLU  63  -3.071  -8.210  -3.908
  485    HG3  GLU  63           1HG      GLU  63  -1.700  -7.278  -4.506
  486    H    GLU  64           H        GLU  64   1.874 -10.146  -4.780
  487    HA   GLU  64           HA       GLU  64   1.875 -12.606  -3.169
  488    HB2  GLU  64           2HB      GLU  64   1.472 -12.383  -5.975
  489    HB3  GLU  64           1HB      GLU  64   3.016 -13.173  -5.704
  490    HG2  GLU  64           2HG      GLU  64   2.075 -15.011  -4.754
  491    HG3  GLU  64           1HG      GLU  64   0.690 -14.116  -4.130
  492    H    VAL  65           H        VAL  65   3.366 -10.899  -2.065
  493    HA   VAL  65           HA       VAL  65   6.095 -11.670  -2.738
  494    HB   VAL  65           HB       VAL  65   6.893  -9.295  -2.468
  495   HG11  VAL  65          1HG1      VAL  65   6.701 -10.543  -4.646
  496   HG12  VAL  65          2HG1      VAL  65   6.678  -8.785  -4.774
  497   HG13  VAL  65          3HG1      VAL  65   5.175  -9.698  -4.907
  498   HG21  VAL  65          3HG2      VAL  65   5.241  -7.527  -3.093
  499   HG22  VAL  65          1HG2      VAL  65   4.971  -8.251  -1.508
  500   HG23  VAL  65          2HG2      VAL  65   3.962  -8.721  -2.876
  501    H    THR  66           H        THR  66   7.602 -11.396  -1.084
  502    HA   THR  66           HA       THR  66   6.617 -11.745   1.549
  503    HB   THR  66           HB       THR  66   9.114 -11.311   2.151
  504    HG1  THR  66           1HG      THR  66   9.560 -11.804  -0.575
  505   HG21  THR  66          3HG2      THR  66   9.828 -13.501   1.262
  506   HG22  THR  66          1HG2      THR  66   8.328 -13.577   0.339
  507   HG23  THR  66          2HG2      THR  66   8.279 -13.551   2.102
  508    H    HIS  67           H        HIS  67   7.319 -10.330   3.435
  509    HA   HIS  67           HA       HIS  67   6.179  -7.809   3.137
  510    HD1  HIS  67           1HD      HIS  67   4.963  -7.148   6.357
  511    HD2  HIS  67           2HD      HIS  67   8.648  -5.644   5.182
  512    HE1  HIS  67           1HE      HIS  67   4.947  -4.730   7.011
  513    HE2  HIS  67           2HE      HIS  67   7.132  -3.816   6.184
  514    HB2  HIS  67           2HB      HIS  67   6.357  -8.885   5.331
  515    HB3  HIS  67           1HB      HIS  67   8.092  -8.602   5.351
  516    H    GLU  68           H        GLU  68   9.591  -8.724   2.919
  517    HA   GLU  68           HA       GLU  68  10.752  -6.213   2.920
  518    HB2  GLU  68           2HB      GLU  68  12.542  -7.200   1.508
  519    HB3  GLU  68           1HB      GLU  68  12.125  -8.198   2.891
  520    HG2  GLU  68           2HG      GLU  68  10.488  -9.209   0.964
  521    HG3  GLU  68           1HG      GLU  68  11.911  -8.751   0.031
  522    H    GLU  69           H        GLU  69   9.233  -7.944   0.220
  523    HA   GLU  69           HA       GLU  69   9.801  -6.033  -1.781
  524    HB2  GLU  69           2HB      GLU  69   7.920  -8.314  -1.493
  525    HB3  GLU  69           1HB      GLU  69   7.559  -7.133  -2.744
  526    HG2  GLU  69           2HG      GLU  69   8.891  -8.371  -4.028
  527    HG3  GLU  69           1HG      GLU  69  10.211  -7.586  -3.164
  528    H    ALA  70           H        ALA  70   7.173  -6.327   0.552
  529    HA   ALA  70           HA       ALA  70   5.397  -4.401  -0.488
  530    HB1  ALA  70           3HB      ALA  70   4.366  -4.413   1.636
  531    HB2  ALA  70           1HB      ALA  70   5.852  -4.909   2.445
  532    HB3  ALA  70           2HB      ALA  70   4.993  -6.043   1.403
  533    H    VAL  71           H        VAL  71   8.167  -4.136   1.686
  534    HA   VAL  71           HA       VAL  71   7.867  -1.281   2.027
  535    HB   VAL  71           HB       VAL  71  10.008  -3.216   2.917
  536   HG11  VAL  71          1HG1      VAL  71  11.284  -1.300   2.679
  537   HG12  VAL  71          2HG1      VAL  71  10.720  -1.163   4.344
  538   HG13  VAL  71          3HG1      VAL  71   9.938  -0.229   3.069
  539   HG21  VAL  71          3HG2      VAL  71   8.371  -1.562   4.766
  540   HG22  VAL  71          1HG2      VAL  71   9.030  -3.182   4.982
  541   HG23  VAL  71          2HG2      VAL  71   7.601  -2.937   3.979
  542    H    THR  72           H        THR  72   9.907  -3.469   0.150
  543    HA   THR  72           HA       THR  72  11.737  -1.562  -0.804
  544    HB   THR  72           HB       THR  72  10.838  -4.210  -1.943
  545    HG1  THR  72           1HG      THR  72  12.055  -4.781  -0.321
  546   HG21  THR  72          3HG2      THR  72  12.983  -4.155  -3.224
  547   HG22  THR  72          1HG2      THR  72  13.089  -2.434  -2.855
  548   HG23  THR  72          2HG2      THR  72  11.741  -3.049  -3.813
  549    H    ALA  73           H        ALA  73   8.534  -2.506  -1.908
  550    HA   ALA  73           HA       ALA  73   8.720  -1.080  -4.396
  551    HB1  ALA  73           3HB      ALA  73   6.191  -2.053  -3.092
  552    HB2  ALA  73           1HB      ALA  73   7.290  -3.131  -3.953
  553    HB3  ALA  73           2HB      ALA  73   6.515  -1.798  -4.808
  554    H    LEU  74           H        LEU  74   7.394  -0.491  -1.156
  555    HA   LEU  74           HA       LEU  74   6.060   1.945  -1.863
  556    HG   LEU  74           HG       LEU  74   4.561   0.397   1.164
  557    HB2  LEU  74           2HB      LEU  74   6.809   0.568   0.688
  558    HB3  LEU  74           1HB      LEU  74   6.295   2.240   0.738
  559   HD11  LEU  74          1HD1      LEU  74   3.982   2.542  -0.870
  560   HD12  LEU  74          2HD1      LEU  74   4.022   2.764   0.880
  561   HD13  LEU  74          3HD1      LEU  74   2.796   1.727   0.150
  562   HD21  LEU  74          3HD2      LEU  74   3.653  -0.786  -0.577
  563   HD22  LEU  74          1HD2      LEU  74   5.352  -0.756  -1.042
  564   HD23  LEU  74          2HD2      LEU  74   4.215   0.361  -1.795
  565    H    LYS  75           H        LYS  75   9.231   1.021  -0.713
  566    HA   LYS  75           HA       LYS  75  10.078   3.740  -0.204
  567    HB2  LYS  75           2HB      LYS  75  12.157   2.853   0.476
  568    HB3  LYS  75           1HB      LYS  75  10.944   1.710   1.032
  569    HG2  LYS  75           2HG      LYS  75  11.718   0.056  -0.271
  570    HG3  LYS  75           1HG      LYS  75  12.075   1.133  -1.619
  571    HD2  LYS  75           2HD      LYS  75  14.164   0.330  -0.873
  572    HD3  LYS  75           1HD      LYS  75  14.034   1.972  -0.241
  573    HE2  LYS  75           2HE      LYS  75  12.899   0.112   1.628
  574    HE3  LYS  75           1HE      LYS  75  14.530  -0.399   1.191
  575    HZ1  LYS  75           3HZ      LYS  75  15.335   1.806   1.777
  576    HZ2  LYS  75           1HZ      LYS  75  14.553   1.084   3.092
  577    HZ3  LYS  75           2HZ      LYS  75  13.770   2.290   2.201
  578    H    ASN  76           H        ASN  76  10.102   1.592  -2.934
  579    HA   ASN  76           HA       ASN  76  12.159   3.046  -4.356
  580    HB2  ASN  76           2HB      ASN  76  11.632   0.549  -4.611
  581    HB3  ASN  76           1HB      ASN  76  10.238   1.052  -5.559
  582   HD21  ASN  76          1HD2      ASN  76  10.514   1.619  -7.643
  583   HD22  ASN  76          2HD2      ASN  76  12.041   1.671  -8.447
  584    H    THR  77           H        THR  77  10.834   5.086  -3.884
  585    HA   THR  77           HA       THR  77   9.006   5.567  -6.144
  586    HB   THR  77           HB       THR  77   7.916   7.288  -4.620
  587    HG1  THR  77           1HG      THR  77   8.283   7.110  -2.453
  588   HG21  THR  77          3HG2      THR  77   7.655   4.487  -3.576
  589   HG22  THR  77          1HG2      THR  77   6.949   5.020  -5.101
  590   HG23  THR  77          2HG2      THR  77   6.442   5.767  -3.587
  591    H    SER  78           H        SER  78   9.411   7.270  -7.405
  592    HA   SER  78           HA       SER  78  11.679   9.004  -6.693
  593    HG   SER  78           HG       SER  78  12.549   9.880  -9.562
  594    HB2  SER  78           2HB      SER  78  11.346   7.522  -8.943
  595    HB3  SER  78           1HB      SER  78  10.626   9.044  -9.467
  596    H    ASP  79           H        ASP  79  10.796  10.897  -8.896
  597    HA   ASP  79           HA       ASP  79   9.610  12.866  -7.406
  598    HB2  ASP  79           2HB      ASP  79   9.427  12.355 -10.379
  599    HB3  ASP  79           1HB      ASP  79   8.819  13.824  -9.621
  600    H    PHE  80           H        PHE  80   7.916  10.558  -9.549
  601    HA   PHE  80           HA       PHE  80   5.450  11.135  -8.043
  602    HD1  PHE  80           1HD      PHE  80   5.532  13.561 -10.072
  603    HD2  PHE  80           2HD      PHE  80   2.527  10.548  -9.926
  604    HE1  PHE  80           1HE      PHE  80   3.812  15.297  -9.818
  605    HE2  PHE  80           2HE      PHE  80   0.799  12.284  -9.671
  606    HZ   PHE  80           HZ       PHE  80   1.445  14.663  -9.612
  607    HB2  PHE  80           2HB      PHE  80   5.925  11.229 -10.884
  608    HB3  PHE  80           1HB      PHE  80   4.732   9.984 -10.521
  609    H    VAL  81           H        VAL  81   3.943   9.279  -7.837
  610    HA   VAL  81           HA       VAL  81   5.169   6.663  -8.253
  611    HB   VAL  81           HB       VAL  81   5.852   7.148  -6.000
  612   HG11  VAL  81          1HG1      VAL  81   4.694   8.373  -4.547
  613   HG12  VAL  81          2HG1      VAL  81   3.265   7.353  -4.715
  614   HG13  VAL  81          3HG1      VAL  81   3.541   8.676  -5.847
  615   HG21  VAL  81          3HG2      VAL  81   5.112   4.867  -6.425
  616   HG22  VAL  81          1HG2      VAL  81   3.462   5.305  -5.983
  617   HG23  VAL  81          2HG2      VAL  81   4.740   5.344  -4.769
  618    H    TYR  82           H        TYR  82   3.712   5.324  -9.155
  619    HA   TYR  82           HA       TYR  82   0.870   6.021  -8.938
  620    HD1  TYR  82           1HD      TYR  82   0.466   2.433 -10.731
  621    HD2  TYR  82           2HD      TYR  82  -0.363   6.489 -11.712
  622    HE1  TYR  82           1HE      TYR  82  -1.722   1.766 -11.611
  623    HE2  TYR  82           2HE      TYR  82  -2.561   5.830 -12.591
  624    HH   TYR  82           HH       TYR  82  -3.409   3.109 -13.567
  625    HB2  TYR  82           2HB      TYR  82   1.906   5.754 -11.199
  626    HB3  TYR  82           1HB      TYR  82   2.233   4.074 -10.800
  627    H    LEU  83           H        LEU  83   0.211   5.164  -7.071
  628    HA   LEU  83           HA       LEU  83   0.903   2.445  -6.320
  629    HG   LEU  83           HG       LEU  83  -0.153   1.727  -4.218
  630    HB2  LEU  83           2HB      LEU  83   0.873   4.357  -4.697
  631    HB3  LEU  83           1HB      LEU  83  -0.871   4.397  -4.863
  632   HD11  LEU  83          1HD1      LEU  83   1.962   2.931  -3.406
  633   HD12  LEU  83          2HD1      LEU  83   1.127   1.867  -2.274
  634   HD13  LEU  83          3HD1      LEU  83   0.925   3.615  -2.153
  635   HD21  LEU  83          3HD2      LEU  83  -1.458   2.258  -2.163
  636   HD22  LEU  83          1HD2      LEU  83  -2.269   2.694  -3.668
  637   HD23  LEU  83          2HD2      LEU  83  -1.502   3.942  -2.686
  638    H    LYS  84           H        LYS  84  -0.434   0.724  -6.242
  639    HA   LYS  84           HA       LYS  84  -3.176   1.086  -7.242
  640    HB2  LYS  84           2HB      LYS  84  -1.158  -1.038  -7.868
  641    HB3  LYS  84           1HB      LYS  84  -2.876  -1.357  -8.034
  642    HG2  LYS  84           2HG      LYS  84  -2.343   1.101  -9.329
  643    HG3  LYS  84           1HG      LYS  84  -1.118  -0.058  -9.848
  644    HD2  LYS  84           2HD      LYS  84  -2.829  -0.406 -11.376
  645    HD3  LYS  84           1HD      LYS  84  -3.122  -1.666 -10.176
  646    HE2  LYS  84           2HE      LYS  84  -4.575   0.361  -9.134
  647    HE3  LYS  84           1HE      LYS  84  -4.710   0.723 -10.853
  648    HZ1  LYS  84           3HZ      LYS  84  -5.338  -1.730 -11.076
  649    HZ2  LYS  84           1HZ      LYS  84  -6.492  -0.676 -10.427
  650    HZ3  LYS  84           2HZ      LYS  84  -5.602  -1.690  -9.406
  651    H    VAL  85           H        VAL  85  -4.604   0.780  -5.682
  652    HA   VAL  85           HA       VAL  85  -4.077  -1.336  -3.701
  653    HB   VAL  85           HB       VAL  85  -5.352   1.375  -3.342
  654   HG11  VAL  85          1HG1      VAL  85  -6.587  -0.777  -2.303
  655   HG12  VAL  85          2HG1      VAL  85  -6.537   0.795  -1.509
  656   HG13  VAL  85          3HG1      VAL  85  -5.398  -0.468  -1.037
  657   HG21  VAL  85          3HG2      VAL  85  -3.560   0.316  -1.293
  658   HG22  VAL  85          1HG2      VAL  85  -3.559   1.882  -2.106
  659   HG23  VAL  85          2HG2      VAL  85  -2.810   0.486  -2.881
  660    H    ALA  86           H        ALA  86  -5.587  -2.903  -3.519
  661    HA   ALA  86           HA       ALA  86  -7.884  -2.819  -5.286
  662    HB1  ALA  86           3HB      ALA  86  -6.794  -4.980  -3.490
  663    HB2  ALA  86           1HB      ALA  86  -6.664  -4.872  -5.245
  664    HB3  ALA  86           2HB      ALA  86  -8.232  -5.165  -4.494
  665    H    LYS  87           H        LYS  87 -10.055  -3.098  -4.623
  666    HA   LYS  87           HA       LYS  87 -10.581  -2.058  -1.932
  667    HB2  LYS  87           2HB      LYS  87 -11.496  -0.975  -4.095
  668    HB3  LYS  87           1HB      LYS  87 -12.636  -2.314  -4.111
  669    HG2  LYS  87           2HG      LYS  87 -13.669  -1.619  -2.139
  670    HG3  LYS  87           1HG      LYS  87 -12.316  -0.579  -1.691
  671    HD2  LYS  87           2HD      LYS  87 -12.934   0.649  -3.931
  672    HD3  LYS  87           1HD      LYS  87 -14.503  -0.113  -3.667
  673    HE2  LYS  87           2HE      LYS  87 -13.125   1.460  -1.511
  674    HE3  LYS  87           1HE      LYS  87 -14.135   2.243  -2.725
  675    HZ1  LYS  87           3HZ      LYS  87 -15.980   0.822  -2.032
  676    HZ2  LYS  87           1HZ      LYS  87 -15.404   1.755  -0.744
  677    HZ3  LYS  87           2HZ      LYS  87 -15.008   0.114  -0.844
  678    HA   PRO  88           HA       PRO  88 -11.869  -6.215  -0.854
  679    HB2  PRO  88           2HB      PRO  88 -12.550  -5.677   1.713
  680    HB3  PRO  88           1HB      PRO  88 -10.869  -5.829   1.185
  681    HG2  PRO  88           2HG      PRO  88 -12.495  -3.354   1.637
  682    HG3  PRO  88           1HG      PRO  88 -10.824  -3.697   2.122
  683    HD2  PRO  88           2HD      PRO  88 -11.433  -2.215  -0.061
  684    HD3  PRO  88           1HD      PRO  88  -9.989  -3.244   0.021
  685    H    THR  89           H        THR  89 -13.810  -7.162  -1.209
  686    HA   THR  89           HA       THR  89 -16.249  -5.652  -0.548
  687    HB   THR  89           HB       THR  89 -15.967  -7.384  -3.006
  688    HG1  THR  89           1HG      THR  89 -14.776  -5.750  -3.644
  689   HG21  THR  89          3HG2      THR  89 -18.192  -7.187  -2.951
  690   HG22  THR  89          1HG2      THR  89 -17.884  -5.558  -3.552
  691   HG23  THR  89          2HG2      THR  89 -18.149  -5.826  -1.830
  692    H    GLY  90           H        GLY  90 -15.337  -8.911  -1.731
  693    HA2  GLY  90           2HA      GLY  90 -15.493 -10.760  -0.083
  694    HA3  GLY  90           1HA      GLY  90 -17.002 -10.029   0.442
  695    H    SER  91           H        SER  91 -15.757 -12.504  -1.296
  696    HA   SER  91           HA       SER  91 -17.446 -12.560  -3.582
  697    HG   SER  91           HG       SER  91 -14.413 -13.648  -3.212
  698    HB2  SER  91           2HB      SER  91 -15.903 -14.740  -2.161
  699    HB3  SER  91           1HB      SER  91 -16.792 -14.998  -3.662
  700    H    HIS  92           H        HIS  92 -17.627 -14.188  -0.413
  701    HA   HIS  92           HA       HIS  92 -20.234 -15.288  -1.020
  702    HD1  HIS  92           1HD      HIS  92 -21.768 -17.020   0.836
  703    HD2  HIS  92           2HD      HIS  92 -17.934 -18.363  -0.037
  704    HE1  HIS  92           1HE      HIS  92 -22.026 -19.450   0.242
  705    HE2  HIS  92           2HE      HIS  92 -19.704 -20.221  -0.360
  706    HB2  HIS  92           2HB      HIS  92 -18.158 -15.823   0.874
  707    HB3  HIS  92           1HB      HIS  92 -19.650 -15.518   1.756
  708    HA   ARG 301           HA       ARG 301   2.473 -10.820  10.354
  709    HE   ARG 301           HE       ARG 301  -1.640 -10.108  13.354
  710    H1   ARG 301           1HT      ARG 301   4.141 -11.970  11.711
  711    H2   ARG 301           2HT      ARG 301   2.658 -12.811  11.519
  712    H3   ARG 301           3HT      ARG 301   3.004 -12.005  12.994
  713    HB2  ARG 301           2HB      ARG 301   1.095 -10.594  13.042
  714    HB3  ARG 301           1HB      ARG 301   0.601  -9.774  11.569
  715    HG2  ARG 301           2HG      ARG 301   0.291 -12.054  10.541
  716    HG3  ARG 301           1HG      ARG 301   0.514 -12.718  12.160
  717    HD2  ARG 301           2HD      ARG 301  -1.658 -10.868  11.198
  718    HD3  ARG 301           1HD      ARG 301  -1.830 -12.515  11.802
  719   HH11  ARG 301          1HH1      ARG 301  -1.094 -13.569  13.402
  720   HH12  ARG 301          2HH1      ARG 301  -1.203 -13.684  15.126
  721   HH21  ARG 301          1HH2      ARG 301  -1.781 -10.270  15.623
  722   HH22  ARG 301          2HH2      ARG 301  -1.593 -11.813  16.386
  723    H    ARG 302           H        ARG 302   4.573  -9.785  10.326
  724    HA   ARG 302           HA       ARG 302   5.047  -7.800  12.417
  725    HE   ARG 302           HE       ARG 302   9.329 -10.173   9.615
  726    HB2  ARG 302           2HB      ARG 302   7.264  -7.661  11.686
  727    HB3  ARG 302           1HB      ARG 302   6.868  -9.362  11.494
  728    HG2  ARG 302           2HG      ARG 302   6.742  -9.186   9.164
  729    HG3  ARG 302           1HG      ARG 302   6.637  -7.428   9.212
  730    HD2  ARG 302           2HD      ARG 302   8.840  -8.180   8.468
  731    HD3  ARG 302           1HD      ARG 302   8.937  -7.293   9.987
  732   HH11  ARG 302          1HH1      ARG 302   9.361  -7.394  11.757
  733   HH12  ARG 302          2HH1      ARG 302  10.239  -8.215  13.000
  734   HH21  ARG 302          1HH2      ARG 302  10.483 -11.239  11.262
  735   HH22  ARG 302          2HH2      ARG 302  10.877 -10.394  12.721
  736    H    GLU 303           H        GLU 303   5.139  -5.614  12.055
  737    HA   GLU 303           HA       GLU 303   4.217  -4.674   9.419
  738    HB2  GLU 303           2HB      GLU 303   3.288  -3.904  12.173
  739    HB3  GLU 303           1HB      GLU 303   3.110  -2.798  10.819
  740    HG2  GLU 303           2HG      GLU 303   1.060  -3.943  11.036
  741    HG3  GLU 303           1HG      GLU 303   1.863  -4.615   9.622
  742    H    THR 304           H        THR 304   5.478  -3.182   8.495
  743    HA   THR 304           HA       THR 304   7.375  -1.713  10.202
  744    HB   THR 304           HB       THR 304   7.848  -3.441   7.907
  745    HG1  THR 304           1HG      THR 304   9.532  -2.217   9.829
  746   HG21  THR 304          3HG2      THR 304   8.080  -1.392   6.647
  747   HG22  THR 304          1HG2      THR 304   9.650  -2.154   6.902
  748   HG23  THR 304          2HG2      THR 304   9.184  -0.749   7.863
  749    H    GLN 305           H        GLN 305   7.847   0.417   9.674
  750    HA   GLN 305           HA       GLN 305   5.777   1.797   8.200
  751    HB2  GLN 305           2HB      GLN 305   8.073   2.662   9.925
  752    HB3  GLN 305           1HB      GLN 305   7.255   3.830   8.894
  753    HG2  GLN 305           2HG      GLN 305   5.326   3.768  10.111
  754    HG3  GLN 305           1HG      GLN 305   5.599   2.119  10.669
  755   HE21  GLN 305          1HE2      GLN 305   6.352   1.839  12.664
  756   HE22  GLN 305          2HE2      GLN 305   7.013   3.079  13.669
  757    H    VAL 306           H        VAL 306   6.139   3.242   6.457
  758    HA   VAL 306           HA       VAL 306   8.688   2.961   5.038
  759    HB   VAL 306           HB       VAL 306   7.440   2.647   2.880
  760   HG11  VAL 306          1HG1      VAL 306   7.081   0.426   4.894
  761   HG12  VAL 306          2HG1      VAL 306   8.594   0.811   4.071
  762   HG13  VAL 306          3HG1      VAL 306   7.200   0.258   3.142
  763   HG21  VAL 306          3HG2      VAL 306   5.142   2.179   4.775
  764   HG22  VAL 306          1HG2      VAL 306   5.154   1.618   3.102
  765   HG23  VAL 306          2HG2      VAL 306   5.235   3.344   3.454
  Start of MODEL   23
    1    HA   MET   1           HA       MET   1  -8.843   1.778  -7.913
    2    H1   MET   1           1HT      MET   1  -9.100  -0.570  -7.971
    3    H2   MET   1           2HT      MET   1  -7.511  -0.790  -7.358
    4    H3   MET   1           3HT      MET   1  -7.747  -0.085  -8.906
    5    HB2  MET   1           2HB      MET   1  -9.338   0.114  -5.849
    6    HB3  MET   1           1HB      MET   1  -7.939   0.957  -5.203
    7    HG2  MET   1           2HG      MET   1  -9.375   2.488  -4.490
    8    HG3  MET   1           1HG      MET   1  -9.489   3.006  -6.171
    9    HE1  MET   1           3HE      MET   1 -12.942   2.281  -7.235
   10    HE2  MET   1           1HE      MET   1 -11.271   2.497  -7.757
   11    HE3  MET   1           2HE      MET   1 -12.033   3.700  -6.716
   12    H    GLU   2           H        GLU   2  -7.077   2.553  -9.120
   13    HA   GLU   2           HA       GLU   2  -4.406   2.508  -8.047
   14    HB2  GLU   2           2HB      GLU   2  -3.892   4.045  -9.965
   15    HB3  GLU   2           1HB      GLU   2  -4.589   2.500 -10.427
   16    HG2  GLU   2           2HG      GLU   2  -6.641   4.489 -10.028
   17    HG3  GLU   2           1HG      GLU   2  -5.439   5.032 -11.195
   18    H    ILE   3           H        ILE   3  -3.235   4.190  -7.144
   19    HA   ILE   3           HA       ILE   3  -4.565   6.727  -6.644
   20    HB   ILE   3           HB       ILE   3  -3.481   4.954  -4.446
   21   HG12  ILE   3          2HG1      ILE   3  -6.240   6.157  -4.712
   22   HG13  ILE   3          1HG1      ILE   3  -5.843   4.557  -5.324
   23   HG21  ILE   3          1HG2      ILE   3  -2.774   7.110  -3.878
   24   HG22  ILE   3          2HG2      ILE   3  -4.281   6.893  -2.988
   25   HG23  ILE   3          3HG2      ILE   3  -4.260   7.850  -4.469
   26   HD11  ILE   3          3HD1      ILE   3  -5.439   5.341  -2.456
   27   HD12  ILE   3          1HD1      ILE   3  -5.441   3.723  -3.158
   28   HD13  ILE   3          2HD1      ILE   3  -6.940   4.647  -3.066
   29    H    LYS   4           H        LYS   4  -3.066   7.810  -7.867
   30    HA   LYS   4           HA       LYS   4  -0.227   7.507  -7.176
   31    HB2  LYS   4           2HB      LYS   4   0.197   8.847  -9.233
   32    HB3  LYS   4           1HB      LYS   4  -0.637   7.332  -9.538
   33    HG2  LYS   4           2HG      LYS   4  -2.608   8.372 -10.110
   34    HG3  LYS   4           1HG      LYS   4  -2.229   9.831  -9.192
   35    HD2  LYS   4           2HD      LYS   4  -0.282   9.368 -11.279
   36    HD3  LYS   4           1HD      LYS   4  -1.918   9.437 -11.938
   37    HE2  LYS   4           2HE      LYS   4  -1.137  11.504  -9.953
   38    HE3  LYS   4           1HE      LYS   4  -0.434  11.614 -11.566
   39    HZ1  LYS   4           3HZ      LYS   4  -3.349  11.401 -11.051
   40    HZ2  LYS   4           1HZ      LYS   4  -2.593  11.734 -12.527
   41    HZ3  LYS   4           2HZ      LYS   4  -2.538  12.867 -11.275
   42    H    LEU   5           H        LEU   5   1.084   9.365  -6.627
   43    HA   LEU   5           HA       LEU   5  -0.282  11.876  -6.159
   44    HG   LEU   5           HG       LEU   5  -1.677  11.818  -4.496
   45    HB2  LEU   5           2HB      LEU   5   0.578   9.997  -4.030
   46    HB3  LEU   5           1HB      LEU   5   0.966  11.687  -3.783
   47   HD11  LEU   5          1HD1      LEU   5  -1.391   9.166  -4.127
   48   HD12  LEU   5          2HD1      LEU   5  -2.884  10.048  -3.807
   49   HD13  LEU   5          3HD1      LEU   5  -1.782   9.671  -2.483
   50   HD21  LEU   5          3HD2      LEU   5  -0.810  11.437  -1.650
   51   HD22  LEU   5          1HD2      LEU   5  -2.042  12.519  -2.299
   52   HD23  LEU   5          2HD2      LEU   5  -0.335  12.859  -2.578
   53    H    ILE   6           H        ILE   6   1.380  13.502  -5.227
   54    HA   ILE   6           HA       ILE   6   3.846  13.168  -6.760
   55    HB   ILE   6           HB       ILE   6   2.486  15.238  -7.059
   56   HG12  ILE   6          2HG1      ILE   6   5.218  15.809  -5.897
   57   HG13  ILE   6          1HG1      ILE   6   4.965  15.090  -7.485
   58   HG21  ILE   6          1HG2      ILE   6   2.228  16.857  -5.406
   59   HG22  ILE   6          2HG2      ILE   6   3.483  16.155  -4.385
   60   HG23  ILE   6          3HG2      ILE   6   1.927  15.344  -4.553
   61   HD11  ILE   6          3HD1      ILE   6   3.456  17.216  -7.832
   62   HD12  ILE   6          1HD1      ILE   6   5.205  17.277  -8.058
   63   HD13  ILE   6          2HD1      ILE   6   4.488  17.867  -6.558
   64    H    LYS   7           H        LYS   7   5.736  12.721  -5.827
   65    HA   LYS   7           HA       LYS   7   5.979  12.120  -3.104
   66    HB2  LYS   7           2HB      LYS   7   7.444  11.099  -4.727
   67    HB3  LYS   7           1HB      LYS   7   8.101  12.664  -5.181
   68    HG2  LYS   7           2HG      LYS   7   9.767  12.032  -3.805
   69    HG3  LYS   7           1HG      LYS   7   8.694  12.689  -2.570
   70    HD2  LYS   7           2HD      LYS   7   7.723  10.307  -2.449
   71    HD3  LYS   7           1HD      LYS   7   9.188   9.824  -3.307
   72    HE2  LYS   7           2HE      LYS   7  10.471  11.056  -1.490
   73    HE3  LYS   7           1HE      LYS   7   8.950  11.111  -0.600
   74    HZ1  LYS   7           3HZ      LYS   7   8.871   8.710  -0.621
   75    HZ2  LYS   7           1HZ      LYS   7  10.340   9.222   0.044
   76    HZ3  LYS   7           2HZ      LYS   7  10.289   8.630  -1.540
   77    H    GLY   8           H        GLY   8   6.290  13.330  -1.366
   78    HA2  GLY   8           2HA      GLY   8   6.971  16.168  -1.724
   79    HA3  GLY   8           1HA      GLY   8   6.183  15.470  -0.317
   80    HA   PRO   9           HA       PRO   9  10.786  15.895   0.504
   81    HB2  PRO   9           2HB      PRO   9  10.226  17.989   2.419
   82    HB3  PRO   9           1HB      PRO   9  11.172  18.085   0.933
   83    HG2  PRO   9           2HG      PRO   9   8.781  19.355   1.289
   84    HG3  PRO   9           1HG      PRO   9   9.394  18.844  -0.295
   85    HD2  PRO   9           2HD      PRO   9   7.395  17.494   1.490
   86    HD3  PRO   9           1HD      PRO   9   7.346  17.736  -0.272
   87    H    LYS  10           H        LYS  10   8.999  13.977   1.573
   88    HA   LYS  10           HA       LYS  10  10.094  13.710   4.245
   89    HB2  LYS  10           2HB      LYS  10   7.733  14.897   4.215
   90    HB3  LYS  10           1HB      LYS  10   7.149  13.254   4.000
   91    HG2  LYS  10           2HG      LYS  10   8.436  12.627   6.058
   92    HG3  LYS  10           1HG      LYS  10   8.741  14.348   6.303
   93    HD2  LYS  10           2HD      LYS  10   6.441  14.811   6.598
   94    HD3  LYS  10           1HD      LYS  10   5.968  13.227   5.980
   95    HE2  LYS  10           2HE      LYS  10   7.423  12.382   8.009
   96    HE3  LYS  10           1HE      LYS  10   7.058  13.985   8.646
   97    HZ1  LYS  10           3HZ      LYS  10   5.413  12.448   9.406
   98    HZ2  LYS  10           1HZ      LYS  10   5.097  11.908   7.834
   99    HZ3  LYS  10           2HZ      LYS  10   4.680  13.483   8.287
  100    H    GLY  11           H        GLY  11   7.597  12.240   2.140
  101    HA2  GLY  11           2HA      GLY  11   8.657  10.076   1.107
  102    HA3  GLY  11           1HA      GLY  11   8.655   9.587   2.794
  103    H    LEU  12           H        LEU  12   7.127   8.039   2.891
  104    HA   LEU  12           HA       LEU  12   4.607   8.362   1.482
  105    HG   LEU  12           HG       LEU  12   5.973   6.632   0.426
  106    HB2  LEU  12           2HB      LEU  12   5.597   6.147   3.279
  107    HB3  LEU  12           1HB      LEU  12   4.089   6.118   2.387
  108   HD11  LEU  12          1HD1      LEU  12   7.814   5.242   0.704
  109   HD12  LEU  12          2HD1      LEU  12   7.082   4.378   2.055
  110   HD13  LEU  12          3HD1      LEU  12   7.654   6.032   2.272
  111   HD21  LEU  12          3HD2      LEU  12   5.473   4.394  -0.333
  112   HD22  LEU  12          1HD2      LEU  12   4.011   5.146   0.303
  113   HD23  LEU  12          2HD2      LEU  12   4.880   3.952   1.268
  114    H    GLY  13           H        GLY  13   5.636   7.854   4.870
  115    HA2  GLY  13           2HA      GLY  13   4.834   8.981   6.746
  116    HA3  GLY  13           1HA      GLY  13   3.566   9.684   5.763
  117    H    PHE  14           H        PHE  14   4.201   6.214   5.904
  118    HA   PHE  14           HA       PHE  14   2.153   5.761   7.869
  119    HD1  PHE  14           2HD      PHE  14   2.344   2.900   5.024
  120    HD2  PHE  14           1HD      PHE  14   0.940   6.730   3.776
  121    HE1  PHE  14           2HE      PHE  14   2.818   2.310   2.687
  122    HE2  PHE  14           1HE      PHE  14   1.411   6.139   1.440
  123    HZ   PHE  14           HZ       PHE  14   2.344   3.933   0.890
  124    HB2  PHE  14           2HB      PHE  14   0.676   4.432   6.397
  125    HB3  PHE  14           1HB      PHE  14   0.707   6.136   5.974
  126    H    SER  15           H        SER  15   1.575   3.195   7.660
  127    HA   SER  15           HA       SER  15   4.156   1.815   7.426
  128    HG   SER  15           HG       SER  15   2.095   2.838  10.052
  129    HB2  SER  15           2HB      SER  15   2.977   0.289   9.267
  130    HB3  SER  15           1HB      SER  15   3.925   1.702   9.713
  131    H    ILE  16           H        ILE  16   3.784  -0.637   7.298
  132    HA   ILE  16           HA       ILE  16   1.311  -1.439   5.979
  133    HB   ILE  16           HB       ILE  16   2.731  -2.303   3.997
  134   HG12  ILE  16          2HG1      ILE  16   4.480   0.044   4.281
  135   HG13  ILE  16          1HG1      ILE  16   4.787  -1.225   5.462
  136   HG21  ILE  16          1HG2      ILE  16   2.226  -0.394   2.709
  137   HG22  ILE  16          2HG2      ILE  16   2.371   0.679   4.101
  138   HG23  ILE  16          3HG2      ILE  16   1.013  -0.440   3.989
  139   HD11  ILE  16          3HD1      ILE  16   5.616  -1.071   2.774
  140   HD12  ILE  16          1HD1      ILE  16   4.518  -2.442   2.927
  141   HD13  ILE  16          2HD1      ILE  16   5.944  -2.338   3.966
  142    H    ALA  17           H        ALA  17   1.416  -3.711   5.292
  143    HA   ALA  17           HA       ALA  17   3.453  -5.382   6.559
  144    HB1  ALA  17           3HB      ALA  17   2.026  -5.863   8.235
  145    HB2  ALA  17           1HB      ALA  17   1.196  -6.852   7.036
  146    HB3  ALA  17           2HB      ALA  17   0.635  -5.210   7.369
  147    H    GLY  18           H        GLY  18   3.128  -7.775   5.621
  148    HA2  GLY  18           2HA      GLY  18   1.556  -8.314   3.458
  149    HA3  GLY  18           1HA      GLY  18   2.860  -7.384   2.767
  150    H    GLY  19           H        GLY  19   1.827 -10.399   2.767
  151    HA2  GLY  19           2HA      GLY  19   3.211 -12.079   1.801
  152    HA3  GLY  19           1HA      GLY  19   4.581 -11.418   2.673
  153    H    VAL  20           H        VAL  20   3.924 -14.141   2.573
  154    HA   VAL  20           HA       VAL  20   2.475 -15.048   4.816
  155    HB   VAL  20           HB       VAL  20   3.093 -16.459   2.849
  156   HG11  VAL  20          1HG1      VAL  20   5.507 -15.664   2.851
  157   HG12  VAL  20          2HG1      VAL  20   5.234 -17.383   2.570
  158   HG13  VAL  20          3HG1      VAL  20   5.775 -16.823   4.154
  159   HG21  VAL  20          3HG2      VAL  20   3.997 -17.672   5.453
  160   HG22  VAL  20          1HG2      VAL  20   3.269 -18.494   4.074
  161   HG23  VAL  20          2HG2      VAL  20   2.307 -17.377   5.041
  162    H    GLY  21           H        GLY  21   3.076 -15.558   6.896
  163    HA2  GLY  21           2HA      GLY  21   4.475 -15.793   8.755
  164    HA3  GLY  21           1HA      GLY  21   5.852 -15.393   7.739
  165    H    ASN  22           H        ASN  22   4.244 -12.961   6.824
  166    HA   ASN  22           HA       ASN  22   4.447 -11.275   9.206
  167    HB2  ASN  22           2HB      ASN  22   5.374  -9.528   7.384
  168    HB3  ASN  22           1HB      ASN  22   6.448 -10.551   8.319
  169   HD21  ASN  22          1HD2      ASN  22   4.484 -10.867   5.372
  170   HD22  ASN  22          2HD2      ASN  22   5.741 -11.572   4.422
  171    H    GLN  23           H        GLN  23   2.256 -12.470   7.365
  172    HA   GLN  23           HA       GLN  23   1.039 -10.532   5.828
  173    HB2  GLN  23           2HB      GLN  23  -0.259 -12.726   7.444
  174    HB3  GLN  23           1HB      GLN  23  -1.047 -11.819   6.164
  175    HG2  GLN  23           2HG      GLN  23   0.509 -12.714   4.538
  176    HG3  GLN  23           1HG      GLN  23   1.373 -13.573   5.815
  177   HE21  GLN  23          1HE2      GLN  23   0.834 -15.612   6.128
  178   HE22  GLN  23          2HE2      GLN  23  -0.653 -16.354   5.655
  179    H    HIS  24           H        HIS  24  -0.605  -9.086   6.119
  180    HA   HIS  24           HA       HIS  24  -0.776  -7.870   8.751
  181    HD1  HIS  24           1HD      HIS  24  -0.431  -4.978   8.879
  182    HD2  HIS  24           2HD      HIS  24  -4.130  -5.602   7.113
  183    HE1  HIS  24           1HE      HIS  24  -1.920  -3.221   9.826
  184    HE2  HIS  24           2HE      HIS  24  -4.128  -3.517   8.651
  185    HB2  HIS  24           2HB      HIS  24  -0.453  -6.489   6.696
  186    HB3  HIS  24           1HB      HIS  24  -2.035  -6.996   6.142
  187    H    ILE  25           H        ILE  25  -2.718  -9.880   6.698
  188    HA   ILE  25           HA       ILE  25  -4.787  -9.944   8.730
  189    HB   ILE  25           HB       ILE  25  -5.129  -8.327   6.474
  190   HG12  ILE  25          2HG1      ILE  25  -7.540  -9.288   7.915
  191   HG13  ILE  25          1HG1      ILE  25  -6.253  -8.589   8.892
  192   HG21  ILE  25          1HG2      ILE  25  -5.567 -10.332   5.128
  193   HG22  ILE  25          2HG2      ILE  25  -6.976  -9.280   5.248
  194   HG23  ILE  25          3HG2      ILE  25  -6.893 -10.755   6.211
  195   HD11  ILE  25          3HD1      ILE  25  -8.083  -7.029   8.125
  196   HD12  ILE  25          1HD1      ILE  25  -7.399  -7.180   6.507
  197   HD13  ILE  25          2HD1      ILE  25  -6.427  -6.511   7.817
  198    HA   PRO  26           HA       PRO  26  -4.642 -14.245   7.718
  199    HB2  PRO  26           2HB      PRO  26  -7.081 -15.004   8.692
  200    HB3  PRO  26           1HB      PRO  26  -5.676 -14.682   9.714
  201    HG2  PRO  26           2HG      PRO  26  -7.997 -12.907   9.072
  202    HG3  PRO  26           1HG      PRO  26  -7.186 -13.172  10.627
  203    HD2  PRO  26           2HD      PRO  26  -6.704 -10.994   9.116
  204    HD3  PRO  26           1HD      PRO  26  -5.439 -11.754  10.102
  205    H    GLY  27           H        GLY  27  -4.942 -15.193   5.804
  206    HA2  GLY  27           2HA      GLY  27  -6.307 -16.146   4.115
  207    HA3  GLY  27           1HA      GLY  27  -7.545 -14.956   4.475
  208    H    ASP  28           H        ASP  28  -5.219 -12.863   4.416
  209    HA   ASP  28           HA       ASP  28  -4.922 -12.752   1.495
  210    HB2  ASP  28           2HB      ASP  28  -6.617 -11.105   2.938
  211    HB3  ASP  28           1HB      ASP  28  -5.161 -10.129   2.772
  212    H    ASN  29           H        ASN  29  -2.824 -12.876   1.070
  213    HA   ASN  29           HA       ASN  29  -0.863 -11.923   3.001
  214    HB2  ASN  29           2HB      ASN  29  -0.383 -13.285   0.345
  215    HB3  ASN  29           1HB      ASN  29   0.796 -13.039   1.629
  216   HD21  ASN  29          1HD2      ASN  29   1.226 -14.842   2.665
  217   HD22  ASN  29          2HD2      ASN  29   0.102 -16.096   3.045
  218    H    SER  30           H        SER  30  -2.579 -10.136   1.107
  219    HA   SER  30           HA       SER  30  -0.699  -8.863  -0.620
  220    HG   SER  30           HG       SER  30  -3.912  -9.427  -1.001
  221    HB2  SER  30           2HB      SER  30  -3.391  -7.914   0.398
  222    HB3  SER  30           1HB      SER  30  -2.440  -7.086  -0.833
  223    H    ILE  31           H        ILE  31  -0.668  -6.260  -0.308
  224    HA   ILE  31           HA       ILE  31   0.675  -5.918   2.277
  225    HB   ILE  31           HB       ILE  31   0.850  -4.051  -0.084
  226   HG12  ILE  31          2HG1      ILE  31   2.043  -5.700  -1.055
  227   HG13  ILE  31          1HG1      ILE  31   3.306  -5.182   0.041
  228   HG21  ILE  31          1HG2      ILE  31   2.683  -3.038   1.029
  229   HG22  ILE  31          2HG2      ILE  31   2.688  -4.281   2.278
  230   HG23  ILE  31          3HG2      ILE  31   1.352  -3.133   2.181
  231   HD11  ILE  31          3HD1      ILE  31   3.407  -7.279   0.747
  232   HD12  ILE  31          1HD1      ILE  31   1.944  -7.709  -0.135
  233   HD13  ILE  31          2HD1      ILE  31   1.829  -7.041   1.490
  234    H    TYR  32           H        TYR  32  -0.531  -5.123   3.842
  235    HA   TYR  32           HA       TYR  32  -2.601  -3.121   3.212
  236    HD1  TYR  32           2HD      TYR  32  -2.386  -6.584   3.274
  237    HD2  TYR  32           1HD      TYR  32  -5.633  -4.284   4.765
  238    HE1  TYR  32           2HE      TYR  32  -3.952  -8.041   2.076
  239    HE2  TYR  32           1HE      TYR  32  -7.220  -5.726   3.587
  240    HH   TYR  32           HH       TYR  32  -6.347  -7.821   1.161
  241    HB2  TYR  32           2HB      TYR  32  -2.337  -5.080   5.482
  242    HB3  TYR  32           1HB      TYR  32  -3.520  -3.781   5.477
  243    H    VAL  33           H        VAL  33  -2.735  -1.216   4.332
  244    HA   VAL  33           HA       VAL  33  -0.345  -0.295   5.658
  245    HB   VAL  33           HB       VAL  33  -2.960   1.103   5.059
  246   HG11  VAL  33          1HG1      VAL  33  -2.369   2.532   6.679
  247   HG12  VAL  33          2HG1      VAL  33  -1.132   3.081   5.549
  248   HG13  VAL  33          3HG1      VAL  33  -0.731   1.886   6.781
  249   HG21  VAL  33          3HG2      VAL  33  -1.876   0.844   3.027
  250   HG22  VAL  33          1HG2      VAL  33  -0.274   1.021   3.742
  251   HG23  VAL  33          2HG2      VAL  33  -1.317   2.430   3.558
  252    H    THR  34           H        THR  34  -0.000  -0.543   7.774
  253    HA   THR  34           HA       THR  34  -2.202  -1.297   9.507
  254    HB   THR  34           HB       THR  34  -0.074  -2.559   9.512
  255    HG1  THR  34           1HG      THR  34  -0.617  -1.314  12.001
  256   HG21  THR  34          3HG2      THR  34   1.717  -1.467  11.044
  257   HG22  THR  34          1HG2      THR  34   1.040   0.039  10.430
  258   HG23  THR  34          2HG2      THR  34   1.709  -1.145   9.309
  259    H    LYS  35           H        LYS  35  -0.295   1.577   8.965
  260    HA   LYS  35           HA       LYS  35  -1.918   3.060  10.812
  261    HB2  LYS  35           2HB      LYS  35   0.919   2.396  11.533
  262    HB3  LYS  35           1HB      LYS  35   0.226   3.927  12.035
  263    HG2  LYS  35           2HG      LYS  35  -1.655   2.003  12.758
  264    HG3  LYS  35           1HG      LYS  35  -0.084   1.305  13.162
  265    HD2  LYS  35           2HD      LYS  35  -0.284   2.492  15.059
  266    HD3  LYS  35           1HD      LYS  35   0.199   3.863  14.061
  267    HE2  LYS  35           2HE      LYS  35  -1.726   4.589  15.186
  268    HE3  LYS  35           1HE      LYS  35  -2.283   4.168  13.568
  269    HZ1  LYS  35           3HZ      LYS  35  -2.469   2.358  15.915
  270    HZ2  LYS  35           1HZ      LYS  35  -3.141   2.108  14.382
  271    HZ3  LYS  35           2HZ      LYS  35  -3.733   3.343  15.375
  272    H    ILE  36           H        ILE  36  -2.169   5.064  10.008
  273    HA   ILE  36           HA       ILE  36  -0.198   6.013   8.050
  274    HB   ILE  36           HB       ILE  36  -3.073   6.811   8.506
  275   HG12  ILE  36          2HG1      ILE  36  -1.594   5.458   6.240
  276   HG13  ILE  36          1HG1      ILE  36  -2.853   4.764   7.256
  277   HG21  ILE  36          1HG2      ILE  36  -2.751   8.323   6.544
  278   HG22  ILE  36          2HG2      ILE  36  -1.015   8.049   6.684
  279   HG23  ILE  36          3HG2      ILE  36  -1.892   8.832   7.997
  280   HD11  ILE  36          3HD1      ILE  36  -3.857   5.248   5.188
  281   HD12  ILE  36          1HD1      ILE  36  -3.131   6.854   5.123
  282   HD13  ILE  36          2HD1      ILE  36  -4.403   6.510   6.295
  283    H    ILE  37           H        ILE  37   1.154   7.621   8.571
  284    HA   ILE  37           HA       ILE  37   0.981   8.913  11.138
  285    HB   ILE  37           HB       ILE  37   2.960   9.052   8.872
  286   HG12  ILE  37          2HG1      ILE  37   4.467   8.332  10.849
  287   HG13  ILE  37          1HG1      ILE  37   2.956   7.966  11.674
  288   HG21  ILE  37          1HG2      ILE  37   2.831  10.811  11.299
  289   HG22  ILE  37          2HG2      ILE  37   3.009  11.276   9.606
  290   HG23  ILE  37          3HG2      ILE  37   4.342  10.487  10.447
  291   HD11  ILE  37          3HD1      ILE  37   2.382   6.335  10.039
  292   HD12  ILE  37          1HD1      ILE  37   4.040   6.028  10.556
  293   HD13  ILE  37          2HD1      ILE  37   3.731   6.815   9.009
  294    H    GLU  38           H        GLU  38   0.722  11.131  11.541
  295    HA   GLU  38           HA       GLU  38  -1.181  12.487  10.001
  296    HB2  GLU  38           2HB      GLU  38   0.637  13.281  12.242
  297    HB3  GLU  38           1HB      GLU  38  -0.272  14.525  11.395
  298    HG2  GLU  38           2HG      GLU  38  -2.340  13.590  12.033
  299    HG3  GLU  38           1HG      GLU  38  -1.579  12.097  12.581
  300    H    GLY  39           H        GLY  39  -1.057  14.318   8.678
  301    HA2  GLY  39           2HA      GLY  39  -0.231  15.568   6.950
  302    HA3  GLY  39           1HA      GLY  39   1.217  15.722   7.929
  303    H    GLY  40           H        GLY  40   0.294  12.516   6.958
  304    HA2  GLY  40           2HA      GLY  40   2.694  12.345   5.320
  305    HA3  GLY  40           1HA      GLY  40   1.698  11.001   5.856
  306    H    ALA  41           H        ALA  41   2.549  10.915   3.329
  307    HA   ALA  41           HA       ALA  41   1.196  12.162   1.294
  308    HB1  ALA  41           3HB      ALA  41   3.068  10.554   1.026
  309    HB2  ALA  41           1HB      ALA  41   1.739  10.286  -0.102
  310    HB3  ALA  41           2HB      ALA  41   1.926   9.238   1.305
  311    H    ALA  42           H        ALA  42   0.193   9.094   2.853
  312    HA   ALA  42           HA       ALA  42  -2.279   8.948   1.456
  313    HB1  ALA  42           3HB      ALA  42  -1.292   7.567   3.945
  314    HB2  ALA  42           1HB      ALA  42  -1.345   6.926   2.302
  315    HB3  ALA  42           2HB      ALA  42  -2.845   7.219   3.183
  316    H    HIS  43           H        HIS  43  -1.476   9.839   4.810
  317    HA   HIS  43           HA       HIS  43  -3.960  10.431   5.805
  318    HD1  HIS  43           1HD      HIS  43  -2.758  14.068   7.187
  319    HD2  HIS  43           2HD      HIS  43  -3.718  10.520   9.125
  320    HE1  HIS  43           1HE      HIS  43  -4.045  14.751   9.232
  321    HE2  HIS  43           2HE      HIS  43  -4.531  12.593  10.443
  322    HB2  HIS  43           2HB      HIS  43  -1.818  10.459   7.076
  323    HB3  HIS  43           1HB      HIS  43  -1.444  12.013   6.345
  324    H    LYS  44           H        LYS  44  -1.855  12.603   3.934
  325    HA   LYS  44           HA       LYS  44  -3.677  14.813   4.056
  326    HB2  LYS  44           2HB      LYS  44  -1.106  14.241   2.656
  327    HB3  LYS  44           1HB      LYS  44  -2.110  15.544   2.039
  328    HG2  LYS  44           2HG      LYS  44  -2.097  16.554   4.309
  329    HG3  LYS  44           1HG      LYS  44  -0.957  15.302   4.809
  330    HD2  LYS  44           2HD      LYS  44   0.478  16.092   2.836
  331    HD3  LYS  44           1HD      LYS  44  -0.563  17.516   2.817
  332    HE2  LYS  44           2HE      LYS  44   0.337  18.361   4.703
  333    HE3  LYS  44           1HE      LYS  44   0.497  16.777   5.459
  334    HZ1  LYS  44           3HZ      LYS  44   2.447  16.370   4.063
  335    HZ2  LYS  44           1HZ      LYS  44   2.657  17.736   5.038
  336    HZ3  LYS  44           2HZ      LYS  44   2.304  17.917   3.394
  337    H    ASP  45           H        ASP  45  -3.014  12.230   1.750
  338    HA   ASP  45           HA       ASP  45  -4.508  13.244  -0.413
  339    HB2  ASP  45           2HB      ASP  45  -2.837  11.345  -0.479
  340    HB3  ASP  45           1HB      ASP  45  -4.081  10.322   0.228
  341    H    GLY  46           H        GLY  46  -5.399  10.823   2.067
  342    HA2  GLY  46           2HA      GLY  46  -7.506  10.734   3.140
  343    HA3  GLY  46           1HA      GLY  46  -8.185  11.701   1.841
  344    H    LYS  47           H        LYS  47  -6.878   9.915  -0.201
  345    HA   LYS  47           HA       LYS  47  -9.057   8.161  -0.591
  346    HB2  LYS  47           2HB      LYS  47  -7.276   9.201  -2.262
  347    HB3  LYS  47           1HB      LYS  47  -6.469   7.665  -1.983
  348    HG2  LYS  47           2HG      LYS  47  -7.809   6.672  -3.433
  349    HG3  LYS  47           1HG      LYS  47  -9.223   7.160  -2.498
  350    HD2  LYS  47           2HD      LYS  47  -9.685   8.909  -3.859
  351    HD3  LYS  47           1HD      LYS  47  -7.982   9.261  -4.161
  352    HE2  LYS  47           2HE      LYS  47  -7.880   7.892  -5.964
  353    HE3  LYS  47           1HE      LYS  47  -9.015   6.729  -5.281
  354    HZ1  LYS  47           3HZ      LYS  47  -9.765   9.367  -6.425
  355    HZ2  LYS  47           1HZ      LYS  47 -10.832   8.191  -5.838
  356    HZ3  LYS  47           2HZ      LYS  47  -9.913   7.884  -7.225
  357    H    LEU  48           H        LEU  48  -5.747   7.615   0.624
  358    HA   LEU  48           HA       LEU  48  -6.292   4.776   0.936
  359    HG   LEU  48           HG       LEU  48  -4.547   3.431   0.725
  360    HB2  LEU  48           2HB      LEU  48  -4.029   6.010   0.253
  361    HB3  LEU  48           1HB      LEU  48  -3.801   6.014   1.992
  362   HD11  LEU  48          1HD1      LEU  48  -2.234   2.957   0.126
  363   HD12  LEU  48          2HD1      LEU  48  -1.778   4.609   0.546
  364   HD13  LEU  48          3HD1      LEU  48  -2.864   4.312  -0.813
  365   HD21  LEU  48          3HD2      LEU  48  -2.507   4.078   2.838
  366   HD22  LEU  48          1HD2      LEU  48  -3.230   2.513   2.465
  367   HD23  LEU  48          2HD2      LEU  48  -4.212   3.787   3.182
  368    H    GLN  49           H        GLN  49  -7.004   3.875   2.737
  369    HA   GLN  49           HA       GLN  49  -6.688   5.292   5.292
  370    HB2  GLN  49           2HB      GLN  49  -8.922   4.565   5.957
  371    HB3  GLN  49           1HB      GLN  49  -8.998   5.554   4.509
  372    HG2  GLN  49           2HG      GLN  49  -8.921   2.576   4.283
  373    HG3  GLN  49           1HG      GLN  49 -10.425   3.398   4.688
  374   HE21  GLN  49          1HE2      GLN  49  -8.457   2.334   2.205
  375   HE22  GLN  49          2HE2      GLN  49  -9.183   3.206   0.903
  376    H    ILE  50           H        ILE  50  -6.161   4.026   7.051
  377    HA   ILE  50           HA       ILE  50  -4.736   1.707   6.739
  378    HB   ILE  50           HB       ILE  50  -5.212   1.227   9.173
  379   HG12  ILE  50          2HG1      ILE  50  -6.306   3.767   9.859
  380   HG13  ILE  50          1HG1      ILE  50  -7.374   3.034   8.666
  381   HG21  ILE  50          1HG2      ILE  50  -4.319   4.020   8.475
  382   HG22  ILE  50          2HG2      ILE  50  -3.314   2.571   8.431
  383   HG23  ILE  50          3HG2      ILE  50  -3.953   3.154   9.968
  384   HD11  ILE  50          3HD1      ILE  50  -6.985   2.386  11.456
  385   HD12  ILE  50          1HD1      ILE  50  -6.837   0.970  10.414
  386   HD13  ILE  50          2HD1      ILE  50  -8.300   1.954  10.364
  387    H    GLY  51           H        GLY  51  -5.215  -0.308   6.161
  388    HA2  GLY  51           2HA      GLY  51  -6.551  -2.307   6.784
  389    HA3  GLY  51           1HA      GLY  51  -7.969  -1.291   6.614
  390    H    ASP  52           H        ASP  52  -6.476  -0.052   4.144
  391    HA   ASP  52           HA       ASP  52  -7.753  -1.721   2.246
  392    HB2  ASP  52           2HB      ASP  52  -6.515  -0.215   0.574
  393    HB3  ASP  52           1HB      ASP  52  -7.691   0.543   1.636
  394    H    LYS  53           H        LYS  53  -6.593  -2.631   0.318
  395    HA   LYS  53           HA       LYS  53  -4.041  -3.822   1.181
  396    HB2  LYS  53           2HB      LYS  53  -4.618  -5.685  -0.424
  397    HB3  LYS  53           1HB      LYS  53  -5.620  -5.579   1.013
  398    HG2  LYS  53           2HG      LYS  53  -6.737  -4.057  -1.174
  399    HG3  LYS  53           1HG      LYS  53  -6.485  -5.750  -1.605
  400    HD2  LYS  53           2HD      LYS  53  -7.551  -5.881   0.941
  401    HD3  LYS  53           1HD      LYS  53  -8.435  -4.550   0.192
  402    HE2  LYS  53           2HE      LYS  53  -9.694  -6.463  -0.311
  403    HE3  LYS  53           1HE      LYS  53  -8.797  -6.114  -1.786
  404    HZ1  LYS  53           3HZ      LYS  53  -8.621  -8.417  -1.428
  405    HZ2  LYS  53           1HZ      LYS  53  -8.254  -8.232   0.213
  406    HZ3  LYS  53           2HZ      LYS  53  -7.124  -7.784  -0.962
  407    H    LEU  54           H        LEU  54  -2.431  -4.030  -0.262
  408    HA   LEU  54           HA       LEU  54  -2.526  -2.134  -2.489
  409    HG   LEU  54           HG       LEU  54  -1.171  -0.501  -1.388
  410    HB2  LEU  54           2HB      LEU  54  -0.557  -2.801  -0.555
  411    HB3  LEU  54           1HB      LEU  54   0.109  -3.124  -2.144
  412   HD11  LEU  54          1HD1      LEU  54   1.146  -1.451  -0.284
  413   HD12  LEU  54          2HD1      LEU  54   0.720   0.249  -0.471
  414   HD13  LEU  54          3HD1      LEU  54   1.731  -0.543  -1.679
  415   HD21  LEU  54          3HD2      LEU  54   0.119  -1.614  -3.796
  416   HD22  LEU  54          1HD2      LEU  54   0.563   0.037  -3.364
  417   HD23  LEU  54          2HD2      LEU  54  -1.128  -0.375  -3.638
  418    H    LEU  55           H        LEU  55  -3.207  -2.990  -4.296
  419    HA   LEU  55           HA       LEU  55  -2.844  -5.689  -5.078
  420    HG   LEU  55           HG       LEU  55  -4.681  -6.224  -6.438
  421    HB2  LEU  55           2HB      LEU  55  -4.529  -3.751  -5.856
  422    HB3  LEU  55           1HB      LEU  55  -3.348  -3.615  -7.143
  423   HD11  LEU  55          1HD1      LEU  55  -6.397  -5.831  -7.922
  424   HD12  LEU  55          2HD1      LEU  55  -5.521  -4.553  -8.764
  425   HD13  LEU  55          3HD1      LEU  55  -6.212  -4.246  -7.170
  426   HD21  LEU  55          3HD2      LEU  55  -2.744  -6.630  -7.698
  427   HD22  LEU  55          1HD2      LEU  55  -3.022  -5.232  -8.738
  428   HD23  LEU  55          2HD2      LEU  55  -4.058  -6.652  -8.874
  429    H    ALA  56           H        ALA  56  -1.323  -2.628  -6.189
  430    HA   ALA  56           HA       ALA  56   1.133  -4.091  -6.746
  431    HB1  ALA  56           3HB      ALA  56   0.078  -4.516  -8.836
  432    HB2  ALA  56           1HB      ALA  56   1.205  -3.188  -9.129
  433    HB3  ALA  56           2HB      ALA  56  -0.519  -2.860  -8.953
  434    H    VAL  57           H        VAL  57   2.959  -2.694  -7.261
  435    HA   VAL  57           HA       VAL  57   2.541   0.179  -6.838
  436    HB   VAL  57           HB       VAL  57   4.449  -1.486  -5.185
  437   HG11  VAL  57          1HG1      VAL  57   4.196   1.481  -5.555
  438   HG12  VAL  57          2HG1      VAL  57   5.643   0.475  -5.614
  439   HG13  VAL  57          3HG1      VAL  57   4.853   0.793  -4.070
  440   HG21  VAL  57          3HG2      VAL  57   2.025   0.146  -4.450
  441   HG22  VAL  57          1HG2      VAL  57   3.156  -0.543  -3.286
  442   HG23  VAL  57          2HG2      VAL  57   2.208  -1.604  -4.327
  443    H    ASN  58           H        ASN  58   3.507   1.178  -8.476
  444    HA   ASN  58           HA       ASN  58   5.000   1.765 -10.082
  445    HB2  ASN  58           2HB      ASN  58   6.913   0.136  -8.394
  446    HB3  ASN  58           1HB      ASN  58   7.396   1.161  -9.741
  447   HD21  ASN  58          1HD2      ASN  58   7.625   1.118  -6.626
  448   HD22  ASN  58          2HD2      ASN  58   7.343   2.771  -6.213
  449    H    ASN  59           H        ASN  59   3.327  -0.436 -10.573
  450    HA   ASN  59           HA       ASN  59   2.992  -1.768 -12.417
  451    HB2  ASN  59           2HB      ASN  59   5.267  -0.621 -13.222
  452    HB3  ASN  59           1HB      ASN  59   5.870  -2.256 -12.967
  453   HD21  ASN  59          1HD2      ASN  59   5.125  -3.926 -14.271
  454   HD22  ASN  59          2HD2      ASN  59   4.260  -3.636 -15.737
  455    H    VAL  60           H        VAL  60   4.993  -2.567  -9.735
  456    HA   VAL  60           HA       VAL  60   4.938  -5.424 -10.347
  457    HB   VAL  60           HB       VAL  60   6.280  -5.776  -8.392
  458   HG11  VAL  60          1HG1      VAL  60   7.923  -3.583  -9.013
  459   HG12  VAL  60          2HG1      VAL  60   7.066  -4.003 -10.496
  460   HG13  VAL  60          3HG1      VAL  60   8.018  -5.224  -9.651
  461   HG21  VAL  60          3HG2      VAL  60   6.776  -3.094  -7.504
  462   HG22  VAL  60          1HG2      VAL  60   6.230  -4.496  -6.584
  463   HG23  VAL  60          2HG2      VAL  60   5.056  -3.463  -7.397
  464    H    CYS  61           H        CYS  61   3.826  -6.969  -9.068
  465    HA   CYS  61           HA       CYS  61   1.434  -5.911  -7.832
  466    HG   CYS  61           HG       CYS  61   3.562  -9.099  -7.914
  467    HB2  CYS  61           2HB      CYS  61   0.713  -8.229  -7.633
  468    HB3  CYS  61           1HB      CYS  61   1.258  -7.878  -9.267
  469    H    LEU  62           H        LEU  62   1.007  -5.737  -5.733
  470    HA   LEU  62           HA       LEU  62   3.093  -6.535  -3.847
  471    HG   LEU  62           HG       LEU  62   3.565  -5.023  -2.073
  472    HB2  LEU  62           2HB      LEU  62   1.668  -4.141  -4.237
  473    HB3  LEU  62           1HB      LEU  62   1.094  -4.802  -2.723
  474   HD11  LEU  62          1HD1      LEU  62   4.927  -3.197  -3.276
  475   HD12  LEU  62          2HD1      LEU  62   3.761  -3.407  -4.582
  476   HD13  LEU  62          3HD1      LEU  62   4.745  -4.770  -4.050
  477   HD21  LEU  62          3HD2      LEU  62   3.590  -2.880  -1.135
  478   HD22  LEU  62          1HD2      LEU  62   1.878  -3.259  -1.320
  479   HD23  LEU  62          2HD2      LEU  62   2.671  -2.189  -2.471
  480    H    GLU  63           H        GLU  63   0.953  -8.322  -4.923
  481    HA   GLU  63           HA       GLU  63  -0.368  -8.975  -2.374
  482    HB2  GLU  63           2HB      GLU  63  -2.014 -10.241  -3.947
  483    HB3  GLU  63           1HB      GLU  63  -2.167  -8.506  -3.730
  484    HG2  GLU  63           2HG      GLU  63  -2.343  -8.584  -5.977
  485    HG3  GLU  63           1HG      GLU  63  -0.590  -8.484  -5.866
  486    H    GLU  64           H        GLU  64   1.804 -10.126  -4.779
  487    HA   GLU  64           HA       GLU  64   1.720 -12.798  -3.550
  488    HB2  GLU  64           2HB      GLU  64   1.500 -12.056  -6.310
  489    HB3  GLU  64           1HB      GLU  64   2.930 -13.042  -6.077
  490    HG2  GLU  64           2HG      GLU  64   1.401 -14.671  -6.470
  491    HG3  GLU  64           1HG      GLU  64   1.252 -14.548  -4.718
  492    H    VAL  65           H        VAL  65   3.270 -10.647  -2.557
  493    HA   VAL  65           HA       VAL  65   5.968 -11.724  -3.022
  494    HB   VAL  65           HB       VAL  65   6.877  -9.389  -2.750
  495   HG11  VAL  65          1HG1      VAL  65   5.180  -9.807  -5.209
  496   HG12  VAL  65          2HG1      VAL  65   6.731 -10.595  -4.920
  497   HG13  VAL  65          3HG1      VAL  65   6.650  -8.840  -5.080
  498   HG21  VAL  65          3HG2      VAL  65   4.885  -8.326  -1.829
  499   HG22  VAL  65          1HG2      VAL  65   4.016  -8.618  -3.336
  500   HG23  VAL  65          2HG2      VAL  65   5.395  -7.518  -3.311
  501    H    THR  66           H        THR  66   7.507 -11.238  -1.323
  502    HA   THR  66           HA       THR  66   6.393 -11.656   1.276
  503    HB   THR  66           HB       THR  66   8.784 -11.515   2.033
  504    HG1  THR  66           1HG      THR  66   9.823 -10.228   0.664
  505   HG21  THR  66          3HG2      THR  66   7.871 -13.664   1.286
  506   HG22  THR  66          1HG2      THR  66   9.589 -13.497   0.928
  507   HG23  THR  66          2HG2      THR  66   8.397 -13.301  -0.357
  508    H    HIS  67           H        HIS  67   7.164 -10.295   3.181
  509    HA   HIS  67           HA       HIS  67   6.098  -7.736   2.945
  510    HD1  HIS  67           1HD      HIS  67   4.917  -6.978   6.013
  511    HD2  HIS  67           2HD      HIS  67   8.780  -5.772   5.121
  512    HE1  HIS  67           1HE      HIS  67   5.048  -4.572   6.701
  513    HE2  HIS  67           2HE      HIS  67   7.326  -3.821   5.967
  514    HB2  HIS  67           2HB      HIS  67   6.294  -8.842   5.131
  515    HB3  HIS  67           1HB      HIS  67   8.038  -8.614   5.103
  516    H    GLU  68           H        GLU  68   9.476  -8.753   2.676
  517    HA   GLU  68           HA       GLU  68  10.758  -6.317   2.690
  518    HB2  GLU  68           2HB      GLU  68  11.348  -8.670   0.881
  519    HB3  GLU  68           1HB      GLU  68  12.456  -7.348   1.219
  520    HG2  GLU  68           2HG      GLU  68  11.439  -9.416   3.152
  521    HG3  GLU  68           1HG      GLU  68  13.082  -9.228   2.546
  522    H    GLU  69           H        GLU  69   9.182  -7.908  -0.075
  523    HA   GLU  69           HA       GLU  69   9.767  -5.920  -1.986
  524    HB2  GLU  69           2HB      GLU  69   7.474  -7.886  -1.888
  525    HB3  GLU  69           1HB      GLU  69   7.915  -6.931  -3.295
  526    HG2  GLU  69           2HG      GLU  69   9.544  -9.084  -1.969
  527    HG3  GLU  69           1HG      GLU  69   8.791  -9.134  -3.562
  528    H    ALA  70           H        ALA  70   7.135  -6.259   0.335
  529    HA   ALA  70           HA       ALA  70   5.367  -4.311  -0.643
  530    HB1  ALA  70           3HB      ALA  70   5.872  -4.922   2.266
  531    HB2  ALA  70           1HB      ALA  70   4.925  -5.957   1.200
  532    HB3  ALA  70           2HB      ALA  70   4.393  -4.310   1.533
  533    H    VAL  71           H        VAL  71   8.158  -4.042   1.513
  534    HA   VAL  71           HA       VAL  71   7.821  -1.190   1.867
  535    HB   VAL  71           HB       VAL  71   9.984  -3.106   2.752
  536   HG11  VAL  71          1HG1      VAL  71  11.234  -1.164   2.473
  537   HG12  VAL  71          2HG1      VAL  71  10.725  -1.070   4.159
  538   HG13  VAL  71          3HG1      VAL  71   9.892  -0.115   2.932
  539   HG21  VAL  71          3HG2      VAL  71   9.137  -2.388   5.017
  540   HG22  VAL  71          1HG2      VAL  71   8.018  -3.349   4.053
  541   HG23  VAL  71          2HG2      VAL  71   7.799  -1.605   4.176
  542    H    THR  72           H        THR  72   9.792  -3.343  -0.096
  543    HA   THR  72           HA       THR  72  11.663  -1.458  -1.013
  544    HB   THR  72           HB       THR  72  10.638  -3.999  -2.288
  545    HG1  THR  72           1HG      THR  72  11.912  -4.871  -0.892
  546   HG21  THR  72          3HG2      THR  72  13.007  -2.310  -3.052
  547   HG22  THR  72          1HG2      THR  72  11.631  -2.750  -4.063
  548   HG23  THR  72          2HG2      THR  72  12.780  -3.987  -3.553
  549    H    ALA  73           H        ALA  73   8.438  -2.325  -2.188
  550    HA   ALA  73           HA       ALA  73   8.649  -0.735  -4.561
  551    HB1  ALA  73           3HB      ALA  73   7.192  -2.848  -4.098
  552    HB2  ALA  73           1HB      ALA  73   6.584  -1.561  -5.138
  553    HB3  ALA  73           2HB      ALA  73   6.039  -1.673  -3.465
  554    H    LEU  74           H        LEU  74   7.260  -0.328  -1.314
  555    HA   LEU  74           HA       LEU  74   5.904   2.115  -1.941
  556    HG   LEU  74           HG       LEU  74   4.495   0.196   0.955
  557    HB2  LEU  74           2HB      LEU  74   6.683   0.734   0.616
  558    HB3  LEU  74           1HB      LEU  74   5.966   2.331   0.630
  559   HD11  LEU  74          1HD1      LEU  74   2.580   1.392   0.095
  560   HD12  LEU  74          2HD1      LEU  74   3.629   2.417  -0.885
  561   HD13  LEU  74          3HD1      LEU  74   3.693   2.515   0.874
  562   HD21  LEU  74          3HD2      LEU  74   3.613  -0.803  -0.970
  563   HD22  LEU  74          1HD2      LEU  74   5.353  -0.760  -1.241
  564   HD23  LEU  74          2HD2      LEU  74   4.309   0.422  -2.030
  565    H    LYS  75           H        LYS  75   9.097   1.194  -0.890
  566    HA   LYS  75           HA       LYS  75   9.858   3.922  -0.228
  567    HB2  LYS  75           2HB      LYS  75  11.855   3.069   0.596
  568    HB3  LYS  75           1HB      LYS  75  10.711   1.776   0.918
  569    HG2  LYS  75           2HG      LYS  75  11.530   0.838  -1.363
  570    HG3  LYS  75           1HG      LYS  75  12.915   1.896  -1.090
  571    HD2  LYS  75           2HD      LYS  75  11.928  -0.248   0.793
  572    HD3  LYS  75           1HD      LYS  75  13.336  -0.371  -0.261
  573    HE2  LYS  75           2HE      LYS  75  13.514   2.020   1.309
  574    HE3  LYS  75           1HE      LYS  75  13.212   0.641   2.365
  575    HZ1  LYS  75           3HZ      LYS  75  15.107  -0.486   1.374
  576    HZ2  LYS  75           1HZ      LYS  75  15.576   1.001   2.033
  577    HZ3  LYS  75           2HZ      LYS  75  15.395   0.836   0.359
  578    H    ASN  76           H        ASN  76   9.915   1.910  -3.034
  579    HA   ASN  76           HA       ASN  76  12.084   3.246  -4.354
  580    HB2  ASN  76           2HB      ASN  76  11.347   0.887  -4.830
  581    HB3  ASN  76           1HB      ASN  76   9.921   1.552  -5.620
  582   HD21  ASN  76          1HD2      ASN  76  10.067   1.837  -7.729
  583   HD22  ASN  76          2HD2      ASN  76  11.529   2.007  -8.633
  584    H    THR  77           H        THR  77  11.034   5.414  -3.748
  585    HA   THR  77           HA       THR  77   9.413   6.320  -6.036
  586    HB   THR  77           HB       THR  77   8.304   7.944  -4.500
  587    HG1  THR  77           1HG      THR  77   9.457   6.377  -2.434
  588   HG21  THR  77          3HG2      THR  77   7.876   5.147  -3.502
  589   HG22  THR  77          1HG2      THR  77   7.270   5.724  -5.054
  590   HG23  THR  77          2HG2      THR  77   6.721   6.478  -3.558
  591    H    SER  78           H        SER  78   9.813   8.417  -6.801
  592    HA   SER  78           HA       SER  78  12.121   9.827  -5.653
  593    HG   SER  78           HG       SER  78  13.782   8.107  -7.201
  594    HB2  SER  78           2HB      SER  78  11.977   8.536  -8.272
  595    HB3  SER  78           1HB      SER  78  12.420  10.239  -8.376
  596    H    ASP  79           H        ASP  79  10.132  10.321  -8.578
  597    HA   ASP  79           HA       ASP  79   9.543  13.035  -7.636
  598    HB2  ASP  79           2HB      ASP  79   9.442  11.740 -10.359
  599    HB3  ASP  79           1HB      ASP  79   8.704  13.308 -10.046
  600    H    PHE  80           H        PHE  80   7.858  10.364  -9.297
  601    HA   PHE  80           HA       PHE  80   5.431  11.041  -7.772
  602    HD1  PHE  80           1HD      PHE  80   5.427  13.408  -9.797
  603    HD2  PHE  80           2HD      PHE  80   2.435  10.386  -9.639
  604    HE1  PHE  80           1HE      PHE  80   3.698  15.139  -9.567
  605    HE2  PHE  80           2HE      PHE  80   0.698  12.116  -9.406
  606    HZ   PHE  80           HZ       PHE  80   1.332  14.497  -9.368
  607    HB2  PHE  80           2HB      PHE  80   5.804  11.051 -10.630
  608    HB3  PHE  80           1HB      PHE  80   4.632   9.812 -10.191
  609    H    VAL  81           H        VAL  81   3.890   9.166  -7.598
  610    HA   VAL  81           HA       VAL  81   5.164   6.557  -7.894
  611    HB   VAL  81           HB       VAL  81   5.733   7.197  -5.614
  612   HG11  VAL  81          1HG1      VAL  81   3.690   8.754  -5.430
  613   HG12  VAL  81          2HG1      VAL  81   4.228   7.897  -3.987
  614   HG13  VAL  81          3HG1      VAL  81   2.829   7.313  -4.887
  615   HG21  VAL  81          3HG2      VAL  81   5.199   4.847  -6.091
  616   HG22  VAL  81          1HG2      VAL  81   3.521   5.145  -5.635
  617   HG23  VAL  81          2HG2      VAL  81   4.802   5.292  -4.432
  618    H    TYR  82           H        TYR  82   3.754   5.264  -8.916
  619    HA   TYR  82           HA       TYR  82   0.902   5.916  -8.744
  620    HD1  TYR  82           1HD      TYR  82  -0.216   2.879 -10.581
  621    HD2  TYR  82           2HD      TYR  82   0.412   6.932 -11.708
  622    HE1  TYR  82           1HE      TYR  82  -2.445   2.935 -11.596
  623    HE2  TYR  82           2HE      TYR  82  -1.823   7.001 -12.725
  624    HH   TYR  82           HH       TYR  82  -4.038   5.717 -12.403
  625    HB2  TYR  82           2HB      TYR  82   2.241   5.580 -10.958
  626    HB3  TYR  82           1HB      TYR  82   2.029   3.867 -10.620
  627    H    LEU  83           H        LEU  83   0.188   5.017  -6.929
  628    HA   LEU  83           HA       LEU  83   0.871   2.293  -6.211
  629    HG   LEU  83           HG       LEU  83  -0.210   1.529  -4.151
  630    HB2  LEU  83           2HB      LEU  83   0.599   4.303  -4.626
  631    HB3  LEU  83           1HB      LEU  83  -1.124   4.035  -4.801
  632   HD11  LEU  83          1HD1      LEU  83   2.032   2.495  -3.698
  633   HD12  LEU  83          2HD1      LEU  83   1.287   1.745  -2.287
  634   HD13  LEU  83          3HD1      LEU  83   1.302   3.501  -2.446
  635   HD21  LEU  83          3HD2      LEU  83  -1.701   1.766  -2.500
  636   HD22  LEU  83          1HD2      LEU  83  -2.009   3.349  -3.213
  637   HD23  LEU  83          2HD2      LEU  83  -0.899   3.196  -1.851
  638    H    LYS  84           H        LYS  84  -0.454   0.546  -6.222
  639    HA   LYS  84           HA       LYS  84  -3.117   0.881  -7.426
  640    HB2  LYS  84           2HB      LYS  84  -1.076  -1.282  -7.867
  641    HB3  LYS  84           1HB      LYS  84  -2.771  -1.502  -8.268
  642    HG2  LYS  84           2HG      LYS  84  -1.991   0.940  -9.425
  643    HG3  LYS  84           1HG      LYS  84  -0.709  -0.221  -9.772
  644    HD2  LYS  84           2HD      LYS  84  -2.163  -0.527 -11.552
  645    HD3  LYS  84           1HD      LYS  84  -2.652  -1.802 -10.435
  646    HE2  LYS  84           2HE      LYS  84  -4.715  -0.985 -10.387
  647    HE3  LYS  84           1HE      LYS  84  -4.104   0.553  -9.782
  648    HZ1  LYS  84           3HZ      LYS  84  -4.244  -0.193 -12.654
  649    HZ2  LYS  84           1HZ      LYS  84  -3.789   1.312 -12.025
  650    HZ3  LYS  84           2HZ      LYS  84  -5.381   0.770 -11.853
  651    H    VAL  85           H        VAL  85  -4.605   0.613  -5.909
  652    HA   VAL  85           HA       VAL  85  -4.114  -1.347  -3.777
  653    HB   VAL  85           HB       VAL  85  -6.115   0.927  -3.899
  654   HG11  VAL  85          1HG1      VAL  85  -5.501  -0.494  -1.364
  655   HG12  VAL  85          2HG1      VAL  85  -6.587  -1.279  -2.510
  656   HG13  VAL  85          3HG1      VAL  85  -6.979   0.319  -1.879
  657   HG21  VAL  85          3HG2      VAL  85  -3.427   0.619  -2.636
  658   HG22  VAL  85          1HG2      VAL  85  -4.634   1.671  -1.894
  659   HG23  VAL  85          2HG2      VAL  85  -4.091   1.976  -3.545
  660    H    ALA  86           H        ALA  86  -5.415  -3.093  -3.493
  661    HA   ALA  86           HA       ALA  86  -7.323  -3.694  -5.605
  662    HB1  ALA  86           3HB      ALA  86  -6.888  -5.861  -5.206
  663    HB2  ALA  86           1HB      ALA  86  -6.976  -5.663  -3.456
  664    HB3  ALA  86           2HB      ALA  86  -5.497  -5.239  -4.318
  665    H    LYS  87           H        LYS  87  -9.498  -4.143  -5.307
  666    HA   LYS  87           HA       LYS  87 -10.627  -3.214  -2.750
  667    HB2  LYS  87           2HB      LYS  87 -11.187  -1.868  -4.775
  668    HB3  LYS  87           1HB      LYS  87 -11.975  -3.284  -5.454
  669    HG2  LYS  87           2HG      LYS  87 -13.782  -3.106  -4.099
  670    HG3  LYS  87           1HG      LYS  87 -12.850  -2.432  -2.760
  671    HD2  LYS  87           2HD      LYS  87 -12.625  -0.333  -4.193
  672    HD3  LYS  87           1HD      LYS  87 -13.889  -1.029  -5.208
  673    HE2  LYS  87           2HE      LYS  87 -15.079   0.317  -3.737
  674    HE3  LYS  87           1HE      LYS  87 -15.209  -1.281  -3.007
  675    HZ1  LYS  87           3HZ      LYS  87 -14.334   0.989  -1.772
  676    HZ2  LYS  87           1HZ      LYS  87 -12.903   0.144  -2.091
  677    HZ3  LYS  87           2HZ      LYS  87 -14.140  -0.590  -1.200
  678    HA   PRO  88           HA       PRO  88 -11.905  -7.488  -2.284
  679    HB2  PRO  88           2HB      PRO  88 -13.175  -7.184   0.090
  680    HB3  PRO  88           1HB      PRO  88 -11.414  -7.244  -0.051
  681    HG2  PRO  88           2HG      PRO  88 -13.214  -4.868   0.225
  682    HG3  PRO  88           1HG      PRO  88 -11.662  -5.196   1.018
  683    HD2  PRO  88           2HD      PRO  88 -11.903  -3.554  -1.132
  684    HD3  PRO  88           1HD      PRO  88 -10.441  -4.506  -0.807
  685    H    THR  89           H        THR  89 -13.776  -8.662  -2.596
  686    HA   THR  89           HA       THR  89 -16.338  -7.257  -2.624
  687    HB   THR  89           HB       THR  89 -15.370  -8.878  -4.988
  688    HG1  THR  89           1HG      THR  89 -15.609  -6.070  -4.667
  689   HG21  THR  89          3HG2      THR  89 -17.796  -8.917  -4.737
  690   HG22  THR  89          1HG2      THR  89 -17.301  -7.994  -6.156
  691   HG23  THR  89          2HG2      THR  89 -17.819  -7.155  -4.694
  692    H    GLY  90           H        GLY  90 -15.219 -10.438  -3.827
  693    HA2  GLY  90           2HA      GLY  90 -15.539 -12.529  -2.803
  694    HA3  GLY  90           1HA      GLY  90 -16.586 -11.767  -1.616
  695    H    SER  91           H        SER  91 -16.684 -14.046  -3.814
  696    HA   SER  91           HA       SER  91 -19.158 -13.264  -5.152
  697    HG   SER  91           HG       SER  91 -19.243 -14.877  -7.413
  698    HB2  SER  91           2HB      SER  91 -16.987 -15.011  -5.793
  699    HB3  SER  91           1HB      SER  91 -18.470 -15.964  -5.747
  700    H    HIS  92           H        HIS  92 -17.964 -15.732  -2.895
  701    HA   HIS  92           HA       HIS  92 -20.403 -17.115  -2.584
  702    HD1  HIS  92           1HD      HIS  92 -16.169 -16.650  -1.820
  703    HD2  HIS  92           2HD      HIS  92 -18.582 -16.354   1.550
  704    HE1  HIS  92           1HE      HIS  92 -14.780 -15.453  -0.102
  705    HE2  HIS  92           2HE      HIS  92 -16.302 -15.182   1.887
  706    HB2  HIS  92           2HB      HIS  92 -19.384 -18.052  -0.535
  707    HB3  HIS  92           1HB      HIS  92 -18.291 -18.122  -1.913
  708    HA   ARG 301           HA       ARG 301   2.354 -10.938  10.571
  709    HE   ARG 301           HE       ARG 301  -0.521 -14.003  12.608
  710    H1   ARG 301           1HT      ARG 301   3.374 -12.304  12.964
  711    H2   ARG 301           2HT      ARG 301   4.149 -12.391  11.435
  712    H3   ARG 301           3HT      ARG 301   2.545 -12.970  11.618
  713    HB2  ARG 301           2HB      ARG 301   1.962 -10.205  13.465
  714    HB3  ARG 301           1HB      ARG 301   0.970  -9.775  12.081
  715    HG2  ARG 301           2HG      ARG 301   1.204 -12.550  13.231
  716    HG3  ARG 301           1HG      ARG 301  -0.097 -11.413  13.582
  717    HD2  ARG 301           2HD      ARG 301  -0.985 -11.568  11.452
  718    HD3  ARG 301           1HD      ARG 301   0.535 -12.116  10.748
  719   HH11  ARG 301          1HH1      ARG 301  -0.841 -12.844   9.323
  720   HH12  ARG 301          2HH1      ARG 301  -1.455 -14.346   8.720
  721   HH21  ARG 301          1HH2      ARG 301  -1.330 -15.981  11.812
  722   HH22  ARG 301          2HH2      ARG 301  -1.734 -16.128  10.135
  723    H    ARG 302           H        ARG 302   3.396  -9.180   9.860
  724    HA   ARG 302           HA       ARG 302   5.177  -7.708  11.641
  725    HE   ARG 302           HE       ARG 302   8.990  -9.680  10.098
  726    HB2  ARG 302           2HB      ARG 302   6.545  -9.463  10.482
  727    HB3  ARG 302           1HB      ARG 302   6.126  -8.705   8.953
  728    HG2  ARG 302           2HG      ARG 302   7.115  -6.564  10.018
  729    HG3  ARG 302           1HG      ARG 302   7.877  -7.684  11.147
  730    HD2  ARG 302           2HD      ARG 302   8.150  -7.702   8.144
  731    HD3  ARG 302           1HD      ARG 302   9.373  -7.181   9.300
  732   HH11  ARG 302          1HH1      ARG 302   9.369  -8.417   6.851
  733   HH12  ARG 302          2HH1      ARG 302  10.070  -9.876   6.237
  734   HH21  ARG 302          1HH2      ARG 302   9.915 -11.593   9.282
  735   HH22  ARG 302          2HH2      ARG 302  10.380 -11.679   7.617
  736    H    GLU 303           H        GLU 303   4.727  -5.628  11.451
  737    HA   GLU 303           HA       GLU 303   3.916  -4.590   8.822
  738    HB2  GLU 303           2HB      GLU 303   2.701  -2.895  10.655
  739    HB3  GLU 303           1HB      GLU 303   1.903  -4.097   9.658
  740    HG2  GLU 303           2HG      GLU 303   3.059  -4.955  12.259
  741    HG3  GLU 303           1HG      GLU 303   1.572  -4.014  12.261
  742    H    THR 304           H        THR 304   5.810  -3.682   8.275
  743    HA   THR 304           HA       THR 304   7.251  -1.973  10.133
  744    HB   THR 304           HB       THR 304   7.832  -3.394   7.624
  745    HG1  THR 304           1HG      THR 304   9.020  -4.153   9.194
  746   HG21  THR 304          3HG2      THR 304   9.161  -0.745   8.127
  747   HG22  THR 304          1HG2      THR 304   8.191  -1.198   6.725
  748   HG23  THR 304          2HG2      THR 304   9.742  -1.985   7.016
  749    H    GLN 305           H        GLN 305   7.711   0.222   9.751
  750    HA   GLN 305           HA       GLN 305   5.631   1.625   8.299
  751    HB2  GLN 305           2HB      GLN 305   7.895   2.630  10.027
  752    HB3  GLN 305           1HB      GLN 305   6.711   3.670   9.245
  753    HG2  GLN 305           2HG      GLN 305   5.134   3.231  10.767
  754    HG3  GLN 305           1HG      GLN 305   5.542   1.518  10.846
  755   HE21  GLN 305          1HE2      GLN 305   7.259   0.858  12.225
  756   HE22  GLN 305          2HE2      GLN 305   7.729   1.830  13.573
  757    H    VAL 306           H        VAL 306   5.925   2.944   6.531
  758    HA   VAL 306           HA       VAL 306   8.586   2.861   5.266
  759    HB   VAL 306           HB       VAL 306   7.419   2.764   3.057
  760   HG11  VAL 306          1HG1      VAL 306   8.417   0.785   4.180
  761   HG12  VAL 306          2HG1      VAL 306   7.084   0.394   3.092
  762   HG13  VAL 306          3HG1      VAL 306   6.822   0.411   4.836
  763   HG21  VAL 306          3HG2      VAL 306   5.082   1.836   3.100
  764   HG22  VAL 306          1HG2      VAL 306   5.232   3.529   3.573
  765   HG23  VAL 306          2HG2      VAL 306   5.018   2.286   4.807
  Start of MODEL   24
    1    HA   MET   1           HA       MET   1  -9.088   3.997  -9.246
    2    H1   MET   1           1HT      MET   1  -8.670   1.191 -10.039
    3    H2   MET   1           2HT      MET   1  -8.784   2.537 -11.097
    4    H3   MET   1           3HT      MET   1 -10.136   2.074 -10.148
    5    HB2  MET   1           2HB      MET   1  -9.849   1.689  -7.948
    6    HB3  MET   1           1HB      MET   1  -8.263   2.000  -7.259
    7    HG2  MET   1           2HG      MET   1  -9.083   4.364  -6.829
    8    HG3  MET   1           1HG      MET   1 -10.694   3.752  -7.200
    9    HE1  MET   1           3HE      MET   1  -7.896   4.180  -4.837
   10    HE2  MET   1           1HE      MET   1  -7.551   2.451  -4.878
   11    HE3  MET   1           2HE      MET   1  -8.243   3.177  -3.428
   12    H    GLU   2           H        GLU   2  -7.277   5.121  -9.573
   13    HA   GLU   2           HA       GLU   2  -4.702   3.777  -9.091
   14    HB2  GLU   2           2HB      GLU   2  -3.715   5.260 -10.841
   15    HB3  GLU   2           1HB      GLU   2  -4.856   4.074 -11.456
   16    HG2  GLU   2           2HG      GLU   2  -6.579   5.981 -11.266
   17    HG3  GLU   2           1HG      GLU   2  -5.165   7.031 -11.193
   18    H    ILE   3           H        ILE   3  -3.800   4.550  -7.393
   19    HA   ILE   3           HA       ILE   3  -4.329   7.293  -6.510
   20    HB   ILE   3           HB       ILE   3  -2.907   5.062  -5.047
   21   HG12  ILE   3          2HG1      ILE   3  -5.625   6.150  -4.368
   22   HG13  ILE   3          1HG1      ILE   3  -5.451   4.893  -5.590
   23   HG21  ILE   3          1HG2      ILE   3  -3.698   7.842  -4.228
   24   HG22  ILE   3          2HG2      ILE   3  -2.110   7.082  -4.147
   25   HG23  ILE   3          3HG2      ILE   3  -3.392   6.564  -3.053
   26   HD11  ILE   3          3HD1      ILE   3  -3.964   4.056  -3.356
   27   HD12  ILE   3          1HD1      ILE   3  -5.469   3.385  -3.981
   28   HD13  ILE   3          2HD1      ILE   3  -5.511   4.651  -2.754
   29    H    LYS   4           H        LYS   4  -3.051   8.597  -7.752
   30    HA   LYS   4           HA       LYS   4  -0.207   8.022  -8.005
   31    HB2  LYS   4           2HB      LYS   4  -2.008  10.127  -9.196
   32    HB3  LYS   4           1HB      LYS   4  -0.260  10.192  -9.364
   33    HG2  LYS   4           2HG      LYS   4  -0.499   8.954 -11.187
   34    HG3  LYS   4           1HG      LYS   4  -0.901   7.608 -10.120
   35    HD2  LYS   4           2HD      LYS   4  -2.828   7.541 -11.273
   36    HD3  LYS   4           1HD      LYS   4  -3.287   8.921 -10.274
   37    HE2  LYS   4           2HE      LYS   4  -1.751   9.418 -12.778
   38    HE3  LYS   4           1HE      LYS   4  -3.460   9.007 -12.906
   39    HZ1  LYS   4           3HZ      LYS   4  -3.980  10.862 -11.446
   40    HZ2  LYS   4           1HZ      LYS   4  -3.132  11.395 -12.809
   41    HZ3  LYS   4           2HZ      LYS   4  -2.339  11.257 -11.322
   42    H    LEU   5           H        LEU   5   0.548   8.294  -5.970
   43    HA   LEU   5           HA       LEU   5   0.054  10.736  -4.509
   44    HG   LEU   5           HG       LEU   5  -0.959   8.590  -3.138
   45    HB2  LEU   5           2HB      LEU   5   1.331   8.138  -3.928
   46    HB3  LEU   5           1HB      LEU   5   1.915   9.513  -3.010
   47   HD11  LEU   5          1HD1      LEU   5   0.255   7.001  -1.878
   48   HD12  LEU   5          2HD1      LEU   5  -0.525   8.068  -0.709
   49   HD13  LEU   5          3HD1      LEU   5   1.193   8.255  -1.064
   50   HD21  LEU   5          3HD2      LEU   5   0.394  10.881  -1.746
   51   HD22  LEU   5          1HD2      LEU   5  -1.120  10.197  -1.155
   52   HD23  LEU   5          2HD2      LEU   5  -1.040  10.902  -2.769
   53    H    ILE   6           H        ILE   6   1.470  12.273  -3.913
   54    HA   ILE   6           HA       ILE   6   3.660  12.769  -5.739
   55    HB   ILE   6           HB       ILE   6   2.052  14.357  -3.827
   56   HG12  ILE   6          2HG1      ILE   6   3.212  15.808  -6.029
   57   HG13  ILE   6          1HG1      ILE   6   2.563  14.271  -6.584
   58   HG21  ILE   6          1HG2      ILE   6   4.880  15.230  -4.423
   59   HG22  ILE   6          2HG2      ILE   6   4.269  14.717  -2.849
   60   HG23  ILE   6          3HG2      ILE   6   3.641  16.181  -3.603
   61   HD11  ILE   6          3HD1      ILE   6   0.900  16.004  -6.775
   62   HD12  ILE   6          1HD1      ILE   6   1.066  16.386  -5.061
   63   HD13  ILE   6          2HD1      ILE   6   0.408  14.826  -5.557
   64    H    LYS   7           H        LYS   7   5.843  13.300  -5.017
   65    HA   LYS   7           HA       LYS   7   6.564  11.951  -2.499
   66    HB2  LYS   7           2HB      LYS   7   7.423  10.806  -4.480
   67    HB3  LYS   7           1HB      LYS   7   8.187  12.291  -5.023
   68    HG2  LYS   7           2HG      LYS   7   9.818  10.800  -4.041
   69    HG3  LYS   7           1HG      LYS   7   9.649  12.258  -3.062
   70    HD2  LYS   7           2HD      LYS   7   8.066  10.970  -1.598
   71    HD3  LYS   7           1HD      LYS   7   8.515   9.523  -2.501
   72    HE2  LYS   7           2HE      LYS   7  10.959  10.475  -1.883
   73    HE3  LYS   7           1HE      LYS   7  10.040  11.066  -0.499
   74    HZ1  LYS   7           3HZ      LYS   7   9.977   8.240  -1.392
   75    HZ2  LYS   7           1HZ      LYS   7   9.401   8.876   0.066
   76    HZ3  LYS   7           2HZ      LYS   7  11.065   8.815  -0.234
   77    H    GLY   8           H        GLY   8   7.259  13.228  -0.930
   78    HA2  GLY   8           2HA      GLY   8   8.628  15.747  -1.659
   79    HA3  GLY   8           1HA      GLY   8   7.460  15.661  -0.351
   80    HA   PRO   9           HA       PRO   9  11.773  15.359   1.464
   81    HB2  PRO   9           2HB      PRO   9  10.244  16.673   3.654
   82    HB3  PRO   9           1HB      PRO   9  11.846  17.053   3.013
   83    HG2  PRO   9           2HG      PRO   9   9.764  18.598   2.429
   84    HG3  PRO   9           1HG      PRO   9  10.988  18.225   1.200
   85    HD2  PRO   9           2HD      PRO   9   8.244  17.083   1.550
   86    HD3  PRO   9           1HD      PRO   9   9.103  17.519   0.058
   87    H    LYS  10           H        LYS  10   8.586  14.756   2.918
   88    HA   LYS  10           HA       LYS  10   9.614  12.904   4.864
   89    HB2  LYS  10           2HB      LYS  10   6.983  14.031   4.153
   90    HB3  LYS  10           1HB      LYS  10   6.935  12.385   4.769
   91    HG2  LYS  10           2HG      LYS  10   7.953  13.030   6.814
   92    HG3  LYS  10           1HG      LYS  10   8.334  14.635   6.188
   93    HD2  LYS  10           2HD      LYS  10   6.207  15.399   6.466
   94    HD3  LYS  10           1HD      LYS  10   5.483  13.818   6.166
   95    HE2  LYS  10           2HE      LYS  10   6.470  13.131   8.418
   96    HE3  LYS  10           1HE      LYS  10   6.745  14.850   8.692
   97    HZ1  LYS  10           3HZ      LYS  10   4.651  14.110   9.651
   98    HZ2  LYS  10           1HZ      LYS  10   4.109  13.597   8.132
   99    HZ3  LYS  10           2HZ      LYS  10   4.380  15.241   8.423
  100    H    GLY  11           H        GLY  11   7.404  12.515   2.084
  101    HA2  GLY  11           2HA      GLY  11   8.079  10.803   0.412
  102    HA3  GLY  11           1HA      GLY  11   8.446   9.764   1.779
  103    H    LEU  12           H        LEU  12   6.926   8.380   2.412
  104    HA   LEU  12           HA       LEU  12   4.311   8.503   1.153
  105    HG   LEU  12           HG       LEU  12   4.285   6.149   0.119
  106    HB2  LEU  12           2HB      LEU  12   5.817   6.434   2.704
  107    HB3  LEU  12           1HB      LEU  12   4.083   6.281   2.519
  108   HD11  LEU  12          1HD1      LEU  12   6.053   7.665  -0.350
  109   HD12  LEU  12          2HD1      LEU  12   6.572   6.078  -0.917
  110   HD13  LEU  12          3HD1      LEU  12   7.202   6.723   0.599
  111   HD21  LEU  12          3HD2      LEU  12   5.271   4.032  -0.062
  112   HD22  LEU  12          1HD2      LEU  12   4.741   4.138   1.615
  113   HD23  LEU  12          2HD2      LEU  12   6.441   4.371   1.212
  114    H    GLY  13           H        GLY  13   5.585   8.241   4.482
  115    HA2  GLY  13           2HA      GLY  13   4.791   9.245   6.408
  116    HA3  GLY  13           1HA      GLY  13   3.500   9.970   5.468
  117    H    PHE  14           H        PHE  14   4.215   6.506   5.667
  118    HA   PHE  14           HA       PHE  14   2.189   5.980   7.615
  119    HD1  PHE  14           2HD      PHE  14   2.084   3.100   4.716
  120    HD2  PHE  14           1HD      PHE  14   1.150   7.094   3.579
  121    HE1  PHE  14           2HE      PHE  14   2.557   2.538   2.370
  122    HE2  PHE  14           1HE      PHE  14   1.618   6.538   1.228
  123    HZ   PHE  14           HZ       PHE  14   2.324   4.259   0.621
  124    HB2  PHE  14           2HB      PHE  14   0.687   4.673   6.145
  125    HB3  PHE  14           1HB      PHE  14   0.696   6.383   5.747
  126    H    SER  15           H        SER  15   1.666   3.332   7.262
  127    HA   SER  15           HA       SER  15   4.262   2.058   6.864
  128    HG   SER  15           HG       SER  15   2.029   1.303  10.134
  129    HB2  SER  15           2HB      SER  15   3.517   0.554   8.836
  130    HB3  SER  15           1HB      SER  15   4.216   2.125   9.199
  131    H    ILE  16           H        ILE  16   3.915  -0.440   6.841
  132    HA   ILE  16           HA       ILE  16   1.306  -1.294   5.898
  133    HB   ILE  16           HB       ILE  16   1.831  -1.894   3.731
  134   HG12  ILE  16          2HG1      ILE  16   4.017  -2.968   4.266
  135   HG13  ILE  16          1HG1      ILE  16   3.984  -2.117   2.728
  136   HG21  ILE  16          1HG2      ILE  16   2.748   0.080   2.587
  137   HG22  ILE  16          2HG2      ILE  16   3.280   0.701   4.149
  138   HG23  ILE  16          3HG2      ILE  16   1.560   0.489   3.824
  139   HD11  ILE  16          3HD1      ILE  16   5.860  -1.860   4.732
  140   HD12  ILE  16          1HD1      ILE  16   4.868  -0.406   4.863
  141   HD13  ILE  16          2HD1      ILE  16   5.647  -0.806   3.331
  142    H    ALA  17           H        ALA  17   1.402  -3.621   5.204
  143    HA   ALA  17           HA       ALA  17   3.509  -5.188   6.505
  144    HB1  ALA  17           3HB      ALA  17   0.675  -5.068   7.252
  145    HB2  ALA  17           1HB      ALA  17   2.058  -5.687   8.155
  146    HB3  ALA  17           2HB      ALA  17   1.268  -6.705   6.952
  147    H    GLY  18           H        GLY  18   3.366  -7.569   5.603
  148    HA2  GLY  18           2HA      GLY  18   1.829  -8.294   3.461
  149    HA3  GLY  18           1HA      GLY  18   3.068  -7.298   2.734
  150    H    GLY  19           H        GLY  19   2.238 -10.417   2.986
  151    HA2  GLY  19           2HA      GLY  19   3.782 -12.006   2.055
  152    HA3  GLY  19           1HA      GLY  19   5.067 -11.227   2.959
  153    H    VAL  20           H        VAL  20   4.535 -14.001   2.932
  154    HA   VAL  20           HA       VAL  20   3.061 -14.846   5.190
  155    HB   VAL  20           HB       VAL  20   3.749 -16.343   3.309
  156   HG11  VAL  20          1HG1      VAL  20   6.427 -16.511   4.669
  157   HG12  VAL  20          2HG1      VAL  20   6.126 -15.498   3.257
  158   HG13  VAL  20          3HG1      VAL  20   5.928 -17.246   3.145
  159   HG21  VAL  20          3HG2      VAL  20   2.962 -17.165   5.540
  160   HG22  VAL  20          1HG2      VAL  20   4.654 -17.388   5.985
  161   HG23  VAL  20          2HG2      VAL  20   3.967 -18.305   4.644
  162    H    GLY  21           H        GLY  21   3.673 -15.267   7.306
  163    HA2  GLY  21           2HA      GLY  21   5.053 -15.334   9.189
  164    HA3  GLY  21           1HA      GLY  21   6.428 -14.962   8.162
  165    H    ASN  22           H        ASN  22   4.705 -12.622   7.122
  166    HA   ASN  22           HA       ASN  22   4.835 -10.801   9.405
  167    HB2  ASN  22           2HB      ASN  22   5.804  -9.136   7.556
  168    HB3  ASN  22           1HB      ASN  22   6.873 -10.109   8.544
  169   HD21  ASN  22          1HD2      ASN  22   5.044 -10.356   5.506
  170   HD22  ASN  22          2HD2      ASN  22   6.294 -11.170   4.635
  171    H    GLN  23           H        GLN  23   2.721 -12.120   7.678
  172    HA   GLN  23           HA       GLN  23   1.594 -10.186   5.973
  173    HB2  GLN  23           2HB      GLN  23  -0.497 -11.629   6.189
  174    HB3  GLN  23           1HB      GLN  23   0.945 -12.392   5.543
  175    HG2  GLN  23           2HG      GLN  23  -0.036 -13.942   7.014
  176    HG3  GLN  23           1HG      GLN  23   1.373 -13.299   7.849
  177   HE21  GLN  23          1HE2      GLN  23   0.870 -13.356   9.937
  178   HE22  GLN  23          2HE2      GLN  23  -0.565 -12.701  10.641
  179    H    HIS  24           H        HIS  24  -0.316  -9.011   6.159
  180    HA   HIS  24           HA       HIS  24  -0.666  -7.780   8.769
  181    HD1  HIS  24           1HD      HIS  24  -0.385  -4.961   8.863
  182    HD2  HIS  24           2HD      HIS  24  -4.082  -5.626   7.101
  183    HE1  HIS  24           1HE      HIS  24  -1.883  -3.191   9.782
  184    HE2  HIS  24           2HE      HIS  24  -4.105  -3.544   8.648
  185    HB2  HIS  24           2HB      HIS  24  -0.416  -6.450   6.637
  186    HB3  HIS  24           1HB      HIS  24  -1.998  -7.036   6.163
  187    H    ILE  25           H        ILE  25  -2.386  -9.941   6.657
  188    HA   ILE  25           HA       ILE  25  -4.474 -10.221   8.660
  189    HB   ILE  25           HB       ILE  25  -5.303  -9.770   5.798
  190   HG12  ILE  25          2HG1      ILE  25  -5.156  -7.774   8.064
  191   HG13  ILE  25          1HG1      ILE  25  -4.347  -7.677   6.503
  192   HG21  ILE  25          1HG2      ILE  25  -6.759 -11.061   7.414
  193   HG22  ILE  25          2HG2      ILE  25  -7.506  -9.663   6.642
  194   HG23  ILE  25          3HG2      ILE  25  -6.939  -9.552   8.308
  195   HD11  ILE  25          3HD1      ILE  25  -6.689  -7.617   5.497
  196   HD12  ILE  25          1HD1      ILE  25  -6.126  -6.182   6.351
  197   HD13  ILE  25          2HD1      ILE  25  -7.247  -7.292   7.138
  198    HA   PRO  26           HA       PRO  26  -3.737 -14.484   7.600
  199    HB2  PRO  26           2HB      PRO  26  -6.023 -15.484   8.777
  200    HB3  PRO  26           1HB      PRO  26  -4.526 -15.125   9.643
  201    HG2  PRO  26           2HG      PRO  26  -7.011 -13.481   9.389
  202    HG3  PRO  26           1HG      PRO  26  -5.985 -13.751  10.810
  203    HD2  PRO  26           2HD      PRO  26  -5.841 -11.481   9.394
  204    HD3  PRO  26           1HD      PRO  26  -4.391 -12.220  10.104
  205    H    GLY  27           H        GLY  27  -4.132 -15.485   5.732
  206    HA2  GLY  27           2HA      GLY  27  -5.751 -16.603   4.289
  207    HA3  GLY  27           1HA      GLY  27  -6.820 -15.228   4.529
  208    H    ASP  28           H        ASP  28  -5.174 -13.091   4.094
  209    HA   ASP  28           HA       ASP  28  -4.272 -13.494   1.316
  210    HB2  ASP  28           2HB      ASP  28  -6.305 -11.781   2.273
  211    HB3  ASP  28           1HB      ASP  28  -4.948 -10.745   1.846
  212    H    ASN  29           H        ASN  29  -2.139 -13.409   1.237
  213    HA   ASN  29           HA       ASN  29  -0.579 -11.988   3.206
  214    HB2  ASN  29           2HB      ASN  29   0.288 -13.475   0.725
  215    HB3  ASN  29           1HB      ASN  29   1.365 -12.863   1.975
  216   HD21  ASN  29          1HD2      ASN  29   1.333 -13.832   4.037
  217   HD22  ASN  29          2HD2      ASN  29   0.707 -15.426   4.267
  218    H    SER  30           H        SER  30  -2.304 -10.411   1.287
  219    HA   SER  30           HA       SER  30  -0.593  -9.035  -0.513
  220    HG   SER  30           HG       SER  30  -3.914  -9.749  -0.496
  221    HB2  SER  30           2HB      SER  30  -2.765  -7.343   0.213
  222    HB3  SER  30           1HB      SER  30  -2.576  -8.294  -1.258
  223    H    ILE  31           H        ILE  31  -0.695  -6.426  -0.200
  224    HA   ILE  31           HA       ILE  31   0.629  -6.009   2.387
  225    HB   ILE  31           HB       ILE  31   1.030  -4.679  -0.264
  226   HG12  ILE  31          2HG1      ILE  31   3.381  -4.985   0.266
  227   HG13  ILE  31          1HG1      ILE  31   2.978  -5.548   1.881
  228   HG21  ILE  31          1HG2      ILE  31   1.498  -3.420   2.421
  229   HG22  ILE  31          2HG2      ILE  31   0.653  -2.752   1.025
  230   HG23  ILE  31          3HG2      ILE  31   2.406  -2.941   0.987
  231   HD11  ILE  31          3HD1      ILE  31   1.654  -7.386   0.554
  232   HD12  ILE  31          1HD1      ILE  31   3.390  -7.522   0.816
  233   HD13  ILE  31          2HD1      ILE  31   2.774  -6.946  -0.732
  234    H    TYR  32           H        TYR  32  -0.424  -4.982   3.901
  235    HA   TYR  32           HA       TYR  32  -2.581  -3.116   3.163
  236    HD1  TYR  32           2HD      TYR  32  -2.177  -6.607   3.498
  237    HD2  TYR  32           1HD      TYR  32  -5.603  -4.354   4.614
  238    HE1  TYR  32           2HE      TYR  32  -3.605  -8.231   2.334
  239    HE2  TYR  32           1HE      TYR  32  -7.055  -5.957   3.465
  240    HH   TYR  32           HH       TYR  32  -6.074  -8.059   1.235
  241    HB2  TYR  32           2HB      TYR  32  -2.318  -4.921   5.563
  242    HB3  TYR  32           1HB      TYR  32  -3.563  -3.692   5.393
  243    H    VAL  33           H        VAL  33  -2.800  -1.207   4.345
  244    HA   VAL  33           HA       VAL  33  -0.367  -0.166   5.481
  245    HB   VAL  33           HB       VAL  33  -3.088   1.061   5.026
  246   HG11  VAL  33          1HG1      VAL  33  -2.463   2.237   6.920
  247   HG12  VAL  33          2HG1      VAL  33  -1.784   3.230   5.631
  248   HG13  VAL  33          3HG1      VAL  33  -0.744   2.137   6.543
  249   HG21  VAL  33          3HG2      VAL  33  -2.176   1.286   2.991
  250   HG22  VAL  33          1HG2      VAL  33  -0.549   0.945   3.579
  251   HG23  VAL  33          2HG2      VAL  33  -1.215   2.571   3.722
  252    H    THR  34           H        THR  34   0.151  -0.119   7.579
  253    HA   THR  34           HA       THR  34  -1.823  -1.101   9.500
  254    HB   THR  34           HB       THR  34  -0.056  -1.861  10.819
  255    HG1  THR  34           1HG      THR  34   1.710  -0.775  11.075
  256   HG21  THR  34          3HG2      THR  34  -0.010  -2.574   8.159
  257   HG22  THR  34          1HG2      THR  34   0.836  -3.384   9.476
  258   HG23  THR  34          2HG2      THR  34   1.668  -2.165   8.513
  259    H    LYS  35           H        LYS  35   0.056   1.790   8.832
  260    HA   LYS  35           HA       LYS  35  -1.488   3.277  10.752
  261    HB2  LYS  35           2HB      LYS  35   0.202   2.260  12.224
  262    HB3  LYS  35           1HB      LYS  35   1.481   2.938  11.223
  263    HG2  LYS  35           2HG      LYS  35   0.866   5.169  11.841
  264    HG3  LYS  35           1HG      LYS  35  -0.559   4.585  12.704
  265    HD2  LYS  35           2HD      LYS  35   0.799   4.719  14.502
  266    HD3  LYS  35           1HD      LYS  35   1.376   3.152  13.930
  267    HE2  LYS  35           2HE      LYS  35   3.111   4.402  12.599
  268    HE3  LYS  35           1HE      LYS  35   2.612   5.859  13.458
  269    HZ1  LYS  35           3HZ      LYS  35   3.230   4.831  15.535
  270    HZ2  LYS  35           1HZ      LYS  35   4.547   4.789  14.473
  271    HZ3  LYS  35           2HZ      LYS  35   3.639   3.389  14.751
  272    H    ILE  36           H        ILE  36  -1.847   5.211   9.857
  273    HA   ILE  36           HA       ILE  36   0.063   6.203   7.867
  274    HB   ILE  36           HB       ILE  36  -2.773   7.110   8.379
  275   HG12  ILE  36          2HG1      ILE  36  -1.552   5.232   6.357
  276   HG13  ILE  36          1HG1      ILE  36  -2.891   4.924   7.459
  277   HG21  ILE  36          1HG2      ILE  36  -0.957   7.787   6.069
  278   HG22  ILE  36          2HG2      ILE  36  -1.226   8.839   7.457
  279   HG23  ILE  36          3HG2      ILE  36  -2.568   8.429   6.389
  280   HD11  ILE  36          3HD1      ILE  36  -3.862   5.157   5.349
  281   HD12  ILE  36          1HD1      ILE  36  -2.873   6.561   4.951
  282   HD13  ILE  36          2HD1      ILE  36  -4.156   6.699   6.153
  283    H    ILE  37           H        ILE  37   1.411   7.800   8.400
  284    HA   ILE  37           HA       ILE  37   1.256   9.141  10.923
  285    HB   ILE  37           HB       ILE  37   3.113   9.399   8.559
  286   HG12  ILE  37          2HG1      ILE  37   4.722   8.718  10.525
  287   HG13  ILE  37          1HG1      ILE  37   3.236   8.154  11.280
  288   HG21  ILE  37          1HG2      ILE  37   3.019  11.076  11.047
  289   HG22  ILE  37          2HG2      ILE  37   3.109  11.598   9.364
  290   HG23  ILE  37          3HG2      ILE  37   4.506  10.843  10.127
  291   HD11  ILE  37          3HD1      ILE  37   4.553   6.440  10.005
  292   HD12  ILE  37          1HD1      ILE  37   4.100   7.303   8.535
  293   HD13  ILE  37          2HD1      ILE  37   2.854   6.587   9.556
  294    H    GLU  38           H        GLU  38   0.904  11.349  11.320
  295    HA   GLU  38           HA       GLU  38  -1.107  12.594   9.792
  296    HB2  GLU  38           2HB      GLU  38  -0.346  12.965  12.293
  297    HB3  GLU  38           1HB      GLU  38   0.655  14.223  11.581
  298    HG2  GLU  38           2HG      GLU  38  -2.175  14.212  10.765
  299    HG3  GLU  38           1HG      GLU  38  -1.855  14.607  12.452
  300    H    GLY  39           H        GLY  39  -1.078  14.364   8.400
  301    HA2  GLY  39           2HA      GLY  39  -0.280  15.715   6.733
  302    HA3  GLY  39           1HA      GLY  39   1.182  15.863   7.690
  303    H    GLY  40           H        GLY  40   0.331  12.649   6.757
  304    HA2  GLY  40           2HA      GLY  40   2.663  12.548   5.018
  305    HA3  GLY  40           1HA      GLY  40   1.736  11.176   5.603
  306    H    ALA  41           H        ALA  41   2.545  11.234   3.006
  307    HA   ALA  41           HA       ALA  41   1.026  12.384   1.051
  308    HB1  ALA  41           3HB      ALA  41   1.712  10.662  -0.405
  309    HB2  ALA  41           1HB      ALA  41   1.844   9.495   0.911
  310    HB3  ALA  41           2HB      ALA  41   2.999  10.821   0.788
  311    H    ALA  42           H        ALA  42   0.276   9.219   2.561
  312    HA   ALA  42           HA       ALA  42  -2.222   8.927   1.259
  313    HB1  ALA  42           3HB      ALA  42  -2.626   7.179   3.037
  314    HB2  ALA  42           1HB      ALA  42  -1.047   7.608   3.696
  315    HB3  ALA  42           2HB      ALA  42  -1.175   6.962   2.059
  316    H    HIS  43           H        HIS  43  -1.382   9.936   4.572
  317    HA   HIS  43           HA       HIS  43  -3.896  10.333   5.626
  318    HD1  HIS  43           1HD      HIS  43  -2.790  14.112   6.865
  319    HD2  HIS  43           2HD      HIS  43  -3.712  10.629   8.937
  320    HE1  HIS  43           1HE      HIS  43  -4.107  14.855   8.873
  321    HE2  HIS  43           2HE      HIS  43  -4.578  12.739  10.159
  322    HB2  HIS  43           2HB      HIS  43  -1.791  10.517   6.904
  323    HB3  HIS  43           1HB      HIS  43  -1.447  12.044   6.103
  324    H    LYS  44           H        LYS  44  -1.943  12.690   3.804
  325    HA   LYS  44           HA       LYS  44  -3.869  14.771   3.909
  326    HB2  LYS  44           2HB      LYS  44  -1.475  14.281   2.144
  327    HB3  LYS  44           1HB      LYS  44  -2.494  15.704   1.968
  328    HG2  LYS  44           2HG      LYS  44  -1.923  16.497   4.121
  329    HG3  LYS  44           1HG      LYS  44  -1.165  14.965   4.559
  330    HD2  LYS  44           2HD      LYS  44   0.698  15.361   3.234
  331    HD3  LYS  44           1HD      LYS  44  -0.146  16.537   2.224
  332    HE2  LYS  44           2HE      LYS  44  -0.071  18.185   3.926
  333    HE3  LYS  44           1HE      LYS  44   0.446  17.012   5.135
  334    HZ1  LYS  44           3HZ      LYS  44   2.036  17.957   2.810
  335    HZ2  LYS  44           1HZ      LYS  44   2.534  16.759   3.898
  336    HZ3  LYS  44           2HZ      LYS  44   2.303  18.347   4.433
  337    H    ASP  45           H        ASP  45  -3.216  12.193   1.584
  338    HA   ASP  45           HA       ASP  45  -4.888  13.103  -0.489
  339    HB2  ASP  45           2HB      ASP  45  -3.125  11.137  -0.384
  340    HB3  ASP  45           1HB      ASP  45  -4.545  10.173   0.009
  341    H    GLY  46           H        GLY  46  -5.521  10.711   2.088
  342    HA2  GLY  46           2HA      GLY  46  -7.551  10.538   3.289
  343    HA3  GLY  46           1HA      GLY  46  -8.350  11.466   2.032
  344    H    LYS  47           H        LYS  47  -7.138   9.719  -0.090
  345    HA   LYS  47           HA       LYS  47  -9.261   7.881  -0.337
  346    HB2  LYS  47           2HB      LYS  47  -6.782   8.495  -1.838
  347    HB3  LYS  47           1HB      LYS  47  -7.453   6.889  -2.080
  348    HG2  LYS  47           2HG      LYS  47  -9.193   7.652  -3.267
  349    HG3  LYS  47           1HG      LYS  47  -9.411   9.065  -2.234
  350    HD2  LYS  47           2HD      LYS  47  -8.087  10.372  -3.521
  351    HD3  LYS  47           1HD      LYS  47  -6.975   9.057  -3.898
  352    HE2  LYS  47           2HE      LYS  47  -7.961   9.476  -5.948
  353    HE3  LYS  47           1HE      LYS  47  -8.932   8.142  -5.329
  354    HZ1  LYS  47           3HZ      LYS  47 -10.592   9.745  -4.598
  355    HZ2  LYS  47           1HZ      LYS  47 -10.319   9.878  -6.262
  356    HZ3  LYS  47           2HZ      LYS  47  -9.660  11.020  -5.203
  357    H    LEU  48           H        LEU  48  -5.878   7.464   0.663
  358    HA   LEU  48           HA       LEU  48  -6.264   4.623   1.094
  359    HG   LEU  48           HG       LEU  48  -4.358   3.364   0.902
  360    HB2  LEU  48           2HB      LEU  48  -4.104   5.885   0.299
  361    HB3  LEU  48           1HB      LEU  48  -3.836   6.101   2.019
  362   HD11  LEU  48          1HD1      LEU  48  -2.497   4.497  -0.370
  363   HD12  LEU  48          2HD1      LEU  48  -2.061   3.010   0.471
  364   HD13  LEU  48          3HD1      LEU  48  -1.615   4.573   1.156
  365   HD21  LEU  48          3HD2      LEU  48  -4.163   4.219   3.439
  366   HD22  LEU  48          1HD2      LEU  48  -2.467   3.874   3.105
  367   HD23  LEU  48          2HD2      LEU  48  -3.682   2.610   2.909
  368    H    GLN  49           H        GLN  49  -6.941   3.735   2.905
  369    HA   GLN  49           HA       GLN  49  -6.552   5.122   5.459
  370    HB2  GLN  49           2HB      GLN  49  -8.800   4.505   6.162
  371    HB3  GLN  49           1HB      GLN  49  -8.869   5.499   4.718
  372    HG2  GLN  49           2HG      GLN  49  -8.929   2.521   4.494
  373    HG3  GLN  49           1HG      GLN  49 -10.386   3.413   4.926
  374   HE21  GLN  49          1HE2      GLN  49  -8.488   2.277   2.410
  375   HE22  GLN  49          2HE2      GLN  49  -9.207   3.172   1.119
  376    H    ILE  50           H        ILE  50  -6.191   3.772   7.233
  377    HA   ILE  50           HA       ILE  50  -4.796   1.442   6.894
  378    HB   ILE  50           HB       ILE  50  -5.424   0.867   9.280
  379   HG12  ILE  50          2HG1      ILE  50  -6.467   3.420  10.003
  380   HG13  ILE  50          1HG1      ILE  50  -7.494   2.763   8.733
  381   HG21  ILE  50          1HG2      ILE  50  -3.423   2.049   8.939
  382   HG22  ILE  50          2HG2      ILE  50  -4.284   2.947  10.188
  383   HG23  ILE  50          3HG2      ILE  50  -4.275   3.537   8.527
  384   HD11  ILE  50          3HD1      ILE  50  -7.851   0.751  10.035
  385   HD12  ILE  50          1HD1      ILE  50  -8.296   2.184  10.962
  386   HD13  ILE  50          2HD1      ILE  50  -6.774   1.357  11.293
  387    H    GLY  51           H        GLY  51  -5.270  -0.538   6.211
  388    HA2  GLY  51           2HA      GLY  51  -6.642  -2.546   6.674
  389    HA3  GLY  51           1HA      GLY  51  -8.048  -1.519   6.499
  390    H    ASP  52           H        ASP  52  -6.595  -0.135   4.139
  391    HA   ASP  52           HA       ASP  52  -7.771  -1.737   2.142
  392    HB2  ASP  52           2HB      ASP  52  -6.462  -0.169   0.569
  393    HB3  ASP  52           1HB      ASP  52  -7.696   0.533   1.603
  394    H    LYS  53           H        LYS  53  -6.704  -2.777   0.348
  395    HA   LYS  53           HA       LYS  53  -4.126  -3.938   1.163
  396    HB2  LYS  53           2HB      LYS  53  -4.887  -5.717  -0.635
  397    HB3  LYS  53           1HB      LYS  53  -5.464  -5.792   1.019
  398    HG2  LYS  53           2HG      LYS  53  -7.020  -4.385  -1.122
  399    HG3  LYS  53           1HG      LYS  53  -7.161  -6.123  -0.855
  400    HD2  LYS  53           2HD      LYS  53  -7.385  -4.483   1.574
  401    HD3  LYS  53           1HD      LYS  53  -8.669  -4.227   0.392
  402    HE2  LYS  53           2HE      LYS  53  -9.205  -6.576   0.401
  403    HE3  LYS  53           1HE      LYS  53  -7.832  -6.923   1.446
  404    HZ1  LYS  53           3HZ      LYS  53  -9.910  -6.855   2.685
  405    HZ2  LYS  53           1HZ      LYS  53 -10.177  -5.258   2.191
  406    HZ3  LYS  53           2HZ      LYS  53  -8.868  -5.625   3.195
  407    H    LEU  54           H        LEU  54  -2.522  -4.169  -0.294
  408    HA   LEU  54           HA       LEU  54  -2.636  -2.285  -2.519
  409    HG   LEU  54           HG       LEU  54  -1.476  -0.772  -1.381
  410    HB2  LEU  54           2HB      LEU  54  -0.549  -3.195  -0.715
  411    HB3  LEU  54           1HB      LEU  54  -0.023  -3.157  -2.388
  412   HD11  LEU  54          1HD1      LEU  54  -0.062  -1.080   0.491
  413   HD12  LEU  54          2HD1      LEU  54   0.694   0.149  -0.522
  414   HD13  LEU  54          3HD1      LEU  54   1.313  -1.500  -0.529
  415   HD21  LEU  54          3HD2      LEU  54  -0.831  -0.246  -3.456
  416   HD22  LEU  54          1HD2      LEU  54   0.403  -1.504  -3.498
  417   HD23  LEU  54          2HD2      LEU  54   0.747   0.044  -2.726
  418    H    LEU  55           H        LEU  55  -3.242  -3.008  -4.385
  419    HA   LEU  55           HA       LEU  55  -2.969  -5.718  -5.235
  420    HG   LEU  55           HG       LEU  55  -3.201  -5.783  -7.857
  421    HB2  LEU  55           2HB      LEU  55  -4.837  -4.454  -6.050
  422    HB3  LEU  55           1HB      LEU  55  -3.793  -3.191  -6.665
  423   HD11  LEU  55          1HD1      LEU  55  -5.437  -6.384  -7.746
  424   HD12  LEU  55          2HD1      LEU  55  -5.313  -5.602  -9.321
  425   HD13  LEU  55          3HD1      LEU  55  -5.998  -4.724  -7.953
  426   HD21  LEU  55          3HD2      LEU  55  -3.105  -4.527  -9.846
  427   HD22  LEU  55          1HD2      LEU  55  -2.486  -3.461  -8.587
  428   HD23  LEU  55          2HD2      LEU  55  -4.131  -3.254  -9.186
  429    H    ALA  56           H        ALA  56  -1.509  -2.623  -6.344
  430    HA   ALA  56           HA       ALA  56   0.968  -4.073  -6.896
  431    HB1  ALA  56           3HB      ALA  56  -0.628  -2.733  -9.087
  432    HB2  ALA  56           1HB      ALA  56  -0.158  -4.430  -8.988
  433    HB3  ALA  56           2HB      ALA  56   1.066  -3.186  -9.255
  434    H    VAL  57           H        VAL  57   2.799  -2.715  -7.261
  435    HA   VAL  57           HA       VAL  57   2.401   0.157  -6.752
  436    HB   VAL  57           HB       VAL  57   4.506  -1.505  -5.355
  437   HG11  VAL  57          1HG1      VAL  57   4.732   0.620  -3.994
  438   HG12  VAL  57          2HG1      VAL  57   3.786   1.415  -5.252
  439   HG13  VAL  57          3HG1      VAL  57   5.341   0.684  -5.648
  440   HG21  VAL  57          3HG2      VAL  57   2.478  -2.100  -4.328
  441   HG22  VAL  57          1HG2      VAL  57   1.855  -0.452  -4.414
  442   HG23  VAL  57          2HG2      VAL  57   3.163  -0.843  -3.296
  443    H    ASN  58           H        ASN  58   3.125   1.080  -8.561
  444    HA   ASN  58           HA       ASN  58   4.502   1.748 -10.235
  445    HB2  ASN  58           2HB      ASN  58   6.643   0.366  -8.599
  446    HB3  ASN  58           1HB      ASN  58   6.944   1.442  -9.957
  447   HD21  ASN  58          1HD2      ASN  58   5.772   3.627  -9.716
  448   HD22  ASN  58          2HD2      ASN  58   5.917   4.375  -8.165
  449    H    ASN  59           H        ASN  59   3.005  -0.409 -10.813
  450    HA   ASN  59           HA       ASN  59   2.773  -1.839 -12.581
  451    HB2  ASN  59           2HB      ASN  59   5.182  -0.664 -13.214
  452    HB3  ASN  59           1HB      ASN  59   5.586  -2.377 -13.168
  453   HD21  ASN  59          1HD2      ASN  59   4.154  -3.821 -14.432
  454   HD22  ASN  59          2HD2      ASN  59   3.529  -3.229 -15.930
  455    H    VAL  60           H        VAL  60   4.746  -2.521  -9.831
  456    HA   VAL  60           HA       VAL  60   4.767  -5.392 -10.412
  457    HB   VAL  60           HB       VAL  60   6.162  -5.690  -8.493
  458   HG11  VAL  60          1HG1      VAL  60   6.993  -3.271 -10.082
  459   HG12  VAL  60          2HG1      VAL  60   7.366  -4.960 -10.425
  460   HG13  VAL  60          3HG1      VAL  60   8.068  -4.172  -9.013
  461   HG21  VAL  60          3HG2      VAL  60   6.643  -3.050  -7.564
  462   HG22  VAL  60          1HG2      VAL  60   5.999  -4.432  -6.678
  463   HG23  VAL  60          2HG2      VAL  60   4.906  -3.342  -7.529
  464    H    CYS  61           H        CYS  61   3.751  -6.944  -9.028
  465    HA   CYS  61           HA       CYS  61   1.336  -5.920  -7.793
  466    HG   CYS  61           HG       CYS  61   2.354  -9.991  -7.309
  467    HB2  CYS  61           2HB      CYS  61   0.670  -8.239  -7.544
  468    HB3  CYS  61           1HB      CYS  61   1.234  -7.949  -9.184
  469    H    LEU  62           H        LEU  62   0.915  -5.773  -5.650
  470    HA   LEU  62           HA       LEU  62   3.129  -6.422  -3.847
  471    HG   LEU  62           HG       LEU  62   2.899  -5.003  -1.496
  472    HB2  LEU  62           2HB      LEU  62   1.881  -4.065  -4.180
  473    HB3  LEU  62           1HB      LEU  62   0.907  -4.734  -2.890
  474   HD11  LEU  62          1HD1      LEU  62   4.634  -5.443  -3.014
  475   HD12  LEU  62          2HD1      LEU  62   5.019  -3.866  -2.325
  476   HD13  LEU  62          3HD1      LEU  62   4.312  -3.974  -3.937
  477   HD21  LEU  62          3HD2      LEU  62   2.491  -2.951  -0.778
  478   HD22  LEU  62          1HD2      LEU  62   1.759  -2.548  -2.329
  479   HD23  LEU  62          2HD2      LEU  62   3.483  -2.289  -2.074
  480    H    GLU  63           H        GLU  63   1.213  -8.439  -4.751
  481    HA   GLU  63           HA       GLU  63  -0.024  -9.096  -2.158
  482    HB2  GLU  63           2HB      GLU  63  -1.615  -8.590  -4.051
  483    HB3  GLU  63           1HB      GLU  63  -1.014 -10.039  -4.846
  484    HG2  GLU  63           2HG      GLU  63  -1.985 -11.451  -3.303
  485    HG3  GLU  63           1HG      GLU  63  -2.060 -10.209  -2.056
  486    H    GLU  64           H        GLU  64   2.150 -10.171  -4.626
  487    HA   GLU  64           HA       GLU  64   2.262 -12.828  -3.362
  488    HB2  GLU  64           2HB      GLU  64   1.912 -12.165  -6.065
  489    HB3  GLU  64           1HB      GLU  64   3.561 -12.749  -5.923
  490    HG2  GLU  64           2HG      GLU  64   1.219 -14.258  -4.814
  491    HG3  GLU  64           1HG      GLU  64   1.788 -14.462  -6.470
  492    H    VAL  65           H        VAL  65   3.614 -10.758  -2.156
  493    HA   VAL  65           HA       VAL  65   6.389 -11.626  -2.536
  494    HB   VAL  65           HB       VAL  65   7.215  -9.288  -2.295
  495   HG11  VAL  65          1HG1      VAL  65   7.204 -10.373  -4.468
  496   HG12  VAL  65          2HG1      VAL  65   6.822  -8.660  -4.642
  497   HG13  VAL  65          3HG1      VAL  65   5.537  -9.863  -4.738
  498   HG21  VAL  65          3HG2      VAL  65   4.309  -8.616  -2.742
  499   HG22  VAL  65          1HG2      VAL  65   5.630  -7.463  -2.931
  500   HG23  VAL  65          2HG2      VAL  65   5.312  -8.188  -1.356
  501    H    THR  66           H        THR  66   7.793 -11.208  -0.785
  502    HA   THR  66           HA       THR  66   6.604 -11.553   1.780
  503    HB   THR  66           HB       THR  66   8.871 -11.543   2.650
  504    HG1  THR  66           1HG      THR  66   9.647 -10.564   0.101
  505   HG21  THR  66          3HG2      THR  66   9.284 -12.812  -0.012
  506   HG22  THR  66          1HG2      THR  66   8.073 -13.461   1.092
  507   HG23  THR  66          2HG2      THR  66   9.762 -13.370   1.592
  508    H    HIS  67           H        HIS  67   7.988  -9.963   3.556
  509    HA   HIS  67           HA       HIS  67   6.578  -7.493   3.214
  510    HD1  HIS  67           1HD      HIS  67   5.213  -6.828   6.146
  511    HD2  HIS  67           2HD      HIS  67   8.948  -5.190   5.377
  512    HE1  HIS  67           1HE      HIS  67   5.036  -4.405   6.785
  513    HE2  HIS  67           2HE      HIS  67   7.255  -3.414   6.175
  514    HB2  HIS  67           2HB      HIS  67   6.882  -8.550   5.443
  515    HB3  HIS  67           1HB      HIS  67   8.575  -8.087   5.410
  516    H    GLU  68           H        GLU  68   9.992  -8.446   3.034
  517    HA   GLU  68           HA       GLU  68  11.209  -5.999   2.820
  518    HB2  GLU  68           2HB      GLU  68  11.798  -8.474   1.178
  519    HB3  GLU  68           1HB      GLU  68  12.878  -7.098   1.344
  520    HG2  GLU  68           2HG      GLU  68  13.571  -7.716   3.390
  521    HG3  GLU  68           1HG      GLU  68  11.979  -8.301   3.871
  522    H    GLU  69           H        GLU  69   9.763  -7.872   0.163
  523    HA   GLU  69           HA       GLU  69  10.135  -5.931  -1.850
  524    HB2  GLU  69           2HB      GLU  69   8.610  -8.429  -1.552
  525    HB3  GLU  69           1HB      GLU  69   7.925  -7.288  -2.701
  526    HG2  GLU  69           2HG      GLU  69  10.766  -7.520  -3.080
  527    HG3  GLU  69           1HG      GLU  69   9.996  -9.106  -3.130
  528    H    ALA  70           H        ALA  70   7.586  -6.404   0.527
  529    HA   ALA  70           HA       ALA  70   5.610  -4.687  -0.521
  530    HB1  ALA  70           3HB      ALA  70   5.064  -6.181   1.265
  531    HB2  ALA  70           1HB      ALA  70   4.858  -4.535   1.866
  532    HB3  ALA  70           2HB      ALA  70   6.283  -5.464   2.314
  533    H    VAL  71           H        VAL  71   8.337  -4.102   1.662
  534    HA   VAL  71           HA       VAL  71   7.776  -1.282   1.921
  535    HB   VAL  71           HB       VAL  71  10.041  -3.025   2.884
  536   HG11  VAL  71          1HG1      VAL  71  11.276  -1.121   2.669
  537   HG12  VAL  71          2HG1      VAL  71  10.538  -0.803   4.237
  538   HG13  VAL  71          3HG1      VAL  71   9.872  -0.060   2.783
  539   HG21  VAL  71          3HG2      VAL  71   8.239  -1.371   4.595
  540   HG22  VAL  71          1HG2      VAL  71   9.083  -2.872   4.975
  541   HG23  VAL  71          2HG2      VAL  71   7.658  -2.899   3.936
  542    H    THR  72           H        THR  72  10.022  -3.317   0.103
  543    HA   THR  72           HA       THR  72  11.677  -1.282  -0.893
  544    HB   THR  72           HB       THR  72  10.980  -3.988  -2.047
  545    HG1  THR  72           1HG      THR  72  12.339  -4.649  -0.616
  546   HG21  THR  72          3HG2      THR  72  13.169  -2.086  -2.854
  547   HG22  THR  72          1HG2      THR  72  11.862  -2.705  -3.865
  548   HG23  THR  72          2HG2      THR  72  13.122  -3.796  -3.286
  549    H    ALA  73           H        ALA  73   8.573  -2.541  -2.005
  550    HA   ALA  73           HA       ALA  73   8.611  -1.136  -4.497
  551    HB1  ALA  73           3HB      ALA  73   7.369  -3.277  -4.066
  552    HB2  ALA  73           1HB      ALA  73   6.424  -2.004  -4.838
  553    HB3  ALA  73           2HB      ALA  73   6.217  -2.335  -3.118
  554    H    LEU  74           H        LEU  74   7.242  -0.581  -1.266
  555    HA   LEU  74           HA       LEU  74   5.707   1.711  -2.014
  556    HG   LEU  74           HG       LEU  74   4.286   0.537   1.173
  557    HB2  LEU  74           2HB      LEU  74   6.555   0.384   0.507
  558    HB3  LEU  74           1HB      LEU  74   6.125   2.077   0.613
  559   HD11  LEU  74          1HD1      LEU  74   3.911   2.342  -1.202
  560   HD12  LEU  74          2HD1      LEU  74   3.705   2.745   0.501
  561   HD13  LEU  74          3HD1      LEU  74   2.582   1.636  -0.285
  562   HD21  LEU  74          3HD2      LEU  74   3.179  -0.345  -1.095
  563   HD22  LEU  74          1HD2      LEU  74   4.268  -1.320  -0.110
  564   HD23  LEU  74          2HD2      LEU  74   4.881  -0.478  -1.533
  565    H    LYS  75           H        LYS  75   8.948   1.082  -0.853
  566    HA   LYS  75           HA       LYS  75   9.598   3.875  -0.486
  567    HB2  LYS  75           2HB      LYS  75  11.685   3.182   0.292
  568    HB3  LYS  75           1HB      LYS  75  10.606   1.886   0.785
  569    HG2  LYS  75           2HG      LYS  75  11.469   0.403  -0.759
  570    HG3  LYS  75           1HG      LYS  75  12.096   1.682  -1.796
  571    HD2  LYS  75           2HD      LYS  75  14.057   1.037  -0.852
  572    HD3  LYS  75           1HD      LYS  75  13.543   2.178   0.391
  573    HE2  LYS  75           2HE      LYS  75  12.397   0.147   1.476
  574    HE3  LYS  75           1HE      LYS  75  13.421  -0.818   0.415
  575    HZ1  LYS  75           3HZ      LYS  75  14.358   1.154   2.429
  576    HZ2  LYS  75           1HZ      LYS  75  15.362   0.285   1.380
  577    HZ3  LYS  75           2HZ      LYS  75  14.462  -0.530   2.557
  578    H    ASN  76           H        ASN  76   9.726   1.651  -3.139
  579    HA   ASN  76           HA       ASN  76  11.797   2.908  -4.625
  580    HB2  ASN  76           2HB      ASN  76  10.855   0.556  -4.956
  581    HB3  ASN  76           1HB      ASN  76   9.524   1.319  -5.818
  582   HD21  ASN  76          1HD2      ASN  76   9.818   1.976  -7.884
  583   HD22  ASN  76          2HD2      ASN  76  11.295   1.789  -8.760
  584    H    THR  77           H        THR  77  10.927   5.130  -4.092
  585    HA   THR  77           HA       THR  77   9.155   6.027  -6.267
  586    HB   THR  77           HB       THR  77   8.116   7.627  -4.796
  587    HG1  THR  77           1HG      THR  77   9.894   6.667  -2.804
  588   HG21  THR  77          3HG2      THR  77   7.070   5.470  -4.670
  589   HG22  THR  77          1HG2      THR  77   7.085   6.207  -3.067
  590   HG23  THR  77          2HG2      THR  77   8.239   4.933  -3.464
  591    H    SER  78           H        SER  78   9.598   8.018  -7.196
  592    HA   SER  78           HA       SER  78  12.177   9.244  -6.454
  593    HG   SER  78           HG       SER  78  10.760   7.614  -9.459
  594    HB2  SER  78           2HB      SER  78  12.335   9.851  -8.941
  595    HB3  SER  78           1HB      SER  78  12.603   8.160  -8.521
  596    H    ASP  79           H        ASP  79   9.712  10.207  -8.825
  597    HA   ASP  79           HA       ASP  79   9.473  12.785  -7.431
  598    HB2  ASP  79           2HB      ASP  79   8.721  12.050 -10.272
  599    HB3  ASP  79           1HB      ASP  79   8.600  13.656  -9.561
  600    H    PHE  80           H        PHE  80   7.597  10.153  -8.869
  601    HA   PHE  80           HA       PHE  80   5.296  11.003  -7.255
  602    HD1  PHE  80           1HD      PHE  80   5.002  13.253  -9.232
  603    HD2  PHE  80           2HD      PHE  80   2.180  10.093  -8.835
  604    HE1  PHE  80           1HE      PHE  80   3.229  14.900  -8.802
  605    HE2  PHE  80           2HE      PHE  80   0.399  11.739  -8.410
  606    HZ   PHE  80           HZ       PHE  80   0.933  14.138  -8.378
  607    HB2  PHE  80           2HB      PHE  80   5.421  10.925 -10.097
  608    HB3  PHE  80           1HB      PHE  80   4.346   9.631  -9.569
  609    H    VAL  81           H        VAL  81   3.588   9.088  -7.235
  610    HA   VAL  81           HA       VAL  81   4.936   6.500  -7.053
  611    HB   VAL  81           HB       VAL  81   3.323   7.795  -4.841
  612   HG11  VAL  81          1HG1      VAL  81   2.665   5.603  -4.670
  613   HG12  VAL  81          2HG1      VAL  81   4.091   5.621  -3.633
  614   HG13  VAL  81          3HG1      VAL  81   4.201   4.976  -5.270
  615   HG21  VAL  81          3HG2      VAL  81   5.433   8.668  -4.570
  616   HG22  VAL  81          1HG2      VAL  81   6.229   7.227  -5.201
  617   HG23  VAL  81          2HG2      VAL  81   5.527   7.210  -3.582
  618    H    TYR  82           H        TYR  82   3.677   5.076  -8.197
  619    HA   TYR  82           HA       TYR  82   0.822   5.701  -8.459
  620    HD1  TYR  82           1HD      TYR  82   0.578   2.151 -10.237
  621    HD2  TYR  82           2HD      TYR  82   0.108   6.223 -11.383
  622    HE1  TYR  82           1HE      TYR  82  -1.493   1.577 -11.413
  623    HE2  TYR  82           2HE      TYR  82  -1.971   5.655 -12.559
  624    HH   TYR  82           HH       TYR  82  -2.814   2.942 -13.602
  625    HB2  TYR  82           2HB      TYR  82   2.243   5.386 -10.524
  626    HB3  TYR  82           1HB      TYR  82   2.418   3.699 -10.056
  627    H    LEU  83           H        LEU  83  -0.111   4.883  -6.712
  628    HA   LEU  83           HA       LEU  83   0.486   2.165  -5.840
  629    HG   LEU  83           HG       LEU  83  -0.149   1.559  -3.732
  630    HB2  LEU  83           2HB      LEU  83   0.294   4.218  -4.307
  631    HB3  LEU  83           1HB      LEU  83  -1.437   4.059  -4.524
  632   HD11  LEU  83          1HD1      LEU  83   1.336   2.958  -2.486
  633   HD12  LEU  83          2HD1      LEU  83   0.146   2.288  -1.369
  634   HD13  LEU  83          3HD1      LEU  83  -0.002   3.958  -1.916
  635   HD21  LEU  83          3HD2      LEU  83  -2.307   3.057  -2.292
  636   HD22  LEU  83          1HD2      LEU  83  -2.059   1.316  -2.425
  637   HD23  LEU  83          2HD2      LEU  83  -2.628   2.235  -3.819
  638    H    LYS  84           H        LYS  84  -0.731   0.482  -6.305
  639    HA   LYS  84           HA       LYS  84  -3.449   0.914  -7.345
  640    HB2  LYS  84           2HB      LYS  84  -1.368  -1.149  -7.979
  641    HB3  LYS  84           1HB      LYS  84  -3.069  -1.481  -8.268
  642    HG2  LYS  84           2HG      LYS  84  -1.594   0.881  -9.410
  643    HG3  LYS  84           1HG      LYS  84  -1.832  -0.649 -10.255
  644    HD2  LYS  84           2HD      LYS  84  -4.137   0.935  -9.153
  645    HD3  LYS  84           1HD      LYS  84  -3.476   1.243 -10.760
  646    HE2  LYS  84           2HE      LYS  84  -3.991  -1.582 -10.245
  647    HE3  LYS  84           1HE      LYS  84  -5.438  -0.583 -10.141
  648    HZ1  LYS  84           3HZ      LYS  84  -5.033  -1.439 -12.388
  649    HZ2  LYS  84           1HZ      LYS  84  -3.561  -0.605 -12.443
  650    HZ3  LYS  84           2HZ      LYS  84  -5.015   0.252 -12.344
  651    H    VAL  85           H        VAL  85  -5.088   0.257  -6.099
  652    HA   VAL  85           HA       VAL  85  -4.494  -1.696  -3.977
  653    HB   VAL  85           HB       VAL  85  -6.619   0.462  -4.017
  654   HG11  VAL  85          1HG1      VAL  85  -7.530  -0.389  -2.152
  655   HG12  VAL  85          2HG1      VAL  85  -5.962  -0.818  -1.466
  656   HG13  VAL  85          3HG1      VAL  85  -6.736  -1.890  -2.630
  657   HG21  VAL  85          3HG2      VAL  85  -5.253   1.420  -2.148
  658   HG22  VAL  85          1HG2      VAL  85  -4.486   1.482  -3.735
  659   HG23  VAL  85          2HG2      VAL  85  -3.989   0.261  -2.563
  660    H    ALA  86           H        ALA  86  -5.593  -3.561  -3.922
  661    HA   ALA  86           HA       ALA  86  -7.693  -3.994  -5.923
  662    HB1  ALA  86           3HB      ALA  86  -7.134  -6.438  -4.715
  663    HB2  ALA  86           1HB      ALA  86  -5.575  -5.621  -4.821
  664    HB3  ALA  86           2HB      ALA  86  -6.544  -5.865  -6.273
  665    H    LYS  87           H        LYS  87  -9.537  -3.174  -4.966
  666    HA   LYS  87           HA       LYS  87 -10.257  -3.663  -2.267
  667    HB2  LYS  87           2HB      LYS  87 -12.470  -2.779  -2.900
  668    HB3  LYS  87           1HB      LYS  87 -11.161  -1.751  -3.463
  669    HG2  LYS  87           2HG      LYS  87 -11.382  -2.775  -5.708
  670    HG3  LYS  87           1HG      LYS  87 -12.774  -3.683  -5.116
  671    HD2  LYS  87           2HD      LYS  87 -13.644  -1.320  -4.411
  672    HD3  LYS  87           1HD      LYS  87 -12.487  -0.750  -5.616
  673    HE2  LYS  87           2HE      LYS  87 -14.447  -0.974  -6.840
  674    HE3  LYS  87           1HE      LYS  87 -13.599  -2.483  -7.172
  675    HZ1  LYS  87           3HZ      LYS  87 -15.958  -2.816  -6.668
  676    HZ2  LYS  87           1HZ      LYS  87 -15.732  -2.147  -5.130
  677    HZ3  LYS  87           2HZ      LYS  87 -14.962  -3.595  -5.544
  678    HA   PRO  88           HA       PRO  88 -11.666  -7.863  -2.731
  679    HB2  PRO  88           2HB      PRO  88 -12.724  -8.167  -0.265
  680    HB3  PRO  88           1HB      PRO  88 -10.978  -8.104  -0.540
  681    HG2  PRO  88           2HG      PRO  88 -12.829  -5.915   0.344
  682    HG3  PRO  88           1HG      PRO  88 -11.254  -6.381   1.012
  683    HD2  PRO  88           2HD      PRO  88 -11.529  -4.306  -0.688
  684    HD3  PRO  88           1HD      PRO  88 -10.082  -5.335  -0.687
  685    H    THR  89           H        THR  89 -13.609  -9.049  -2.916
  686    HA   THR  89           HA       THR  89 -16.117  -7.590  -2.592
  687    HB   THR  89           HB       THR  89 -15.843  -7.078  -4.835
  688    HG1  THR  89           1HG      THR  89 -17.776  -7.991  -4.911
  689   HG21  THR  89          3HG2      THR  89 -15.130  -9.732  -5.882
  690   HG22  THR  89          1HG2      THR  89 -13.867  -8.887  -4.988
  691   HG23  THR  89          2HG2      THR  89 -14.614  -8.125  -6.391
  692    H    GLY  90           H        GLY  90 -15.132 -10.698  -4.105
  693    HA2  GLY  90           2HA      GLY  90 -16.043 -12.295  -1.954
  694    HA3  GLY  90           1HA      GLY  90 -17.304 -12.167  -3.170
  695    H    SER  91           H        SER  91 -13.872 -13.006  -2.771
  696    HA   SER  91           HA       SER  91 -13.702 -14.408  -5.250
  697    HG   SER  91           HG       SER  91 -10.564 -13.646  -4.906
  698    HB2  SER  91           2HB      SER  91 -11.919 -14.157  -2.848
  699    HB3  SER  91           1HB      SER  91 -11.558 -15.348  -4.097
  700    H    HIS  92           H        HIS  92 -14.374 -15.362  -1.920
  701    HA   HIS  92           HA       HIS  92 -14.164 -18.162  -2.324
  702    HD1  HIS  92           1HD      HIS  92 -14.493 -16.595   2.113
  703    HD2  HIS  92           2HD      HIS  92 -12.119 -17.360  -1.209
  704    HE1  HIS  92           1HE      HIS  92 -12.130 -16.188   2.868
  705    HE2  HIS  92           2HE      HIS  92 -10.721 -16.558   0.813
  706    HB2  HIS  92           2HB      HIS  92 -15.757 -16.644  -0.244
  707    HB3  HIS  92           1HB      HIS  92 -15.377 -18.362  -0.187
  708    HA   ARG 301           HA       ARG 301   2.645 -10.626  10.849
  709    HE   ARG 301           HE       ARG 301  -1.707 -12.428  12.737
  710    H1   ARG 301           1HT      ARG 301   4.210 -11.842  12.320
  711    H2   ARG 301           2HT      ARG 301   2.600 -12.427  12.258
  712    H3   ARG 301           3HT      ARG 301   3.130 -11.508  13.608
  713    HB2  ARG 301           2HB      ARG 301   1.654  -9.548  13.494
  714    HB3  ARG 301           1HB      ARG 301   1.067  -9.138  11.889
  715    HG2  ARG 301           2HG      ARG 301   0.667 -11.824  11.927
  716    HG3  ARG 301           1HG      ARG 301   0.405 -11.408  13.620
  717    HD2  ARG 301           2HD      ARG 301  -1.197  -9.659  12.890
  718    HD3  ARG 301           1HD      ARG 301  -0.989 -10.211  11.227
  719   HH11  ARG 301          1HH1      ARG 301  -3.133  -9.365  11.816
  720   HH12  ARG 301          2HH1      ARG 301  -4.755  -9.966  11.876
  721   HH21  ARG 301          1HH2      ARG 301  -3.844 -13.212  12.812
  722   HH22  ARG 301          2HH2      ARG 301  -5.160 -12.148  12.442
  723    H    ARG 302           H        ARG 302   3.840  -9.017  10.049
  724    HA   ARG 302           HA       ARG 302   5.475  -7.409  11.901
  725    HE   ARG 302           HE       ARG 302   8.900  -9.865  10.907
  726    HB2  ARG 302           2HB      ARG 302   6.736  -9.182  10.556
  727    HB3  ARG 302           1HB      ARG 302   6.376  -8.204   9.139
  728    HG2  ARG 302           2HG      ARG 302   7.638  -6.370   9.989
  729    HG3  ARG 302           1HG      ARG 302   7.833  -7.159  11.555
  730    HD2  ARG 302           2HD      ARG 302   8.865  -8.375   9.004
  731    HD3  ARG 302           1HD      ARG 302   9.813  -7.231   9.948
  732   HH11  ARG 302          1HH1      ARG 302  11.177  -7.194  11.047
  733   HH12  ARG 302          2HH1      ARG 302  12.213  -7.987  12.181
  734   HH21  ARG 302          1HH2      ARG 302  10.277 -10.889  12.400
  735   HH22  ARG 302          2HH2      ARG 302  11.705 -10.079  12.948
  736    H    GLU 303           H        GLU 303   5.261  -5.279  11.694
  737    HA   GLU 303           HA       GLU 303   4.147  -4.199   9.189
  738    HB2  GLU 303           2HB      GLU 303   3.474  -3.091  11.912
  739    HB3  GLU 303           1HB      GLU 303   2.703  -2.730  10.375
  740    HG2  GLU 303           2HG      GLU 303   1.747  -4.948  10.291
  741    HG3  GLU 303           1HG      GLU 303   2.595  -5.398  11.768
  742    H    THR 304           H        THR 304   5.636  -2.945   8.278
  743    HA   THR 304           HA       THR 304   7.353  -1.316  10.027
  744    HB   THR 304           HB       THR 304   8.003  -3.111   7.846
  745    HG1  THR 304           1HG      THR 304   9.409  -3.427   9.346
  746   HG21  THR 304          3HG2      THR 304   8.164  -1.113   6.477
  747   HG22  THR 304          1HG2      THR 304   9.755  -1.799   6.804
  748   HG23  THR 304          2HG2      THR 304   9.216  -0.366   7.680
  749    H    GLN 305           H        GLN 305   7.787   0.815   9.458
  750    HA   GLN 305           HA       GLN 305   5.727   2.100   7.908
  751    HB2  GLN 305           2HB      GLN 305   8.087   3.147   9.464
  752    HB3  GLN 305           1HB      GLN 305   7.030   4.196   8.528
  753    HG2  GLN 305           2HG      GLN 305   5.347   4.061  10.016
  754    HG3  GLN 305           1HG      GLN 305   5.683   2.376  10.407
  755   HE21  GLN 305          1HE2      GLN 305   5.593   5.360  11.684
  756   HE22  GLN 305          2HE2      GLN 305   6.761   5.191  12.945
  757    H    VAL 306           H        VAL 306   6.044   3.444   6.096
  758    HA   VAL 306           HA       VAL 306   8.590   3.165   4.669
  759    HB   VAL 306           HB       VAL 306   7.318   2.710   2.547
  760   HG11  VAL 306          1HG1      VAL 306   7.036   0.566   4.650
  761   HG12  VAL 306          2HG1      VAL 306   8.552   0.980   3.848
  762   HG13  VAL 306          3HG1      VAL 306   7.204   0.341   2.908
  763   HG21  VAL 306          3HG2      VAL 306   5.100   3.344   3.928
  764   HG22  VAL 306          1HG2      VAL 306   5.064   1.589   4.096
  765   HG23  VAL 306          2HG2      VAL 306   5.087   2.320   2.492
  Start of MODEL   25
    1    HA   MET   1           HA       MET   1  -8.258   0.132  -7.684
    2    H1   MET   1           1HT      MET   1  -8.891   2.225  -6.689
    3    H2   MET   1           2HT      MET   1 -10.147   1.513  -7.616
    4    H3   MET   1           3HT      MET   1  -9.262   2.843  -8.244
    5    HB2  MET   1           2HB      MET   1  -9.331   1.538 -10.031
    6    HB3  MET   1           1HB      MET   1  -7.791   0.744 -10.321
    7    HG2  MET   1           2HG      MET   1  -8.695  -1.373  -9.621
    8    HG3  MET   1           1HG      MET   1 -10.218  -0.608  -9.171
    9    HE1  MET   1           3HE      MET   1 -12.201  -0.269 -12.256
   10    HE2  MET   1           1HE      MET   1 -11.867   0.355 -10.641
   11    HE3  MET   1           2HE      MET   1 -12.228  -1.357 -10.869
   12    H    GLU   2           H        GLU   2  -7.396   3.183  -9.352
   13    HA   GLU   2           HA       GLU   2  -4.663   2.872  -8.297
   14    HB2  GLU   2           2HB      GLU   2  -3.927   4.073 -10.416
   15    HB3  GLU   2           1HB      GLU   2  -4.448   2.405 -10.600
   16    HG2  GLU   2           2HG      GLU   2  -6.656   4.233 -10.937
   17    HG3  GLU   2           1HG      GLU   2  -5.332   4.611 -12.034
   18    H    ILE   3           H        ILE   3  -3.458   4.871  -8.006
   19    HA   ILE   3           HA       ILE   3  -4.978   7.349  -7.958
   20    HB   ILE   3           HB       ILE   3  -3.722   6.125  -5.491
   21   HG12  ILE   3          2HG1      ILE   3  -6.197   6.934  -4.747
   22   HG13  ILE   3          1HG1      ILE   3  -6.498   6.541  -6.436
   23   HG21  ILE   3          1HG2      ILE   3  -4.772   8.913  -5.927
   24   HG22  ILE   3          2HG2      ILE   3  -3.113   8.443  -5.562
   25   HG23  ILE   3          3HG2      ILE   3  -4.377   8.224  -4.352
   26   HD11  ILE   3          3HD1      ILE   3  -6.167   4.798  -4.176
   27   HD12  ILE   3          1HD1      ILE   3  -5.020   4.399  -5.454
   28   HD13  ILE   3          2HD1      ILE   3  -6.748   4.438  -5.802
   29    H    LYS   4           H        LYS   4  -3.672   8.950  -8.715
   30    HA   LYS   4           HA       LYS   4  -0.847   8.386  -9.037
   31    HB2  LYS   4           2HB      LYS   4  -2.771  10.374 -10.139
   32    HB3  LYS   4           1HB      LYS   4  -1.074  10.829 -10.097
   33    HG2  LYS   4           2HG      LYS   4  -0.749   9.709 -11.974
   34    HG3  LYS   4           1HG      LYS   4  -1.186   8.214 -11.145
   35    HD2  LYS   4           2HD      LYS   4  -3.048   8.070 -12.349
   36    HD3  LYS   4           1HD      LYS   4  -3.576   9.644 -11.753
   37    HE2  LYS   4           2HE      LYS   4  -1.647   9.319 -14.042
   38    HE3  LYS   4           1HE      LYS   4  -3.394   9.397 -14.266
   39    HZ1  LYS   4           3HZ      LYS   4  -3.329  11.573 -13.094
   40    HZ2  LYS   4           1HZ      LYS   4  -2.510  11.566 -14.576
   41    HZ3  LYS   4           2HZ      LYS   4  -1.640  11.501 -13.127
   42    H    LEU   5           H        LEU   5  -0.018   8.493  -7.007
   43    HA   LEU   5           HA       LEU   5  -0.358  10.875  -5.384
   44    HG   LEU   5           HG       LEU   5   0.566  10.723  -3.098
   45    HB2  LEU   5           2HB      LEU   5   0.034   8.267  -4.744
   46    HB3  LEU   5           1HB      LEU   5   1.663   8.894  -4.568
   47   HD11  LEU   5          1HD1      LEU   5  -1.547   8.587  -2.879
   48   HD12  LEU   5          2HD1      LEU   5  -1.752  10.110  -3.744
   49   HD13  LEU   5          3HD1      LEU   5  -1.476  10.116  -2.002
   50   HD21  LEU   5          3HD2      LEU   5   2.074   9.075  -2.205
   51   HD22  LEU   5          1HD2      LEU   5   0.802   7.853  -2.209
   52   HD23  LEU   5          2HD2      LEU   5   0.691   9.237  -1.122
   53    H    ILE   6           H        ILE   6   1.029  12.502  -5.105
   54    HA   ILE   6           HA       ILE   6   3.357  12.627  -6.842
   55    HB   ILE   6           HB       ILE   6   1.676  14.603  -5.397
   56   HG12  ILE   6          2HG1      ILE   6   3.156  14.616  -8.031
   57   HG13  ILE   6          1HG1      ILE   6   1.450  14.252  -7.789
   58   HG21  ILE   6          1HG2      ILE   6   4.607  15.155  -5.886
   59   HG22  ILE   6          2HG2      ILE   6   3.767  15.160  -4.336
   60   HG23  ILE   6          3HG2      ILE   6   3.393  16.387  -5.544
   61   HD11  ILE   6          3HD1      ILE   6   1.320  16.413  -8.486
   62   HD12  ILE   6          1HD1      ILE   6   2.861  16.860  -7.755
   63   HD13  ILE   6          2HD1      ILE   6   1.430  16.661  -6.743
   64    H    LYS   7           H        LYS   7   5.282  11.949  -6.101
   65    HA   LYS   7           HA       LYS   7   5.792  11.400  -3.369
   66    HB2  LYS   7           2HB      LYS   7   6.863  10.345  -5.471
   67    HB3  LYS   7           1HB      LYS   7   7.958  11.720  -5.427
   68    HG2  LYS   7           2HG      LYS   7   9.107  10.062  -4.284
   69    HG3  LYS   7           1HG      LYS   7   8.402  11.041  -2.997
   70    HD2  LYS   7           2HD      LYS   7   6.494   9.068  -3.675
   71    HD3  LYS   7           1HD      LYS   7   8.050   8.250  -3.547
   72    HE2  LYS   7           2HE      LYS   7   7.533   8.162  -1.356
   73    HE3  LYS   7           1HE      LYS   7   8.145   9.813  -1.343
   74    HZ1  LYS   7           3HZ      LYS   7   5.291   9.187  -1.829
   75    HZ2  LYS   7           1HZ      LYS   7   5.977  10.677  -1.414
   76    HZ3  LYS   7           2HZ      LYS   7   5.910   9.429  -0.275
   77    H    GLY   8           H        GLY   8   6.258  12.781  -1.803
   78    HA2  GLY   8           2HA      GLY   8   7.218  15.461  -2.471
   79    HA3  GLY   8           1HA      GLY   8   6.588  14.939  -0.918
   80    HA   PRO   9           HA       PRO   9  11.285  15.280  -0.746
   81    HB2  PRO   9           2HB      PRO   9  10.671  16.764   1.731
   82    HB3  PRO   9           1HB      PRO   9  11.743  17.199   0.397
   83    HG2  PRO   9           2HG      PRO   9   9.406  18.454   0.777
   84    HG3  PRO   9           1HG      PRO   9  10.035  18.131  -0.850
   85    HD2  PRO   9           2HD      PRO   9   7.911  16.675   0.685
   86    HD3  PRO   9           1HD      PRO   9   7.951  17.125  -1.033
   87    H    LYS  10           H        LYS  10   9.258  15.171   2.197
   88    HA   LYS  10           HA       LYS  10  10.935  13.507   3.683
   89    HB2  LYS  10           2HB      LYS  10   9.093  14.837   4.646
   90    HB3  LYS  10           1HB      LYS  10   7.927  13.750   3.910
   91    HG2  LYS  10           2HG      LYS  10   9.634  12.092   5.361
   92    HG3  LYS  10           1HG      LYS  10   9.369  13.499   6.392
   93    HD2  LYS  10           2HD      LYS  10   6.878  12.756   5.227
   94    HD3  LYS  10           1HD      LYS  10   7.628  11.309   5.903
   95    HE2  LYS  10           2HE      LYS  10   6.553  12.069   7.763
   96    HE3  LYS  10           1HE      LYS  10   8.076  12.939   7.941
   97    HZ1  LYS  10           3HZ      LYS  10   6.216  14.414   8.286
   98    HZ2  LYS  10           1HZ      LYS  10   5.567  14.023   6.773
   99    HZ3  LYS  10           2HZ      LYS  10   7.032  14.862   6.876
  100    H    GLY  11           H        GLY  11   7.766  12.078   3.180
  101    HA2  GLY  11           2HA      GLY  11   8.614  10.071   1.339
  102    HA3  GLY  11           1HA      GLY  11   8.705   9.484   2.989
  103    H    LEU  12           H        LEU  12   7.119   8.002   2.966
  104    HA   LEU  12           HA       LEU  12   4.521   8.584   1.838
  105    HG   LEU  12           HG       LEU  12   5.054   5.030   1.061
  106    HB2  LEU  12           2HB      LEU  12   5.772   6.183   3.123
  107    HB3  LEU  12           1HB      LEU  12   4.042   6.248   2.876
  108   HD11  LEU  12          1HD1      LEU  12   3.850   5.978  -0.601
  109   HD12  LEU  12          2HD1      LEU  12   4.530   7.582  -0.333
  110   HD13  LEU  12          3HD1      LEU  12   3.253   6.978   0.721
  111   HD21  LEU  12          3HD2      LEU  12   6.676   6.089  -0.450
  112   HD22  LEU  12          1HD2      LEU  12   7.305   5.920   1.189
  113   HD23  LEU  12          2HD2      LEU  12   6.741   7.490   0.617
  114    H    GLY  13           H        GLY  13   5.864   8.003   5.083
  115    HA2  GLY  13           2HA      GLY  13   5.146   8.809   7.118
  116    HA3  GLY  13           1HA      GLY  13   3.915   9.730   6.274
  117    H    PHE  14           H        PHE  14   4.389   6.208   6.250
  118    HA   PHE  14           HA       PHE  14   2.273   5.726   8.113
  119    HD1  PHE  14           2HD      PHE  14   2.217   2.975   5.178
  120    HD2  PHE  14           1HD      PHE  14   1.286   6.964   4.016
  121    HE1  PHE  14           2HE      PHE  14   2.701   2.402   2.837
  122    HE2  PHE  14           1HE      PHE  14   1.760   6.393   1.674
  123    HZ   PHE  14           HZ       PHE  14   2.471   4.112   1.081
  124    HB2  PHE  14           2HB      PHE  14   0.732   4.592   6.564
  125    HB3  PHE  14           1HB      PHE  14   0.888   6.301   6.195
  126    H    SER  15           H        SER  15   1.628   3.108   7.635
  127    HA   SER  15           HA       SER  15   4.186   1.748   7.265
  128    HG   SER  15           HG       SER  15   2.005   1.205  10.627
  129    HB2  SER  15           2HB      SER  15   3.209   0.175   9.145
  130    HB3  SER  15           1HB      SER  15   4.138   1.606   9.567
  131    H    ILE  16           H        ILE  16   3.798  -0.699   7.062
  132    HA   ILE  16           HA       ILE  16   1.186  -1.484   6.063
  133    HB   ILE  16           HB       ILE  16   1.695  -1.908   3.859
  134   HG12  ILE  16          2HG1      ILE  16   3.807  -3.115   4.235
  135   HG13  ILE  16          1HG1      ILE  16   3.878  -2.052   2.837
  136   HG21  ILE  16          1HG2      ILE  16   3.234   0.598   4.459
  137   HG22  ILE  16          2HG2      ILE  16   1.506   0.470   4.125
  138   HG23  ILE  16          3HG2      ILE  16   2.678   0.108   2.858
  139   HD11  ILE  16          3HD1      ILE  16   5.654  -2.184   4.976
  140   HD12  ILE  16          1HD1      ILE  16   4.769  -0.670   5.172
  141   HD13  ILE  16          2HD1      ILE  16   5.621  -1.000   3.665
  142    H    ALA  17           H        ALA  17   1.294  -3.765   5.213
  143    HA   ALA  17           HA       ALA  17   3.415  -5.405   6.393
  144    HB1  ALA  17           3HB      ALA  17   1.997  -6.065   8.003
  145    HB2  ALA  17           1HB      ALA  17   1.168  -6.958   6.731
  146    HB3  ALA  17           2HB      ALA  17   0.605  -5.348   7.192
  147    H    GLY  18           H        GLY  18   3.265  -7.724   5.326
  148    HA2  GLY  18           2HA      GLY  18   1.714  -8.274   3.138
  149    HA3  GLY  18           1HA      GLY  18   2.962  -7.238   2.491
  150    H    GLY  19           H        GLY  19   2.097 -10.347   2.503
  151    HA2  GLY  19           2HA      GLY  19   3.632 -11.875   1.450
  152    HA3  GLY  19           1HA      GLY  19   4.915 -11.197   2.439
  153    H    VAL  20           H        VAL  20   4.221 -13.966   2.154
  154    HA   VAL  20           HA       VAL  20   2.716 -14.905   4.350
  155    HB   VAL  20           HB       VAL  20   4.974 -16.350   2.937
  156   HG11  VAL  20          1HG1      VAL  20   2.709 -17.309   4.674
  157   HG12  VAL  20          2HG1      VAL  20   4.442 -17.510   4.936
  158   HG13  VAL  20          3HG1      VAL  20   3.643 -18.376   3.625
  159   HG21  VAL  20          3HG2      VAL  20   2.095 -15.946   2.224
  160   HG22  VAL  20          1HG2      VAL  20   2.937 -17.414   1.730
  161   HG23  VAL  20          2HG2      VAL  20   3.526 -15.839   1.199
  162    H    GLY  21           H        GLY  21   3.352 -15.600   6.416
  163    HA2  GLY  21           2HA      GLY  21   4.766 -15.891   8.256
  164    HA3  GLY  21           1HA      GLY  21   6.127 -15.418   7.252
  165    H    ASN  22           H        ASN  22   4.352 -12.985   6.516
  166    HA   ASN  22           HA       ASN  22   4.518 -11.411   8.964
  167    HB2  ASN  22           2HB      ASN  22   5.513  -9.563   7.310
  168    HB3  ASN  22           1HB      ASN  22   6.566 -10.642   8.202
  169   HD21  ASN  22          1HD2      ASN  22   4.780 -10.524   5.136
  170   HD22  ASN  22          2HD2      ASN  22   6.028 -11.260   4.196
  171    H    GLN  23           H        GLN  23   2.383 -12.531   7.193
  172    HA   GLN  23           HA       GLN  23   1.236 -10.551   5.581
  173    HB2  GLN  23           2HB      GLN  23   0.375 -13.121   6.762
  174    HB3  GLN  23           1HB      GLN  23  -0.913 -12.019   6.303
  175    HG2  GLN  23           2HG      GLN  23   0.084 -11.889   4.034
  176    HG3  GLN  23           1HG      GLN  23   1.243 -13.122   4.523
  177   HE21  GLN  23          1HE2      GLN  23   0.658 -15.221   4.474
  178   HE22  GLN  23          2HE2      GLN  23  -0.914 -15.787   4.036
  179    H    HIS  24           H        HIS  24  -0.538  -9.221   5.859
  180    HA   HIS  24           HA       HIS  24  -0.813  -8.084   8.525
  181    HD1  HIS  24           1HD      HIS  24  -0.453  -5.272   8.753
  182    HD2  HIS  24           2HD      HIS  24  -4.153  -5.738   6.937
  183    HE1  HIS  24           1HE      HIS  24  -1.909  -3.512   9.754
  184    HE2  HIS  24           2HE      HIS  24  -4.122  -3.731   8.577
  185    HB2  HIS  24           2HB      HIS  24  -0.504  -6.658   6.468
  186    HB3  HIS  24           1HB      HIS  24  -2.097  -7.168   5.945
  187    H    ILE  25           H        ILE  25  -2.617 -10.023   6.281
  188    HA   ILE  25           HA       ILE  25  -4.730 -10.364   8.253
  189    HB   ILE  25           HB       ILE  25  -5.507  -9.757   5.405
  190   HG12  ILE  25          2HG1      ILE  25  -5.371  -7.855   7.754
  191   HG13  ILE  25          1HG1      ILE  25  -4.480  -7.731   6.241
  192   HG21  ILE  25          1HG2      ILE  25  -7.705  -9.706   6.180
  193   HG22  ILE  25          2HG2      ILE  25  -7.205  -9.520   7.861
  194   HG23  ILE  25          3HG2      ILE  25  -6.987 -11.067   7.042
  195   HD11  ILE  25          3HD1      ILE  25  -7.403  -7.292   6.728
  196   HD12  ILE  25          1HD1      ILE  25  -6.748  -7.545   5.111
  197   HD13  ILE  25          2HD1      ILE  25  -6.210  -6.170   6.076
  198    HA   PRO  26           HA       PRO  26  -4.011 -14.578   6.996
  199    HB2  PRO  26           2HB      PRO  26  -6.403 -15.584   7.975
  200    HB3  PRO  26           1HB      PRO  26  -4.929 -15.364   8.923
  201    HG2  PRO  26           2HG      PRO  26  -7.336 -13.607   8.723
  202    HG3  PRO  26           1HG      PRO  26  -6.356 -14.012  10.144
  203    HD2  PRO  26           2HD      PRO  26  -6.105 -11.653   8.903
  204    HD3  PRO  26           1HD      PRO  26  -4.694 -12.489   9.586
  205    H    GLY  27           H        GLY  27  -4.285 -15.426   5.038
  206    HA2  GLY  27           2HA      GLY  27  -5.741 -16.435   3.400
  207    HA3  GLY  27           1HA      GLY  27  -6.919 -15.176   3.737
  208    H    ASP  28           H        ASP  28  -5.648 -12.857   3.478
  209    HA   ASP  28           HA       ASP  28  -4.814 -12.887   0.670
  210    HB2  ASP  28           2HB      ASP  28  -6.634 -11.295   2.002
  211    HB3  ASP  28           1HB      ASP  28  -5.217 -10.257   1.892
  212    H    ASN  29           H        ASN  29  -2.729 -12.899   0.288
  213    HA   ASN  29           HA       ASN  29  -0.812 -11.946   2.244
  214    HB2  ASN  29           2HB      ASN  29   0.163 -12.742  -0.427
  215    HB3  ASN  29           1HB      ASN  29   0.749 -13.187   1.172
  216   HD21  ASN  29          1HD2      ASN  29  -1.076 -14.139  -1.524
  217   HD22  ASN  29          2HD2      ASN  29  -1.671 -15.634  -0.894
  218    H    SER  30           H        SER  30  -2.627 -10.086   0.517
  219    HA   SER  30           HA       SER  30  -0.714  -8.546  -1.003
  220    HG   SER  30           HG       SER  30  -4.661  -7.946  -0.407
  221    HB2  SER  30           2HB      SER  30  -2.860  -6.898  -0.803
  222    HB3  SER  30           1HB      SER  30  -2.726  -8.165  -2.013
  223    H    ILE  31           H        ILE  31  -0.082  -6.352  -0.496
  224    HA   ILE  31           HA       ILE  31   0.515  -6.036   2.262
  225    HB   ILE  31           HB       ILE  31   1.071  -4.426  -0.202
  226   HG12  ILE  31          2HG1      ILE  31   3.377  -4.790   0.407
  227   HG13  ILE  31          1HG1      ILE  31   2.905  -5.486   1.952
  228   HG21  ILE  31          1HG2      ILE  31   1.364  -3.442   2.620
  229   HG22  ILE  31          2HG2      ILE  31   0.588  -2.645   1.252
  230   HG23  ILE  31          3HG2      ILE  31   2.343  -2.816   1.293
  231   HD11  ILE  31          3HD1      ILE  31   3.478  -7.304   0.612
  232   HD12  ILE  31          1HD1      ILE  31   2.641  -6.650  -0.791
  233   HD13  ILE  31          2HD1      ILE  31   1.718  -7.275   0.573
  234    H    TYR  32           H        TYR  32  -0.491  -4.929   3.828
  235    HA   TYR  32           HA       TYR  32  -2.651  -3.062   3.098
  236    HD1  TYR  32           2HD      TYR  32  -2.427  -6.561   3.261
  237    HD2  TYR  32           1HD      TYR  32  -5.777  -4.229   4.405
  238    HE1  TYR  32           2HE      TYR  32  -3.882  -8.054   1.962
  239    HE2  TYR  32           1HE      TYR  32  -7.263  -5.702   3.134
  240    HH   TYR  32           HH       TYR  32  -6.842  -8.496   2.331
  241    HB2  TYR  32           2HB      TYR  32  -2.528  -5.012   5.397
  242    HB3  TYR  32           1HB      TYR  32  -3.711  -3.717   5.292
  243    H    VAL  33           H        VAL  33  -2.906  -1.230   4.433
  244    HA   VAL  33           HA       VAL  33  -0.471  -0.316   5.692
  245    HB   VAL  33           HB       VAL  33  -3.105   1.053   5.132
  246   HG11  VAL  33          1HG1      VAL  33  -2.423   2.062   7.148
  247   HG12  VAL  33          2HG1      VAL  33  -1.857   3.145   5.875
  248   HG13  VAL  33          3HG1      VAL  33  -0.725   2.054   6.673
  249   HG21  VAL  33          3HG2      VAL  33  -2.023   1.113   3.137
  250   HG22  VAL  33          1HG2      VAL  33  -0.425   0.975   3.872
  251   HG23  VAL  33          2HG2      VAL  33  -1.269   2.524   3.878
  252    H    THR  34           H        THR  34  -0.069  -0.424   7.804
  253    HA   THR  34           HA       THR  34  -2.217  -1.288   9.592
  254    HB   THR  34           HB       THR  34  -0.233  -2.677   9.545
  255    HG1  THR  34           1HG      THR  34  -0.866  -2.890  11.536
  256   HG21  THR  34          3HG2      THR  34   1.854  -1.962   9.543
  257   HG22  THR  34          1HG2      THR  34   1.586  -0.963  10.971
  258   HG23  THR  34          2HG2      THR  34   1.221  -0.326   9.368
  259    H    LYS  35           H        LYS  35  -0.194   1.517   9.054
  260    HA   LYS  35           HA       LYS  35  -1.687   3.005  11.000
  261    HB2  LYS  35           2HB      LYS  35  -0.025   1.798  12.426
  262    HB3  LYS  35           1HB      LYS  35   1.259   2.618  11.547
  263    HG2  LYS  35           2HG      LYS  35   1.086   4.404  12.834
  264    HG3  LYS  35           1HG      LYS  35  -0.644   4.533  12.517
  265    HD2  LYS  35           2HD      LYS  35  -0.933   4.036  14.678
  266    HD3  LYS  35           1HD      LYS  35  -0.474   2.388  14.247
  267    HE2  LYS  35           2HE      LYS  35   1.944   3.717  14.537
  268    HE3  LYS  35           1HE      LYS  35   0.942   4.360  15.837
  269    HZ1  LYS  35           3HZ      LYS  35   0.478   2.075  16.531
  270    HZ2  LYS  35           1HZ      LYS  35   2.135   2.413  16.573
  271    HZ3  LYS  35           2HZ      LYS  35   1.493   1.487  15.312
  272    H    ILE  36           H        ILE  36  -1.921   4.995  10.202
  273    HA   ILE  36           HA       ILE  36   0.083   5.973   8.295
  274    HB   ILE  36           HB       ILE  36  -2.758   6.886   8.765
  275   HG12  ILE  36          2HG1      ILE  36  -1.402   5.327   6.560
  276   HG13  ILE  36          1HG1      ILE  36  -2.734   4.805   7.585
  277   HG21  ILE  36          1HG2      ILE  36  -1.822   7.974   6.374
  278   HG22  ILE  36          2HG2      ILE  36  -0.526   8.245   7.537
  279   HG23  ILE  36          3HG2      ILE  36  -2.152   8.834   7.878
  280   HD11  ILE  36          3HD1      ILE  36  -2.783   6.799   5.346
  281   HD12  ILE  36          1HD1      ILE  36  -4.093   6.651   6.518
  282   HD13  ILE  36          2HD1      ILE  36  -3.670   5.281   5.489
  283    H    ILE  37           H        ILE  37   1.452   7.542   8.869
  284    HA   ILE  37           HA       ILE  37   1.260   8.801  11.458
  285    HB   ILE  37           HB       ILE  37   3.299   8.924   9.238
  286   HG12  ILE  37          2HG1      ILE  37   4.695   8.084  11.302
  287   HG13  ILE  37          1HG1      ILE  37   3.113   7.643  11.935
  288   HG21  ILE  37          1HG2      ILE  37   3.370  11.118  10.109
  289   HG22  ILE  37          2HG2      ILE  37   4.705  10.244  10.858
  290   HG23  ILE  37          3HG2      ILE  37   3.226  10.542  11.770
  291   HD11  ILE  37          3HD1      ILE  37   2.740   6.098  10.224
  292   HD12  ILE  37          1HD1      ILE  37   4.426   5.866  10.683
  293   HD13  ILE  37          2HD1      ILE  37   4.029   6.766   9.222
  294    H    GLU  38           H        GLU  38   1.232  11.088  11.820
  295    HA   GLU  38           HA       GLU  38  -0.609  12.491  10.168
  296    HB2  GLU  38           2HB      GLU  38   0.976  13.169  12.612
  297    HB3  GLU  38           1HB      GLU  38   0.244  14.475  11.691
  298    HG2  GLU  38           2HG      GLU  38  -1.775  12.581  11.970
  299    HG3  GLU  38           1HG      GLU  38  -0.963  12.620  13.534
  300    H    GLY  39           H        GLY  39  -0.318  14.241   8.811
  301    HA2  GLY  39           2HA      GLY  39   0.733  15.635   7.331
  302    HA3  GLY  39           1HA      GLY  39   2.161  15.523   8.342
  303    H    GLY  40           H        GLY  40   1.000  12.487   7.242
  304    HA2  GLY  40           2HA      GLY  40   3.314  12.258   5.478
  305    HA3  GLY  40           1HA      GLY  40   2.318  10.936   6.065
  306    H    ALA  41           H        ALA  41   3.105  11.048   3.440
  307    HA   ALA  41           HA       ALA  41   1.628  12.288   1.529
  308    HB1  ALA  41           3HB      ALA  41   3.464  10.731   1.067
  309    HB2  ALA  41           1HB      ALA  41   2.044  10.382   0.080
  310    HB3  ALA  41           2HB      ALA  41   2.412   9.376   1.483
  311    H    ALA  42           H        ALA  42   0.716   9.073   2.829
  312    HA   ALA  42           HA       ALA  42  -1.815   9.005   1.604
  313    HB1  ALA  42           3HB      ALA  42  -0.852   6.958   2.335
  314    HB2  ALA  42           1HB      ALA  42  -2.313   7.211   3.292
  315    HB3  ALA  42           2HB      ALA  42  -0.728   7.535   3.997
  316    H    HIS  43           H        HIS  43  -0.868   9.899   4.915
  317    HA   HIS  43           HA       HIS  43  -3.358  10.382   6.014
  318    HD1  HIS  43           1HD      HIS  43  -1.975  14.048   7.355
  319    HD2  HIS  43           2HD      HIS  43  -3.148  10.587   9.331
  320    HE1  HIS  43           1HE      HIS  43  -3.205  14.830   9.399
  321    HE2  HIS  43           2HE      HIS  43  -3.838  12.719  10.624
  322    HB2  HIS  43           2HB      HIS  43  -1.247  10.393   7.285
  323    HB3  HIS  43           1HB      HIS  43  -0.798  11.912   6.525
  324    H    LYS  44           H        LYS  44  -1.246  12.745   4.377
  325    HA   LYS  44           HA       LYS  44  -3.033  14.915   4.536
  326    HB2  LYS  44           2HB      LYS  44  -0.735  14.347   2.664
  327    HB3  LYS  44           1HB      LYS  44  -1.622  15.864   2.662
  328    HG2  LYS  44           2HG      LYS  44  -0.885  16.415   4.835
  329    HG3  LYS  44           1HG      LYS  44  -0.277  14.782   5.120
  330    HD2  LYS  44           2HD      LYS  44   1.672  15.210   4.099
  331    HD3  LYS  44           1HD      LYS  44   0.892  16.073   2.771
  332    HE2  LYS  44           2HE      LYS  44   1.175  18.088   3.744
  333    HE3  LYS  44           1HE      LYS  44   0.868  17.466   5.364
  334    HZ1  LYS  44           3HZ      LYS  44   3.091  16.636   5.482
  335    HZ2  LYS  44           1HZ      LYS  44   3.165  18.261   5.018
  336    HZ3  LYS  44           2HZ      LYS  44   3.398  17.043   3.869
  337    H    ASP  45           H        ASP  45  -2.530  12.458   2.027
  338    HA   ASP  45           HA       ASP  45  -4.217  13.587   0.075
  339    HB2  ASP  45           2HB      ASP  45  -2.542  11.448   0.127
  340    HB3  ASP  45           1HB      ASP  45  -4.101  10.634   0.190
  341    H    GLY  46           H        GLY  46  -4.866  11.043   2.494
  342    HA2  GLY  46           2HA      GLY  46  -6.871  10.832   3.720
  343    HA3  GLY  46           1HA      GLY  46  -7.668  11.877   2.558
  344    H    LYS  47           H        LYS  47  -6.559  10.257   0.284
  345    HA   LYS  47           HA       LYS  47  -8.747   8.563  -0.124
  346    HB2  LYS  47           2HB      LYS  47  -6.028   8.511  -1.448
  347    HB3  LYS  47           1HB      LYS  47  -7.451   7.665  -2.038
  348    HG2  LYS  47           2HG      LYS  47  -7.594  10.609  -1.605
  349    HG3  LYS  47           1HG      LYS  47  -6.759   9.981  -3.027
  350    HD2  LYS  47           2HD      LYS  47  -8.740   8.827  -3.749
  351    HD3  LYS  47           1HD      LYS  47  -9.581   9.251  -2.257
  352    HE2  LYS  47           2HE      LYS  47 -10.378  10.753  -3.894
  353    HE3  LYS  47           1HE      LYS  47  -9.240  11.673  -2.911
  354    HZ1  LYS  47           3HZ      LYS  47  -7.572  11.421  -4.598
  355    HZ2  LYS  47           1HZ      LYS  47  -8.971  12.046  -5.314
  356    HZ3  LYS  47           2HZ      LYS  47  -8.573  10.415  -5.518
  357    H    LEU  48           H        LEU  48  -5.396   7.761   0.787
  358    HA   LEU  48           HA       LEU  48  -6.034   4.970   1.123
  359    HG   LEU  48           HG       LEU  48  -4.232   3.571   0.945
  360    HB2  LEU  48           2HB      LEU  48  -3.753   6.091   0.471
  361    HB3  LEU  48           1HB      LEU  48  -3.533   6.198   2.208
  362   HD11  LEU  48          1HD1      LEU  48  -1.941   3.055   0.567
  363   HD12  LEU  48          2HD1      LEU  48  -1.416   4.584   1.272
  364   HD13  LEU  48          3HD1      LEU  48  -2.280   4.572  -0.265
  365   HD21  LEU  48          3HD2      LEU  48  -3.390   2.633   2.880
  366   HD22  LEU  48          1HD2      LEU  48  -4.182   4.091   3.472
  367   HD23  LEU  48          2HD2      LEU  48  -2.428   4.058   3.281
  368    H    GLN  49           H        GLN  49  -6.781   4.012   2.870
  369    HA   GLN  49           HA       GLN  49  -6.410   5.252   5.500
  370    HB2  GLN  49           2HB      GLN  49  -8.710   4.710   6.107
  371    HB3  GLN  49           1HB      GLN  49  -8.679   5.793   4.727
  372    HG2  GLN  49           2HG      GLN  49  -8.877   2.848   4.293
  373    HG3  GLN  49           1HG      GLN  49 -10.302   3.764   4.775
  374   HE21  GLN  49          1HE2      GLN  49  -8.428   2.737   2.201
  375   HE22  GLN  49          2HE2      GLN  49  -9.086   3.759   0.975
  376    H    ILE  50           H        ILE  50  -6.200   3.790   7.221
  377    HA   ILE  50           HA       ILE  50  -4.917   1.408   6.789
  378    HB   ILE  50           HB       ILE  50  -5.849   0.734   9.136
  379   HG12  ILE  50          2HG1      ILE  50  -6.371   2.970  10.385
  380   HG13  ILE  50          1HG1      ILE  50  -6.874   3.543   8.803
  381   HG21  ILE  50          1HG2      ILE  50  -4.259   2.436  10.173
  382   HG22  ILE  50          2HG2      ILE  50  -4.014   3.027   8.529
  383   HG23  ILE  50          3HG2      ILE  50  -3.607   1.360   8.937
  384   HD11  ILE  50          3HD1      ILE  50  -7.995   0.956   9.629
  385   HD12  ILE  50          1HD1      ILE  50  -8.759   2.325   8.822
  386   HD13  ILE  50          2HD1      ILE  50  -8.508   2.358  10.567
  387    H    GLY  51           H        GLY  51  -5.457  -0.577   6.117
  388    HA2  GLY  51           2HA      GLY  51  -7.029  -2.465   6.427
  389    HA3  GLY  51           1HA      GLY  51  -8.321  -1.317   6.139
  390    H    ASP  52           H        ASP  52  -6.643  -0.025   3.933
  391    HA   ASP  52           HA       ASP  52  -7.701  -1.575   1.824
  392    HB2  ASP  52           2HB      ASP  52  -6.284   0.034   0.389
  393    HB3  ASP  52           1HB      ASP  52  -7.594   0.704   1.349
  394    H    LYS  53           H        LYS  53  -6.557  -2.634   0.114
  395    HA   LYS  53           HA       LYS  53  -3.983  -3.744   1.013
  396    HB2  LYS  53           2HB      LYS  53  -4.506  -5.685  -0.451
  397    HB3  LYS  53           1HB      LYS  53  -5.641  -5.467   0.866
  398    HG2  LYS  53           2HG      LYS  53  -6.670  -4.042  -1.333
  399    HG3  LYS  53           1HG      LYS  53  -6.150  -5.621  -1.926
  400    HD2  LYS  53           2HD      LYS  53  -7.583  -5.702   0.631
  401    HD3  LYS  53           1HD      LYS  53  -8.547  -5.106  -0.723
  402    HE2  LYS  53           2HE      LYS  53  -6.954  -7.663  -0.801
  403    HE3  LYS  53           1HE      LYS  53  -8.654  -7.588  -0.344
  404    HZ1  LYS  53           3HZ      LYS  53  -8.788  -6.316  -2.638
  405    HZ2  LYS  53           1HZ      LYS  53  -8.874  -8.003  -2.549
  406    HZ3  LYS  53           2HZ      LYS  53  -7.419  -7.251  -2.970
  407    H    LEU  54           H        LEU  54  -2.336  -4.002  -0.427
  408    HA   LEU  54           HA       LEU  54  -2.425  -2.170  -2.701
  409    HG   LEU  54           HG       LEU  54  -1.094  -0.566  -1.422
  410    HB2  LEU  54           2HB      LEU  54  -0.408  -2.913  -0.779
  411    HB3  LEU  54           1HB      LEU  54   0.197  -3.103  -2.415
  412   HD11  LEU  54          1HD1      LEU  54   1.134  -1.404  -0.307
  413   HD12  LEU  54          2HD1      LEU  54   0.922   0.283  -0.771
  414   HD13  LEU  54          3HD1      LEU  54   1.845  -0.806  -1.806
  415   HD21  LEU  54          3HD2      LEU  54   0.200  -1.454  -3.943
  416   HD22  LEU  54          1HD2      LEU  54   0.464   0.208  -3.418
  417   HD23  LEU  54          2HD2      LEU  54  -1.175  -0.378  -3.691
  418    H    LEU  55           H        LEU  55  -3.163  -3.122  -4.459
  419    HA   LEU  55           HA       LEU  55  -2.704  -5.846  -5.138
  420    HG   LEU  55           HG       LEU  55  -5.215  -5.505  -7.723
  421    HB2  LEU  55           2HB      LEU  55  -4.582  -4.186  -5.911
  422    HB3  LEU  55           1HB      LEU  55  -3.433  -3.754  -7.162
  423   HD11  LEU  55          1HD1      LEU  55  -3.166  -6.999  -8.702
  424   HD12  LEU  55          2HD1      LEU  55  -2.354  -5.473  -8.355
  425   HD13  LEU  55          3HD1      LEU  55  -3.758  -5.502  -9.422
  426   HD21  LEU  55          3HD2      LEU  55  -4.695  -6.750  -5.524
  427   HD22  LEU  55          1HD2      LEU  55  -3.339  -7.440  -6.417
  428   HD23  LEU  55          2HD2      LEU  55  -4.991  -7.693  -6.983
  429    H    ALA  56           H        ALA  56  -1.405  -2.743  -6.378
  430    HA   ALA  56           HA       ALA  56   1.099  -4.131  -7.000
  431    HB1  ALA  56           3HB      ALA  56  -0.603  -2.786  -9.107
  432    HB2  ALA  56           1HB      ALA  56  -0.032  -4.454  -9.081
  433    HB3  ALA  56           2HB      ALA  56   1.110  -3.132  -9.333
  434    H    VAL  57           H        VAL  57   2.888  -2.692  -7.393
  435    HA   VAL  57           HA       VAL  57   2.414   0.134  -6.709
  436    HB   VAL  57           HB       VAL  57   4.592  -1.604  -5.528
  437   HG11  VAL  57          1HG1      VAL  57   5.647   0.430  -5.672
  438   HG12  VAL  57          2HG1      VAL  57   4.840   0.595  -4.113
  439   HG13  VAL  57          3HG1      VAL  57   4.144   1.344  -5.549
  440   HG21  VAL  57          3HG2      VAL  57   2.496  -2.048  -4.447
  441   HG22  VAL  57          1HG2      VAL  57   2.158  -0.324  -4.294
  442   HG23  VAL  57          2HG2      VAL  57   3.476  -1.048  -3.375
  443    H    ASN  58           H        ASN  58   2.978   1.197  -8.507
  444    HA   ASN  58           HA       ASN  58   4.183   1.984 -10.261
  445    HB2  ASN  58           2HB      ASN  58   6.335   0.913  -8.469
  446    HB3  ASN  58           1HB      ASN  58   6.756   1.512 -10.070
  447   HD21  ASN  58          1HD2      ASN  58   7.435   3.525 -10.039
  448   HD22  ASN  58          2HD2      ASN  58   6.877   4.775  -8.985
  449    H    ASN  59           H        ASN  59   2.855  -0.345 -10.756
  450    HA   ASN  59           HA       ASN  59   2.654  -1.726 -12.589
  451    HB2  ASN  59           2HB      ASN  59   4.620  -0.336 -13.553
  452    HB3  ASN  59           1HB      ASN  59   5.617  -1.704 -13.071
  453   HD21  ASN  59          1HD2      ASN  59   5.738  -3.410 -14.383
  454   HD22  ASN  59          2HD2      ASN  59   4.760  -3.657 -15.786
  455    H    VAL  60           H        VAL  60   4.772  -2.259  -9.931
  456    HA   VAL  60           HA       VAL  60   5.075  -5.101 -10.504
  457    HB   VAL  60           HB       VAL  60   6.543  -5.259  -8.695
  458   HG11  VAL  60          1HG1      VAL  60   8.125  -4.076  -9.692
  459   HG12  VAL  60          2HG1      VAL  60   7.524  -2.605  -8.927
  460   HG13  VAL  60          3HG1      VAL  60   6.897  -3.104 -10.499
  461   HG21  VAL  60          3HG2      VAL  60   5.719  -4.465  -6.764
  462   HG22  VAL  60          1HG2      VAL  60   4.940  -3.088  -7.541
  463   HG23  VAL  60          2HG2      VAL  60   6.661  -3.029  -7.166
  464    H    CYS  61           H        CYS  61   4.120  -6.765  -9.243
  465    HA   CYS  61           HA       CYS  61   1.635  -5.945  -7.977
  466    HG   CYS  61           HG       CYS  61   3.071  -9.710  -7.469
  467    HB2  CYS  61           2HB      CYS  61   1.045  -8.277  -7.929
  468    HB3  CYS  61           1HB      CYS  61   1.666  -7.877  -9.525
  469    H    LEU  62           H        LEU  62   1.256  -5.872  -5.842
  470    HA   LEU  62           HA       LEU  62   3.466  -6.619  -4.071
  471    HG   LEU  62           HG       LEU  62   3.321  -5.399  -1.721
  472    HB2  LEU  62           2HB      LEU  62   2.200  -4.251  -4.279
  473    HB3  LEU  62           1HB      LEU  62   1.224  -5.001  -3.034
  474   HD11  LEU  62          1HD1      LEU  62   5.145  -5.365  -3.069
  475   HD12  LEU  62          2HD1      LEU  62   5.166  -3.678  -2.552
  476   HD13  LEU  62          3HD1      LEU  62   4.485  -4.111  -4.120
  477   HD21  LEU  62          3HD2      LEU  62   3.390  -3.241  -0.814
  478   HD22  LEU  62          1HD2      LEU  62   1.769  -3.390  -1.491
  479   HD23  LEU  62          2HD2      LEU  62   3.006  -2.486  -2.360
  480    H    GLU  63           H        GLU  63   1.489  -8.547  -5.130
  481    HA   GLU  63           HA       GLU  63   0.165  -9.337  -2.620
  482    HB2  GLU  63           2HB      GLU  63  -0.962  -8.986  -5.102
  483    HB3  GLU  63           1HB      GLU  63  -0.696 -10.724  -5.054
  484    HG2  GLU  63           2HG      GLU  63  -1.954  -9.439  -2.697
  485    HG3  GLU  63           1HG      GLU  63  -2.919  -9.623  -4.157
  486    H    GLU  64           H        GLU  64   2.590 -10.275  -4.892
  487    HA   GLU  64           HA       GLU  64   2.768 -12.906  -3.585
  488    HB2  GLU  64           2HB      GLU  64   2.428 -12.329  -6.336
  489    HB3  GLU  64           1HB      GLU  64   4.050 -12.967  -6.130
  490    HG2  GLU  64           2HG      GLU  64   2.682 -14.736  -4.655
  491    HG3  GLU  64           1HG      GLU  64   1.438 -14.288  -5.820
  492    H    VAL  65           H        VAL  65   4.045 -10.885  -2.371
  493    HA   VAL  65           HA       VAL  65   6.850 -11.571  -2.815
  494    HB   VAL  65           HB       VAL  65   7.533  -9.168  -2.547
  495   HG11  VAL  65          1HG1      VAL  65   7.379  -8.668  -4.870
  496   HG12  VAL  65          2HG1      VAL  65   5.944  -9.676  -5.056
  497   HG13  VAL  65          3HG1      VAL  65   7.508 -10.420  -4.719
  498   HG21  VAL  65          3HG2      VAL  65   5.532  -8.190  -1.684
  499   HG22  VAL  65          1HG2      VAL  65   4.603  -8.709  -3.090
  500   HG23  VAL  65          2HG2      VAL  65   5.844  -7.468  -3.262
  501    H    THR  66           H        THR  66   8.201 -11.285  -1.048
  502    HA   THR  66           HA       THR  66   7.019 -11.613   1.504
  503    HB   THR  66           HB       THR  66   9.400 -11.301   2.340
  504    HG1  THR  66           1HG      THR  66  10.405 -10.086   0.871
  505   HG21  THR  66          3HG2      THR  66  10.313 -13.321   1.252
  506   HG22  THR  66          1HG2      THR  66   8.941 -13.303   0.144
  507   HG23  THR  66          2HG2      THR  66   8.674 -13.532   1.872
  508    H    HIS  67           H        HIS  67   7.668 -10.179   3.419
  509    HA   HIS  67           HA       HIS  67   6.505  -7.671   3.073
  510    HD1  HIS  67           1HD      HIS  67   5.050  -7.016   5.993
  511    HD2  HIS  67           2HD      HIS  67   8.860  -5.474   5.429
  512    HE1  HIS  67           1HE      HIS  67   4.924  -4.615   6.710
  513    HE2  HIS  67           2HE      HIS  67   7.201  -3.679   6.245
  514    HB2  HIS  67           2HB      HIS  67   6.674  -8.760   5.286
  515    HB3  HIS  67           1HB      HIS  67   8.386  -8.366   5.345
  516    H    GLU  68           H        GLU  68   9.937  -8.547   2.960
  517    HA   GLU  68           HA       GLU  68  11.122  -6.076   2.975
  518    HB2  GLU  68           2HB      GLU  68  11.800  -8.412   1.172
  519    HB3  GLU  68           1HB      GLU  68  12.849  -7.031   1.460
  520    HG2  GLU  68           2HG      GLU  68  12.445  -7.772   3.989
  521    HG3  GLU  68           1HG      GLU  68  12.214  -9.332   3.202
  522    H    GLU  69           H        GLU  69   9.823  -7.738   0.096
  523    HA   GLU  69           HA       GLU  69  10.235  -5.617  -1.710
  524    HB2  GLU  69           2HB      GLU  69   9.385  -8.193  -1.962
  525    HB3  GLU  69           1HB      GLU  69   7.886  -7.318  -2.244
  526    HG2  GLU  69           2HG      GLU  69  10.451  -6.767  -3.713
  527    HG3  GLU  69           1HG      GLU  69   9.189  -7.852  -4.296
  528    H    ALA  70           H        ALA  70   7.613  -6.293   0.532
  529    HA   ALA  70           HA       ALA  70   5.647  -4.533  -0.451
  530    HB1  ALA  70           3HB      ALA  70   4.842  -4.528   1.927
  531    HB2  ALA  70           1HB      ALA  70   6.261  -5.482   2.346
  532    HB3  ALA  70           2HB      ALA  70   5.067  -6.132   1.226
  533    H    VAL  71           H        VAL  71   8.330  -4.064   1.802
  534    HA   VAL  71           HA       VAL  71   7.729  -1.274   2.230
  535    HB   VAL  71           HB       VAL  71  10.000  -3.047   3.119
  536   HG11  VAL  71          1HG1      VAL  71   9.808  -0.081   3.192
  537   HG12  VAL  71          2HG1      VAL  71  11.221  -1.121   3.018
  538   HG13  VAL  71          3HG1      VAL  71  10.474  -0.908   4.601
  539   HG21  VAL  71          3HG2      VAL  71   8.155  -1.509   4.894
  540   HG22  VAL  71          1HG2      VAL  71   9.025  -3.011   5.208
  541   HG23  VAL  71          2HG2      VAL  71   7.614  -3.013   4.150
  542    H    THR  72           H        THR  72  10.020  -3.157   0.311
  543    HA   THR  72           HA       THR  72  11.676  -1.041  -0.503
  544    HB   THR  72           HB       THR  72  11.025  -3.643  -1.899
  545    HG1  THR  72           1HG      THR  72  12.218  -4.405  -0.370
  546   HG21  THR  72          3HG2      THR  72  12.017  -2.251  -3.554
  547   HG22  THR  72          1HG2      THR  72  13.265  -3.349  -2.965
  548   HG23  THR  72          2HG2      THR  72  13.237  -1.673  -2.419
  549    H    ALA  73           H        ALA  73   8.563  -2.162  -1.710
  550    HA   ALA  73           HA       ALA  73   8.693  -0.559  -4.104
  551    HB1  ALA  73           3HB      ALA  73   6.585  -1.478  -4.654
  552    HB2  ALA  73           1HB      ALA  73   6.272  -1.952  -2.984
  553    HB3  ALA  73           2HB      ALA  73   7.516  -2.784  -3.920
  554    H    LEU  74           H        LEU  74   7.233  -0.346  -0.880
  555    HA   LEU  74           HA       LEU  74   5.662   1.983  -1.532
  556    HG   LEU  74           HG       LEU  74   3.924   0.264   1.244
  557    HB2  LEU  74           2HB      LEU  74   6.271   0.415   0.939
  558    HB3  LEU  74           1HB      LEU  74   5.642   2.040   1.108
  559   HD11  LEU  74          1HD1      LEU  74   3.293   1.845  -1.199
  560   HD12  LEU  74          2HD1      LEU  74   3.642   2.698   0.304
  561   HD13  LEU  74          3HD1      LEU  74   2.313   1.543   0.237
  562   HD21  LEU  74          3HD2      LEU  74   5.218  -0.867  -0.869
  563   HD22  LEU  74          1HD2      LEU  74   3.815  -0.137  -1.649
  564   HD23  LEU  74          2HD2      LEU  74   3.594  -1.287  -0.330
  565    H    LYS  75           H        LYS  75   8.743   1.254  -0.007
  566    HA   LYS  75           HA       LYS  75   9.233   3.950   0.849
  567    HB2  LYS  75           2HB      LYS  75  11.251   3.197   1.721
  568    HB3  LYS  75           1HB      LYS  75  10.216   1.783   1.826
  569    HG2  LYS  75           2HG      LYS  75  11.447   0.604   0.350
  570    HG3  LYS  75           1HG      LYS  75  11.814   2.015  -0.642
  571    HD2  LYS  75           2HD      LYS  75  13.877   1.462   0.271
  572    HD3  LYS  75           1HD      LYS  75  13.298   2.738   1.343
  573    HE2  LYS  75           2HE      LYS  75  12.689   1.186   3.020
  574    HE3  LYS  75           1HE      LYS  75  12.856  -0.180   1.918
  575    HZ1  LYS  75           3HZ      LYS  75  15.100   1.538   2.830
  576    HZ2  LYS  75           1HZ      LYS  75  15.223   0.150   1.869
  577    HZ3  LYS  75           2HZ      LYS  75  14.720   0.024   3.480
  578    H    ASN  76           H        ASN  76   9.869   2.194  -2.100
  579    HA   ASN  76           HA       ASN  76  12.003   3.597  -3.150
  580    HB2  ASN  76           2HB      ASN  76  11.196   1.636  -4.271
  581    HB3  ASN  76           1HB      ASN  76   9.630   2.382  -4.568
  582   HD21  ASN  76          1HD2      ASN  76  12.900   3.691  -4.978
  583   HD22  ASN  76          2HD2      ASN  76  12.744   4.009  -6.666
  584    H    THR  77           H        THR  77  11.823   5.770  -2.523
  585    HA   THR  77           HA       THR  77   9.681   7.415  -3.533
  586    HB   THR  77           HB       THR  77  10.844   9.272  -2.466
  587    HG1  THR  77           1HG      THR  77  12.927   7.402  -1.996
  588   HG21  THR  77          3HG2      THR  77   9.712   7.240  -1.115
  589   HG22  THR  77          1HG2      THR  77  10.333   8.709  -0.362
  590   HG23  THR  77          2HG2      THR  77  11.324   7.249  -0.399
  591    H    SER  78           H        SER  78   9.586   8.403  -5.410
  592    HA   SER  78           HA       SER  78  12.050   9.067  -6.856
  593    HG   SER  78           HG       SER  78  11.428   7.385  -9.783
  594    HB2  SER  78           2HB      SER  78  10.965   6.873  -7.657
  595    HB3  SER  78           1HB      SER  78   9.667   7.887  -8.289
  596    H    ASP  79           H        ASP  79   9.925   9.717  -9.121
  597    HA   ASP  79           HA       ASP  79   9.484  12.449  -8.209
  598    HB2  ASP  79           2HB      ASP  79  10.353  12.144 -10.478
  599    HB3  ASP  79           1HB      ASP  79   8.974  11.131 -10.895
  600    H    PHE  80           H        PHE  80   7.575   9.832  -9.680
  601    HA   PHE  80           HA       PHE  80   5.231  10.751  -8.153
  602    HD1  PHE  80           1HD      PHE  80   4.935  12.872 -10.663
  603    HD2  PHE  80           2HD      PHE  80   2.278   9.761  -9.493
  604    HE1  PHE  80           1HE      PHE  80   3.113  14.510 -10.461
  605    HE2  PHE  80           2HE      PHE  80   0.452  11.394  -9.290
  606    HZ   PHE  80           HZ       PHE  80   0.872  13.769  -9.766
  607    HB2  PHE  80           2HB      PHE  80   5.511  10.541 -10.977
  608    HB3  PHE  80           1HB      PHE  80   4.417   9.259 -10.460
  609    H    VAL  81           H        VAL  81   3.560   8.899  -7.896
  610    HA   VAL  81           HA       VAL  81   4.823   6.273  -7.783
  611    HB   VAL  81           HB       VAL  81   3.769   7.824  -5.437
  612   HG11  VAL  81          1HG1      VAL  81   2.376   5.989  -5.178
  613   HG12  VAL  81          2HG1      VAL  81   3.793   5.537  -4.231
  614   HG13  VAL  81          3HG1      VAL  81   3.561   4.865  -5.845
  615   HG21  VAL  81          3HG2      VAL  81   5.722   6.786  -4.325
  616   HG22  VAL  81          1HG2      VAL  81   6.160   7.761  -5.728
  617   HG23  VAL  81          2HG2      VAL  81   6.136   6.002  -5.849
  618    H    TYR  82           H        TYR  82   3.465   4.900  -8.777
  619    HA   TYR  82           HA       TYR  82   0.624   5.610  -8.926
  620    HD1  TYR  82           1HD      TYR  82  -0.462   2.471 -10.649
  621    HD2  TYR  82           2HD      TYR  82   0.517   6.400 -11.957
  622    HE1  TYR  82           1HE      TYR  82  -2.558   2.565 -11.915
  623    HE2  TYR  82           2HE      TYR  82  -1.584   6.507 -13.224
  624    HH   TYR  82           HH       TYR  82  -3.867   5.387 -13.117
  625    HB2  TYR  82           2HB      TYR  82   2.186   4.981 -10.945
  626    HB3  TYR  82           1HB      TYR  82   1.808   3.333 -10.462
  627    H    LEU  83           H        LEU  83  -0.273   4.928  -7.096
  628    HA   LEU  83           HA       LEU  83   0.303   2.327  -5.979
  629    HG   LEU  83           HG       LEU  83  -1.395   1.844  -4.035
  630    HB2  LEU  83           2HB      LEU  83  -0.142   4.462  -4.675
  631    HB3  LEU  83           1HB      LEU  83  -1.829   4.261  -5.103
  632   HD11  LEU  83          1HD1      LEU  83   0.954   2.285  -3.540
  633   HD12  LEU  83          2HD1      LEU  83   0.024   2.055  -2.059
  634   HD13  LEU  83          3HD1      LEU  83   0.494   3.679  -2.563
  635   HD21  LEU  83          3HD2      LEU  83  -3.078   3.612  -3.437
  636   HD22  LEU  83          1HD2      LEU  83  -1.882   4.269  -2.322
  637   HD23  LEU  83          2HD2      LEU  83  -2.499   2.633  -2.089
  638    H    LYS  84           H        LYS  84  -0.736   0.511  -6.415
  639    HA   LYS  84           HA       LYS  84  -3.378   0.651  -7.698
  640    HB2  LYS  84           2HB      LYS  84  -1.098  -1.246  -8.033
  641    HB3  LYS  84           1HB      LYS  84  -2.735  -1.808  -8.324
  642    HG2  LYS  84           2HG      LYS  84  -2.504   0.619  -9.704
  643    HG3  LYS  84           1HG      LYS  84  -1.014  -0.270 -10.021
  644    HD2  LYS  84           2HD      LYS  84  -2.655  -0.834 -11.700
  645    HD3  LYS  84           1HD      LYS  84  -2.367  -2.236 -10.670
  646    HE2  LYS  84           2HE      LYS  84  -4.722  -2.069 -11.033
  647    HE3  LYS  84           1HE      LYS  84  -4.399  -1.602  -9.363
  648    HZ1  LYS  84           3HZ      LYS  84  -4.598   0.434 -11.493
  649    HZ2  LYS  84           1HZ      LYS  84  -4.804   0.619  -9.823
  650    HZ3  LYS  84           2HZ      LYS  84  -5.986  -0.170 -10.739
  651    H    VAL  85           H        VAL  85  -4.870   0.422  -6.148
  652    HA   VAL  85           HA       VAL  85  -4.423  -1.668  -4.127
  653    HB   VAL  85           HB       VAL  85  -6.203   0.780  -4.006
  654   HG11  VAL  85          1HG1      VAL  85  -7.219  -0.014  -2.179
  655   HG12  VAL  85          2HG1      VAL  85  -5.712  -0.640  -1.507
  656   HG13  VAL  85          3HG1      VAL  85  -6.619  -1.595  -2.679
  657   HG21  VAL  85          3HG2      VAL  85  -4.661   1.499  -2.219
  658   HG22  VAL  85          1HG2      VAL  85  -3.865   1.348  -3.785
  659   HG23  VAL  85          2HG2      VAL  85  -3.646   0.098  -2.561
  660    H    ALA  86           H        ALA  86  -5.707  -3.403  -4.129
  661    HA   ALA  86           HA       ALA  86  -7.892  -3.544  -6.049
  662    HB1  ALA  86           3HB      ALA  86  -6.744  -5.488  -6.271
  663    HB2  ALA  86           1HB      ALA  86  -7.869  -6.001  -5.014
  664    HB3  ALA  86           2HB      ALA  86  -6.232  -5.511  -4.584
  665    H    LYS  87           H        LYS  87 -10.000  -4.288  -5.509
  666    HA   LYS  87           HA       LYS  87 -10.920  -3.292  -2.943
  667    HB2  LYS  87           2HB      LYS  87 -12.021  -3.470  -5.540
  668    HB3  LYS  87           1HB      LYS  87 -13.009  -4.498  -4.511
  669    HG2  LYS  87           2HG      LYS  87 -13.022  -2.454  -2.914
  670    HG3  LYS  87           1HG      LYS  87 -12.549  -1.554  -4.357
  671    HD2  LYS  87           2HD      LYS  87 -14.623  -3.100  -5.274
  672    HD3  LYS  87           1HD      LYS  87 -15.130  -2.719  -3.627
  673    HE2  LYS  87           2HE      LYS  87 -15.990  -0.933  -4.801
  674    HE3  LYS  87           1HE      LYS  87 -14.437  -0.291  -4.270
  675    HZ1  LYS  87           3HZ      LYS  87 -14.880   0.181  -6.609
  676    HZ2  LYS  87           1HZ      LYS  87 -14.971  -1.475  -6.942
  677    HZ3  LYS  87           2HZ      LYS  87 -13.510  -0.794  -6.430
  678    HA   PRO  88           HA       PRO  88 -10.760  -7.465  -1.286
  679    HB2  PRO  88           2HB      PRO  88 -11.592  -6.838   1.216
  680    HB3  PRO  88           1HB      PRO  88  -9.949  -6.524   0.648
  681    HG2  PRO  88           2HG      PRO  88 -12.272  -4.648   0.861
  682    HG3  PRO  88           1HG      PRO  88 -10.574  -4.379   1.297
  683    HD2  PRO  88           2HD      PRO  88 -11.656  -3.474  -1.020
  684    HD3  PRO  88           1HD      PRO  88  -9.954  -3.953  -0.879
  685    H    THR  89           H        THR  89 -12.336  -8.862  -1.891
  686    HA   THR  89           HA       THR  89 -14.932  -8.718  -0.657
  687    HB   THR  89           HB       THR  89 -15.324  -7.240  -2.544
  688    HG1  THR  89           1HG      THR  89 -17.110  -8.397  -2.237
  689   HG21  THR  89          3HG2      THR  89 -13.519  -8.153  -4.022
  690   HG22  THR  89          1HG2      THR  89 -15.060  -7.831  -4.815
  691   HG23  THR  89          2HG2      THR  89 -14.609  -9.486  -4.404
  692    H    GLY  90           H        GLY  90 -15.733 -10.712  -0.327
  693    HA2  GLY  90           2HA      GLY  90 -14.283 -12.958  -1.556
  694    HA3  GLY  90           1HA      GLY  90 -15.185 -13.026  -0.050
  695    H    SER  91           H        SER  91 -15.386 -14.798  -2.337
  696    HA   SER  91           HA       SER  91 -18.056 -14.183  -3.386
  697    HG   SER  91           HG       SER  91 -15.467 -16.862  -5.037
  698    HB2  SER  91           2HB      SER  91 -17.597 -16.127  -4.929
  699    HB3  SER  91           1HB      SER  91 -16.497 -14.762  -5.119
  700    H    HIS  92           H        HIS  92 -16.255 -16.872  -1.893
  701    HA   HIS  92           HA       HIS  92 -18.686 -18.337  -1.348
  702    HD1  HIS  92           1HD      HIS  92 -14.493 -18.881  -2.509
  703    HD2  HIS  92           2HD      HIS  92 -15.244 -18.546   1.565
  704    HE1  HIS  92           1HE      HIS  92 -12.296 -18.235  -1.472
  705    HE2  HIS  92           2HE      HIS  92 -12.803 -17.928   0.977
  706    HB2  HIS  92           2HB      HIS  92 -17.111 -19.929  -0.176
  707    HB3  HIS  92           1HB      HIS  92 -16.789 -19.677  -1.888
  708    HA   ARG 301           HA       ARG 301   2.404 -11.212   9.876
  709    HE   ARG 301           HE       ARG 301  -1.004 -14.569  11.611
  710    H1   ARG 301           1HT      ARG 301   2.448 -13.379  10.784
  711    H2   ARG 301           2HT      ARG 301   3.401 -12.851  12.111
  712    H3   ARG 301           3HT      ARG 301   4.050 -12.828  10.523
  713    HB2  ARG 301           2HB      ARG 301   1.675 -11.477  12.794
  714    HB3  ARG 301           1HB      ARG 301   1.211 -10.083  11.828
  715    HG2  ARG 301           2HG      ARG 301  -0.509 -11.168  10.949
  716    HG3  ARG 301           1HG      ARG 301   0.505 -12.538  10.493
  717    HD2  ARG 301           2HD      ARG 301   0.076 -12.486  13.344
  718    HD3  ARG 301           1HD      ARG 301  -1.460 -12.457  12.483
  719   HH11  ARG 301          1HH1      ARG 301   1.674 -13.434  13.569
  720   HH12  ARG 301          2HH1      ARG 301   2.410 -14.996  13.680
  721   HH21  ARG 301          1HH2      ARG 301  -0.026 -16.620  11.765
  722   HH22  ARG 301          2HH2      ARG 301   1.447 -16.803  12.658
  723    H    ARG 302           H        ARG 302   3.411  -9.315   9.555
  724    HA   ARG 302           HA       ARG 302   5.015  -8.108  11.654
  725    HE   ARG 302           HE       ARG 302   8.451  -8.880   8.311
  726    HB2  ARG 302           2HB      ARG 302   6.570  -9.661  10.513
  727    HB3  ARG 302           1HB      ARG 302   6.240  -8.845   8.992
  728    HG2  ARG 302           2HG      ARG 302   7.402  -6.946   9.601
  729    HG3  ARG 302           1HG      ARG 302   7.259  -7.287  11.326
  730    HD2  ARG 302           2HD      ARG 302   9.545  -7.636  10.491
  731    HD3  ARG 302           1HD      ARG 302   8.832  -9.116  11.128
  732   HH11  ARG 302          1HH1      ARG 302  10.815  -9.754  10.742
  733   HH12  ARG 302          2HH1      ARG 302  11.685 -10.817   9.689
  734   HH21  ARG 302          1HH2      ARG 302   9.600 -10.283   6.929
  735   HH22  ARG 302          2HH2      ARG 302  10.996 -11.118   7.524
  736    H    GLU 303           H        GLU 303   4.805  -5.973  11.623
  737    HA   GLU 303           HA       GLU 303   3.928  -4.676   9.123
  738    HB2  GLU 303           2HB      GLU 303   2.992  -4.292  11.955
  739    HB3  GLU 303           1HB      GLU 303   2.827  -3.002  10.774
  740    HG2  GLU 303           2HG      GLU 303   0.774  -4.090  10.726
  741    HG3  GLU 303           1HG      GLU 303   1.626  -4.718   9.319
  742    H    THR 304           H        THR 304   5.318  -3.224   8.377
  743    HA   THR 304           HA       THR 304   7.055  -1.807  10.286
  744    HB   THR 304           HB       THR 304   7.768  -3.483   8.000
  745    HG1  THR 304           1HG      THR 304   8.974  -4.037   9.611
  746   HG21  THR 304          3HG2      THR 304   8.156  -1.383   6.862
  747   HG22  THR 304          1HG2      THR 304   9.677  -2.179   7.258
  748   HG23  THR 304          2HG2      THR 304   9.124  -0.809   8.222
  749    H    GLN 305           H        GLN 305   7.610   0.340   9.769
  750    HA   GLN 305           HA       GLN 305   5.619   1.725   8.228
  751    HB2  GLN 305           2HB      GLN 305   7.491   2.410  10.285
  752    HB3  GLN 305           1HB      GLN 305   7.693   3.511   8.926
  753    HG2  GLN 305           2HG      GLN 305   5.833   4.600   9.423
  754    HG3  GLN 305           1HG      GLN 305   4.905   3.110   9.522
  755   HE21  GLN 305          1HE2      GLN 305   6.941   5.332  11.319
  756   HE22  GLN 305          2HE2      GLN 305   6.382   4.869  12.887
  757    H    VAL 306           H        VAL 306   6.122   3.305   6.569
  758    HA   VAL 306           HA       VAL 306   8.601   2.907   5.088
  759    HB   VAL 306           HB       VAL 306   7.308   2.584   2.948
  760   HG11  VAL 306          1HG1      VAL 306   8.488   0.768   4.225
  761   HG12  VAL 306          2HG1      VAL 306   7.175   0.221   3.183
  762   HG13  VAL 306          3HG1      VAL 306   6.926   0.341   4.925
  763   HG21  VAL 306          3HG2      VAL 306   5.023   1.379   3.521
  764   HG22  VAL 306          1HG2      VAL 306   5.113   3.125   3.286
  765   HG23  VAL 306          2HG2      VAL 306   5.083   2.455   4.918
  Start of MODEL   26
    1    HA   MET   1           HA       MET   1  -9.063   2.158  -8.092
    2    H1   MET   1           1HT      MET   1  -8.238   0.173  -9.002
    3    H2   MET   1           2HT      MET   1  -9.564  -0.196  -7.978
    4    H3   MET   1           3HT      MET   1  -7.958  -0.494  -7.447
    5    HB2  MET   1           2HB      MET   1  -9.321   0.453  -5.757
    6    HB3  MET   1           1HB      MET   1  -8.502   1.955  -5.354
    7    HG2  MET   1           2HG      MET   1 -10.976   2.115  -6.982
    8    HG3  MET   1           1HG      MET   1 -11.129   1.721  -5.271
    9    HE1  MET   1           3HE      MET   1 -10.871   4.946  -3.506
   10    HE2  MET   1           1HE      MET   1 -10.135   3.356  -3.301
   11    HE3  MET   1           2HE      MET   1 -11.824   3.490  -3.793
   12    H    GLU   2           H        GLU   2  -7.466   3.487  -8.601
   13    HA   GLU   2           HA       GLU   2  -4.822   3.070  -7.369
   14    HB2  GLU   2           2HB      GLU   2  -3.861   4.071  -9.467
   15    HB3  GLU   2           1HB      GLU   2  -4.589   2.485  -9.667
   16    HG2  GLU   2           2HG      GLU   2  -6.330   4.822 -10.166
   17    HG3  GLU   2           1HG      GLU   2  -5.038   4.524 -11.327
   18    H    ILE   3           H        ILE   3  -3.483   5.012  -7.156
   19    HA   ILE   3           HA       ILE   3  -4.884   7.566  -7.202
   20    HB   ILE   3           HB       ILE   3  -3.585   6.393  -4.729
   21   HG12  ILE   3          2HG1      ILE   3  -6.021   7.317  -3.954
   22   HG13  ILE   3          1HG1      ILE   3  -6.375   6.821  -5.604
   23   HG21  ILE   3          1HG2      ILE   3  -4.837   8.933  -4.283
   24   HG22  ILE   3          2HG2      ILE   3  -3.615   9.073  -5.547
   25   HG23  ILE   3          3HG2      ILE   3  -3.176   8.430  -3.966
   26   HD11  ILE   3          3HD1      ILE   3  -5.564   5.176  -3.263
   27   HD12  ILE   3          1HD1      ILE   3  -5.166   4.620  -4.888
   28   HD13  ILE   3          2HD1      ILE   3  -6.847   4.909  -4.441
   29    H    LYS   4           H        LYS   4  -3.483   9.263  -7.686
   30    HA   LYS   4           HA       LYS   4  -0.703   8.479  -8.175
   31    HB2  LYS   4           2HB      LYS   4  -2.569   9.965  -9.679
   32    HB3  LYS   4           1HB      LYS   4  -1.338  11.108  -9.162
   33    HG2  LYS   4           2HG      LYS   4   0.393   9.603 -10.083
   34    HG3  LYS   4           1HG      LYS   4  -0.889   8.548 -10.682
   35    HD2  LYS   4           2HD      LYS   4  -1.086   9.801 -12.506
   36    HD3  LYS   4           1HD      LYS   4  -1.454  11.212 -11.514
   37    HE2  LYS   4           2HE      LYS   4   0.447  11.679 -12.934
   38    HE3  LYS   4           1HE      LYS   4   0.958  11.628 -11.249
   39    HZ1  LYS   4           3HZ      LYS   4   1.188   9.262 -13.011
   40    HZ2  LYS   4           1HZ      LYS   4   1.989   9.570 -11.551
   41    HZ3  LYS   4           2HZ      LYS   4   2.402  10.438 -12.944
   42    H    LEU   5           H        LEU   5   0.154   8.654  -6.172
   43    HA   LEU   5           HA       LEU   5  -0.076  11.142  -4.681
   44    HG   LEU   5           HG       LEU   5  -1.173   9.568  -2.969
   45    HB2  LEU   5           2HB      LEU   5   0.730   8.409  -4.087
   46    HB3  LEU   5           1HB      LEU   5   1.819   9.586  -3.379
   47   HD11  LEU   5          1HD1      LEU   5   1.076   8.486  -1.292
   48   HD12  LEU   5          2HD1      LEU   5  -0.343   7.632  -1.897
   49   HD13  LEU   5          3HD1      LEU   5  -0.519   8.855  -0.639
   50   HD21  LEU   5          3HD2      LEU   5  -0.119  11.781  -2.767
   51   HD22  LEU   5          1HD2      LEU   5   1.000  11.126  -1.571
   52   HD23  LEU   5          2HD2      LEU   5  -0.727  11.188  -1.222
   53    H    ILE   6           H        ILE   6   1.295  12.776  -4.741
   54    HA   ILE   6           HA       ILE   6   3.714  12.555  -6.348
   55    HB   ILE   6           HB       ILE   6   2.187  14.456  -6.736
   56   HG12  ILE   6          2HG1      ILE   6   4.881  15.288  -5.633
   57   HG13  ILE   6          1HG1      ILE   6   4.604  14.633  -7.243
   58   HG21  ILE   6          1HG2      ILE   6   1.598  14.634  -4.244
   59   HG22  ILE   6          2HG2      ILE   6   1.744  16.128  -5.169
   60   HG23  ILE   6          3HG2      ILE   6   3.058  15.615  -4.111
   61   HD11  ILE   6          3HD1      ILE   6   2.890  16.696  -7.290
   62   HD12  ILE   6          1HD1      ILE   6   4.576  16.810  -7.796
   63   HD13  ILE   6          2HD1      ILE   6   4.104  17.328  -6.178
   64    H    LYS   7           H        LYS   7   5.729  12.479  -5.528
   65    HA   LYS   7           HA       LYS   7   6.349  11.914  -2.925
   66    HB2  LYS   7           2HB      LYS   7   7.892  11.651  -4.836
   67    HB3  LYS   7           1HB      LYS   7   8.125  13.392  -4.869
   68    HG2  LYS   7           2HG      LYS   7   9.928  12.907  -3.626
   69    HG3  LYS   7           1HG      LYS   7   8.760  12.889  -2.305
   70    HD2  LYS   7           2HD      LYS   7   8.546  10.343  -3.231
   71    HD3  LYS   7           1HD      LYS   7  10.249  10.679  -3.548
   72    HE2  LYS   7           2HE      LYS   7  10.094  11.641  -1.064
   73    HE3  LYS   7           1HE      LYS   7   8.796  10.450  -0.973
   74    HZ1  LYS   7           3HZ      LYS   7  11.631   9.935  -1.698
   75    HZ2  LYS   7           1HZ      LYS   7  10.402   8.775  -1.778
   76    HZ3  LYS   7           2HZ      LYS   7  10.840   9.441  -0.288
   77    H    GLY   8           H        GLY   8   6.115  13.006  -1.102
   78    HA2  GLY   8           2HA      GLY   8   5.875  15.912  -1.152
   79    HA3  GLY   8           1HA      GLY   8   5.521  14.861   0.210
   80    HA   PRO   9           HA       PRO   9   9.591  16.866   1.111
   81    HB2  PRO   9           2HB      PRO   9   8.497  17.731   3.633
   82    HB3  PRO   9           1HB      PRO   9   8.979  18.721   2.254
   83    HG2  PRO   9           2HG      PRO   9   6.390  18.439   3.101
   84    HG3  PRO   9           1HG      PRO   9   6.847  18.829   1.434
   85    HD2  PRO   9           2HD      PRO   9   6.100  16.178   2.622
   86    HD3  PRO   9           1HD      PRO   9   5.593  16.900   1.075
   87    H    LYS  10           H        LYS  10   8.709  14.075   1.609
   88    HA   LYS  10           HA       LYS  10  10.672  13.290   3.435
   89    HB2  LYS  10           2HB      LYS  10   8.790  12.190   5.026
   90    HB3  LYS  10           1HB      LYS  10   9.584  13.716   5.379
   91    HG2  LYS  10           2HG      LYS  10   7.703  14.938   4.441
   92    HG3  LYS  10           1HG      LYS  10   6.912  13.422   4.013
   93    HD2  LYS  10           2HD      LYS  10   6.392  12.919   6.196
   94    HD3  LYS  10           1HD      LYS  10   7.733  13.865   6.843
   95    HE2  LYS  10           2HE      LYS  10   6.592  15.895   6.543
   96    HE3  LYS  10           1HE      LYS  10   5.405  15.165   5.462
   97    HZ1  LYS  10           3HZ      LYS  10   5.658  14.634   8.376
   98    HZ2  LYS  10           1HZ      LYS  10   4.528  13.911   7.343
   99    HZ3  LYS  10           2HZ      LYS  10   4.460  15.575   7.639
  100    H    GLY  11           H        GLY  11   7.373  12.031   2.881
  101    HA2  GLY  11           2HA      GLY  11   7.879  10.280   0.823
  102    HA3  GLY  11           1HA      GLY  11   8.352   9.413   2.276
  103    H    LEU  12           H        LEU  12   6.646   7.923   1.586
  104    HA   LEU  12           HA       LEU  12   3.977   8.450   1.300
  105    HG   LEU  12           HG       LEU  12   5.397   6.625  -0.039
  106    HB2  LEU  12           2HB      LEU  12   5.384   6.101   2.533
  107    HB3  LEU  12           1HB      LEU  12   3.644   6.132   2.340
  108   HD11  LEU  12          1HD1      LEU  12   6.370   4.638   0.764
  109   HD12  LEU  12          2HD1      LEU  12   5.214   4.142  -0.474
  110   HD13  LEU  12          3HD1      LEU  12   4.807   3.970   1.235
  111   HD21  LEU  12          3HD2      LEU  12   2.990   4.985  -0.266
  112   HD22  LEU  12          1HD2      LEU  12   3.518   6.370  -1.220
  113   HD23  LEU  12          2HD2      LEU  12   2.689   6.623   0.316
  114    H    GLY  13           H        GLY  13   5.726   8.004   4.361
  115    HA2  GLY  13           2HA      GLY  13   5.217   8.731   6.485
  116    HA3  GLY  13           1HA      GLY  13   3.967   9.733   5.771
  117    H    PHE  14           H        PHE  14   4.429   6.208   5.978
  118    HA   PHE  14           HA       PHE  14   2.357   5.833   7.874
  119    HD1  PHE  14           2HD      PHE  14   2.456   3.047   5.091
  120    HD2  PHE  14           1HD      PHE  14   0.835   6.757   3.768
  121    HE1  PHE  14           2HE      PHE  14   2.785   2.355   2.757
  122    HE2  PHE  14           1HE      PHE  14   1.154   6.063   1.433
  123    HZ   PHE  14           HZ       PHE  14   2.130   3.861   0.925
  124    HB2  PHE  14           2HB      PHE  14   0.738   4.638   6.467
  125    HB3  PHE  14           1HB      PHE  14   0.884   6.324   6.002
  126    H    SER  15           H        SER  15   1.669   3.185   7.490
  127    HA   SER  15           HA       SER  15   4.238   1.830   7.156
  128    HG   SER  15           HG       SER  15   1.955   1.325  10.447
  129    HB2  SER  15           2HB      SER  15   3.186   0.278   9.054
  130    HB3  SER  15           1HB      SER  15   4.196   1.665   9.443
  131    H    ILE  16           H        ILE  16   3.784  -0.669   7.111
  132    HA   ILE  16           HA       ILE  16   1.219  -1.409   6.006
  133    HB   ILE  16           HB       ILE  16   1.817  -1.983   3.843
  134   HG12  ILE  16          2HG1      ILE  16   4.023  -3.044   4.567
  135   HG13  ILE  16          1HG1      ILE  16   3.944  -2.365   2.949
  136   HG21  ILE  16          1HG2      ILE  16   2.843  -0.004   2.787
  137   HG22  ILE  16          2HG2      ILE  16   3.279   0.581   4.392
  138   HG23  ILE  16          3HG2      ILE  16   1.581   0.393   3.953
  139   HD11  ILE  16          3HD1      ILE  16   5.570  -0.933   3.371
  140   HD12  ILE  16          1HD1      ILE  16   5.875  -1.880   4.830
  141   HD13  ILE  16          2HD1      ILE  16   4.851  -0.444   4.907
  142    H    ALA  17           H        ALA  17   1.338  -3.723   5.197
  143    HA   ALA  17           HA       ALA  17   3.327  -5.373   6.562
  144    HB1  ALA  17           3HB      ALA  17   1.027  -6.843   6.890
  145    HB2  ALA  17           1HB      ALA  17   0.484  -5.200   7.240
  146    HB3  ALA  17           2HB      ALA  17   1.823  -5.901   8.149
  147    H    GLY  18           H        GLY  18   3.120  -7.737   5.591
  148    HA2  GLY  18           2HA      GLY  18   1.654  -8.309   3.361
  149    HA3  GLY  18           1HA      GLY  18   2.958  -7.336   2.729
  150    H    GLY  19           H        GLY  19   2.014 -10.395   2.704
  151    HA2  GLY  19           2HA      GLY  19   3.501 -12.016   1.789
  152    HA3  GLY  19           1HA      GLY  19   4.803 -11.313   2.730
  153    H    VAL  20           H        VAL  20   4.280 -14.044   2.625
  154    HA   VAL  20           HA       VAL  20   2.718 -14.990   4.776
  155    HB   VAL  20           HB       VAL  20   5.145 -16.312   3.532
  156   HG11  VAL  20          1HG1      VAL  20   4.689 -17.444   5.545
  157   HG12  VAL  20          2HG1      VAL  20   3.922 -18.409   4.284
  158   HG13  VAL  20          3HG1      VAL  20   2.945 -17.347   5.299
  159   HG21  VAL  20          3HG2      VAL  20   3.239 -15.655   1.974
  160   HG22  VAL  20          1HG2      VAL  20   2.270 -16.850   2.837
  161   HG23  VAL  20          2HG2      VAL  20   3.723 -17.350   1.973
  162    H    GLY  21           H        GLY  21   3.237 -15.447   6.913
  163    HA2  GLY  21           2HA      GLY  21   4.541 -15.579   8.846
  164    HA3  GLY  21           1HA      GLY  21   5.951 -15.146   7.894
  165    H    ASN  22           H        ASN  22   4.302 -12.781   6.860
  166    HA   ASN  22           HA       ASN  22   4.328 -11.076   9.233
  167    HB2  ASN  22           2HB      ASN  22   5.280  -9.302   7.457
  168    HB3  ASN  22           1HB      ASN  22   6.345 -10.279   8.448
  169   HD21  ASN  22          1HD2      ASN  22   4.531 -10.739   5.421
  170   HD22  ASN  22          2HD2      ASN  22   5.869 -11.382   4.537
  171    H    GLN  23           H        GLN  23   2.248 -12.356   7.394
  172    HA   GLN  23           HA       GLN  23   1.031 -10.482   5.755
  173    HB2  GLN  23           2HB      GLN  23  -0.384 -12.605   7.371
  174    HB3  GLN  23           1HB      GLN  23  -0.960 -11.849   5.895
  175    HG2  GLN  23           2HG      GLN  23   0.662 -12.962   4.584
  176    HG3  GLN  23           1HG      GLN  23   1.549 -13.495   6.012
  177   HE21  GLN  23          1HE2      GLN  23   1.130 -15.458   6.776
  178   HE22  GLN  23          2HE2      GLN  23  -0.232 -16.432   6.352
  179    H    HIS  24           H        HIS  24  -0.657  -9.071   5.986
  180    HA   HIS  24           HA       HIS  24  -0.951  -7.867   8.617
  181    HD1  HIS  24           1HD      HIS  24  -0.591  -5.023   8.770
  182    HD2  HIS  24           2HD      HIS  24  -4.261  -5.578   6.921
  183    HE1  HIS  24           1HE      HIS  24  -2.067  -3.228   9.680
  184    HE2  HIS  24           2HE      HIS  24  -4.257  -3.495   8.465
  185    HB2  HIS  24           2HB      HIS  24  -0.598  -6.495   6.541
  186    HB3  HIS  24           1HB      HIS  24  -2.180  -7.006   5.991
  187    H    ILE  25           H        ILE  25  -2.724  -9.966   6.525
  188    HA   ILE  25           HA       ILE  25  -4.887 -10.093   8.457
  189    HB   ILE  25           HB       ILE  25  -5.572  -9.662   5.550
  190   HG12  ILE  25          2HG1      ILE  25  -5.532  -7.658   7.815
  191   HG13  ILE  25          1HG1      ILE  25  -4.589  -7.595   6.330
  192   HG21  ILE  25          1HG2      ILE  25  -7.198 -10.906   6.908
  193   HG22  ILE  25          2HG2      ILE  25  -7.827  -9.343   6.383
  194   HG23  ILE  25          3HG2      ILE  25  -7.264  -9.555   8.041
  195   HD11  ILE  25          3HD1      ILE  25  -7.529  -7.151   6.693
  196   HD12  ILE  25          1HD1      ILE  25  -6.812  -7.461   5.112
  197   HD13  ILE  25          2HD1      ILE  25  -6.318  -6.047   6.044
  198    HA   PRO  26           HA       PRO  26  -4.269 -14.438   7.709
  199    HB2  PRO  26           2HB      PRO  26  -7.170 -14.508   8.426
  200    HB3  PRO  26           1HB      PRO  26  -5.833 -15.482   9.051
  201    HG2  PRO  26           2HG      PRO  26  -6.834 -13.486  10.491
  202    HG3  PRO  26           1HG      PRO  26  -5.088 -13.796  10.461
  203    HD2  PRO  26           2HD      PRO  26  -6.659 -11.648   9.116
  204    HD3  PRO  26           1HD      PRO  26  -5.017 -11.596   9.790
  205    H    GLY  27           H        GLY  27  -4.245 -15.375   5.760
  206    HA2  GLY  27           2HA      GLY  27  -5.332 -16.445   3.937
  207    HA3  GLY  27           1HA      GLY  27  -6.685 -15.343   4.127
  208    H    ASP  28           H        ASP  28  -5.726 -12.887   3.948
  209    HA   ASP  28           HA       ASP  28  -4.756 -12.761   1.212
  210    HB2  ASP  28           2HB      ASP  28  -6.441 -11.142   2.840
  211    HB3  ASP  28           1HB      ASP  28  -5.059 -10.158   2.372
  212    H    ASN  29           H        ASN  29  -2.622 -12.880   0.908
  213    HA   ASN  29           HA       ASN  29  -0.772 -11.873   2.916
  214    HB2  ASN  29           2HB      ASN  29  -0.147 -13.195   0.271
  215    HB3  ASN  29           1HB      ASN  29   0.971 -12.926   1.606
  216   HD21  ASN  29          1HD2      ASN  29   1.303 -14.570   2.902
  217   HD22  ASN  29          2HD2      ASN  29   0.246 -15.918   3.131
  218    H    SER  30           H        SER  30  -2.480 -10.145   0.941
  219    HA   SER  30           HA       SER  30  -0.635  -8.791  -0.737
  220    HG   SER  30           HG       SER  30  -4.330  -8.954  -0.333
  221    HB2  SER  30           2HB      SER  30  -3.080  -7.408   0.300
  222    HB3  SER  30           1HB      SER  30  -2.395  -7.403  -1.324
  223    H    ILE  31           H        ILE  31  -0.618  -6.202  -0.401
  224    HA   ILE  31           HA       ILE  31   0.684  -5.857   2.204
  225    HB   ILE  31           HB       ILE  31   0.888  -3.994  -0.160
  226   HG12  ILE  31          2HG1      ILE  31   2.090  -5.654  -1.102
  227   HG13  ILE  31          1HG1      ILE  31   3.340  -5.138   0.013
  228   HG21  ILE  31          1HG2      ILE  31   1.360  -3.036   2.080
  229   HG22  ILE  31          2HG2      ILE  31   2.740  -3.008   0.982
  230   HG23  ILE  31          3HG2      ILE  31   2.655  -4.218   2.262
  231   HD11  ILE  31          3HD1      ILE  31   1.829  -7.628  -0.099
  232   HD12  ILE  31          1HD1      ILE  31   1.946  -6.938   1.516
  233   HD13  ILE  31          2HD1      ILE  31   3.411  -7.289   0.601
  234    H    TYR  32           H        TYR  32  -0.551  -5.060   3.759
  235    HA   TYR  32           HA       TYR  32  -2.591  -3.042   3.087
  236    HD1  TYR  32           2HD      TYR  32  -2.374  -6.603   3.266
  237    HD2  TYR  32           1HD      TYR  32  -5.653  -4.140   4.395
  238    HE1  TYR  32           2HE      TYR  32  -3.891  -8.061   1.996
  239    HE2  TYR  32           1HE      TYR  32  -7.187  -5.582   3.140
  240    HH   TYR  32           HH       TYR  32  -6.390  -7.559   0.842
  241    HB2  TYR  32           2HB      TYR  32  -2.401  -5.009   5.360
  242    HB3  TYR  32           1HB      TYR  32  -3.588  -3.715   5.306
  243    H    VAL  33           H        VAL  33  -2.739  -1.143   4.250
  244    HA   VAL  33           HA       VAL  33  -0.344  -0.219   5.537
  245    HB   VAL  33           HB       VAL  33  -3.012   1.099   5.024
  246   HG11  VAL  33          1HG1      VAL  33  -2.259   2.080   7.058
  247   HG12  VAL  33          2HG1      VAL  33  -1.874   3.215   5.765
  248   HG13  VAL  33          3HG1      VAL  33  -0.605   2.206   6.461
  249   HG21  VAL  33          3HG2      VAL  33  -1.922   1.104   3.009
  250   HG22  VAL  33          1HG2      VAL  33  -0.322   1.144   3.749
  251   HG23  VAL  33          2HG2      VAL  33  -1.306   2.606   3.698
  252    H    THR  34           H        THR  34   0.051  -0.005   7.675
  253    HA   THR  34           HA       THR  34  -2.001  -1.033   9.508
  254    HB   THR  34           HB       THR  34  -0.308  -1.823  10.908
  255    HG1  THR  34           1HG      THR  34   1.473  -0.778  11.221
  256   HG21  THR  34          3HG2      THR  34  -0.037  -2.406   8.143
  257   HG22  THR  34          1HG2      THR  34   0.346  -3.417   9.535
  258   HG23  THR  34          2HG2      THR  34   1.569  -2.340   8.865
  259    H    LYS  35           H        LYS  35   0.054   1.788   8.991
  260    HA   LYS  35           HA       LYS  35  -1.557   3.320  10.843
  261    HB2  LYS  35           2HB      LYS  35   1.402   2.978  11.385
  262    HB3  LYS  35           1HB      LYS  35   0.331   4.088  12.227
  263    HG2  LYS  35           2HG      LYS  35  -0.942   2.190  13.105
  264    HG3  LYS  35           1HG      LYS  35   0.146   1.082  12.267
  265    HD2  LYS  35           2HD      LYS  35   1.778   1.330  13.797
  266    HD3  LYS  35           1HD      LYS  35   1.491   3.063  13.967
  267    HE2  LYS  35           2HE      LYS  35  -0.511   1.149  15.072
  268    HE3  LYS  35           1HE      LYS  35   0.999   1.401  15.945
  269    HZ1  LYS  35           3HZ      LYS  35  -0.726   2.890  16.730
  270    HZ2  LYS  35           1HZ      LYS  35  -0.930   3.525  15.175
  271    HZ3  LYS  35           2HZ      LYS  35   0.522   3.772  16.006
  272    H    ILE  36           H        ILE  36  -1.900   5.219   9.851
  273    HA   ILE  36           HA       ILE  36   0.058   6.170   7.901
  274    HB   ILE  36           HB       ILE  36  -2.802   6.956   8.434
  275   HG12  ILE  36          2HG1      ILE  36  -1.427   5.900   5.952
  276   HG13  ILE  36          1HG1      ILE  36  -2.327   4.907   7.094
  277   HG21  ILE  36          1HG2      ILE  36  -0.768   8.323   6.685
  278   HG22  ILE  36          2HG2      ILE  36  -1.748   9.029   7.970
  279   HG23  ILE  36          3HG2      ILE  36  -2.508   8.511   6.465
  280   HD11  ILE  36          3HD1      ILE  36  -4.169   5.320   5.956
  281   HD12  ILE  36          1HD1      ILE  36  -3.280   6.380   4.864
  282   HD13  ILE  36          2HD1      ILE  36  -4.012   7.036   6.330
  283    H    ILE  37           H        ILE  37   1.536   7.625   8.496
  284    HA   ILE  37           HA       ILE  37   1.423   8.978  11.009
  285    HB   ILE  37           HB       ILE  37   3.360   8.984   8.714
  286   HG12  ILE  37          2HG1      ILE  37   4.828   8.411  10.857
  287   HG13  ILE  37          1HG1      ILE  37   3.259   7.950  11.509
  288   HG21  ILE  37          1HG2      ILE  37   3.330  10.888  11.036
  289   HG22  ILE  37          2HG2      ILE  37   3.480  11.249   9.316
  290   HG23  ILE  37          3HG2      ILE  37   4.812  10.474  10.171
  291   HD11  ILE  37          3HD1      ILE  37   4.276   6.903   8.889
  292   HD12  ILE  37          1HD1      ILE  37   2.965   6.278   9.889
  293   HD13  ILE  37          2HD1      ILE  37   4.636   6.127  10.431
  294    H    GLU  38           H        GLU  38   1.168  11.170  11.434
  295    HA   GLU  38           HA       GLU  38  -0.690  12.600   9.918
  296    HB2  GLU  38           2HB      GLU  38  -0.065  12.904  12.381
  297    HB3  GLU  38           1HB      GLU  38   1.272  13.891  11.808
  298    HG2  GLU  38           2HG      GLU  38  -0.197  15.502  10.884
  299    HG3  GLU  38           1HG      GLU  38  -1.595  14.451  11.104
  300    H    GLY  39           H        GLY  39  -0.563  14.268   8.465
  301    HA2  GLY  39           2HA      GLY  39   0.296  15.573   6.795
  302    HA3  GLY  39           1HA      GLY  39   1.746  15.701   7.773
  303    H    GLY  40           H        GLY  40   0.675  12.548   6.744
  304    HA2  GLY  40           2HA      GLY  40   3.075  12.330   5.083
  305    HA3  GLY  40           1HA      GLY  40   2.112  10.993   5.692
  306    H    ALA  41           H        ALA  41   2.875  10.884   3.132
  307    HA   ALA  41           HA       ALA  41   1.483  12.041   1.100
  308    HB1  ALA  41           3HB      ALA  41   2.073   9.090   1.212
  309    HB2  ALA  41           1HB      ALA  41   3.285  10.330   0.884
  310    HB3  ALA  41           2HB      ALA  41   1.932  10.105  -0.224
  311    H    ALA  42           H        ALA  42   0.413   9.039   2.755
  312    HA   ALA  42           HA       ALA  42  -2.094   8.945   1.443
  313    HB1  ALA  42           3HB      ALA  42  -0.963   7.575   3.858
  314    HB2  ALA  42           1HB      ALA  42  -1.358   6.899   2.278
  315    HB3  ALA  42           2HB      ALA  42  -2.649   7.355   3.389
  316    H    HIS  43           H        HIS  43  -1.175   9.976   4.728
  317    HA   HIS  43           HA       HIS  43  -3.624  10.639   5.772
  318    HD1  HIS  43           1HD      HIS  43  -2.380  14.344   6.949
  319    HD2  HIS  43           2HD      HIS  43  -3.278  10.876   9.054
  320    HE1  HIS  43           1HE      HIS  43  -3.600  15.108   9.007
  321    HE2  HIS  43           2HE      HIS  43  -4.048  13.001  10.315
  322    HB2  HIS  43           2HB      HIS  43  -1.420  10.743   6.957
  323    HB3  HIS  43           1HB      HIS  43  -1.100  12.265   6.137
  324    H    LYS  44           H        LYS  44  -1.504  12.794   3.876
  325    HA   LYS  44           HA       LYS  44  -3.316  14.974   3.841
  326    HB2  LYS  44           2HB      LYS  44  -0.941  14.300   2.104
  327    HB3  LYS  44           1HB      LYS  44  -1.843  15.803   1.966
  328    HG2  LYS  44           2HG      LYS  44  -1.220  16.470   4.168
  329    HG3  LYS  44           1HG      LYS  44  -0.511  14.889   4.505
  330    HD2  LYS  44           2HD      LYS  44   1.313  15.274   3.100
  331    HD3  LYS  44           1HD      LYS  44   0.489  16.574   2.235
  332    HE2  LYS  44           2HE      LYS  44   0.634  18.000   4.197
  333    HE3  LYS  44           1HE      LYS  44   1.391  16.698   5.112
  334    HZ1  LYS  44           3HZ      LYS  44   3.258  16.763   3.563
  335    HZ2  LYS  44           1HZ      LYS  44   3.037  18.259   4.319
  336    HZ3  LYS  44           2HZ      LYS  44   2.534  18.037   2.720
  337    H    ASP  45           H        ASP  45  -2.763  12.258   1.652
  338    HA   ASP  45           HA       ASP  45  -4.284  13.162  -0.527
  339    HB2  ASP  45           2HB      ASP  45  -2.705  11.092  -0.293
  340    HB3  ASP  45           1HB      ASP  45  -4.166  10.254   0.218
  341    H    GLY  46           H        GLY  46  -5.225  11.029   2.180
  342    HA2  GLY  46           2HA      GLY  46  -7.297  11.066   3.293
  343    HA3  GLY  46           1HA      GLY  46  -7.957  12.045   1.994
  344    H    LYS  47           H        LYS  47  -6.699   9.943   0.081
  345    HA   LYS  47           HA       LYS  47  -9.082   8.343  -0.117
  346    HB2  LYS  47           2HB      LYS  47  -7.725   9.293  -2.065
  347    HB3  LYS  47           1HB      LYS  47  -6.575   8.001  -1.752
  348    HG2  LYS  47           2HG      LYS  47  -7.903   7.130  -3.431
  349    HG3  LYS  47           1HG      LYS  47  -8.603   6.431  -1.971
  350    HD2  LYS  47           2HD      LYS  47 -10.573   7.276  -2.559
  351    HD3  LYS  47           1HD      LYS  47  -9.901   8.897  -2.373
  352    HE2  LYS  47           2HE      LYS  47  -9.372   9.063  -4.647
  353    HE3  LYS  47           1HE      LYS  47  -9.504   7.323  -4.896
  354    HZ1  LYS  47           3HZ      LYS  47 -11.885   7.478  -4.585
  355    HZ2  LYS  47           1HZ      LYS  47 -11.397   8.529  -5.818
  356    HZ3  LYS  47           2HZ      LYS  47 -11.775   9.140  -4.287
  357    H    LEU  48           H        LEU  48  -5.792   7.875   1.023
  358    HA   LEU  48           HA       LEU  48  -6.147   4.998   1.236
  359    HG   LEU  48           HG       LEU  48  -4.253   3.787   1.054
  360    HB2  LEU  48           2HB      LEU  48  -3.968   6.381   0.645
  361    HB3  LEU  48           1HB      LEU  48  -3.794   6.420   2.388
  362   HD11  LEU  48          1HD1      LEU  48  -2.520   4.593  -0.327
  363   HD12  LEU  48          2HD1      LEU  48  -1.734   3.594   0.896
  364   HD13  LEU  48          3HD1      LEU  48  -1.685   5.353   1.029
  365   HD21  LEU  48          3HD2      LEU  48  -3.295   2.901   2.943
  366   HD22  LEU  48          1HD2      LEU  48  -4.095   4.328   3.600
  367   HD23  LEU  48          2HD2      LEU  48  -2.359   4.357   3.288
  368    H    GLN  49           H        GLN  49  -7.026   4.079   2.947
  369    HA   GLN  49           HA       GLN  49  -6.757   5.350   5.582
  370    HB2  GLN  49           2HB      GLN  49  -9.008   4.903   6.128
  371    HB3  GLN  49           1HB      GLN  49  -9.057   5.614   4.525
  372    HG2  GLN  49           2HG      GLN  49  -9.088   2.641   4.947
  373    HG3  GLN  49           1HG      GLN  49 -10.558   3.612   4.988
  374   HE21  GLN  49          1HE2      GLN  49  -8.255   2.056   3.030
  375   HE22  GLN  49          2HE2      GLN  49  -8.877   2.550   1.496
  376    H    ILE  50           H        ILE  50  -6.399   3.963   7.306
  377    HA   ILE  50           HA       ILE  50  -4.972   1.660   6.975
  378    HB   ILE  50           HB       ILE  50  -6.842   1.987   9.318
  379   HG12  ILE  50          2HG1      ILE  50  -5.734   4.126   9.059
  380   HG13  ILE  50          1HG1      ILE  50  -5.010   3.273  10.416
  381   HG21  ILE  50          1HG2      ILE  50  -4.113   0.727   9.065
  382   HG22  ILE  50          2HG2      ILE  50  -5.651  -0.129   9.195
  383   HG23  ILE  50          3HG2      ILE  50  -5.064   0.842  10.546
  384   HD11  ILE  50          3HD1      ILE  50  -3.018   2.969   9.337
  385   HD12  ILE  50          1HD1      ILE  50  -3.530   4.518   8.667
  386   HD13  ILE  50          2HD1      ILE  50  -3.747   3.037   7.733
  387    H    GLY  51           H        GLY  51  -5.403  -0.299   6.164
  388    HA2  GLY  51           2HA      GLY  51  -6.792  -2.327   6.499
  389    HA3  GLY  51           1HA      GLY  51  -8.187  -1.287   6.297
  390    H    ASP  52           H        ASP  52  -6.537   0.157   4.070
  391    HA   ASP  52           HA       ASP  52  -7.674  -1.282   1.936
  392    HB2  ASP  52           2HB      ASP  52  -6.170   0.258   0.517
  393    HB3  ASP  52           1HB      ASP  52  -7.424   0.994   1.503
  394    H    LYS  53           H        LYS  53  -6.565  -2.276   0.142
  395    HA   LYS  53           HA       LYS  53  -4.119  -3.654   1.018
  396    HB2  LYS  53           2HB      LYS  53  -4.836  -5.411  -0.686
  397    HB3  LYS  53           1HB      LYS  53  -5.781  -5.294   0.787
  398    HG2  LYS  53           2HG      LYS  53  -6.663  -3.789  -1.626
  399    HG3  LYS  53           1HG      LYS  53  -6.951  -5.525  -1.531
  400    HD2  LYS  53           2HD      LYS  53  -7.749  -3.669   0.695
  401    HD3  LYS  53           1HD      LYS  53  -8.799  -3.956  -0.692
  402    HE2  LYS  53           2HE      LYS  53  -8.389  -6.465  -0.127
  403    HE3  LYS  53           1HE      LYS  53  -7.928  -5.842   1.454
  404    HZ1  LYS  53           3HZ      LYS  53 -10.268  -6.453   1.372
  405    HZ2  LYS  53           1HZ      LYS  53 -10.533  -5.355   0.114
  406    HZ3  LYS  53           2HZ      LYS  53 -10.088  -4.794   1.647
  407    H    LEU  54           H        LEU  54  -2.489  -4.012  -0.399
  408    HA   LEU  54           HA       LEU  54  -2.378  -2.113  -2.629
  409    HG   LEU  54           HG       LEU  54  -0.950  -0.558  -2.072
  410    HB2  LEU  54           2HB      LEU  54  -0.558  -2.705  -0.586
  411    HB3  LEU  54           1HB      LEU  54   0.170  -3.322  -2.056
  412   HD11  LEU  54          1HD1      LEU  54   1.361  -1.470  -0.471
  413   HD12  LEU  54          2HD1      LEU  54   0.288  -0.089  -0.240
  414   HD13  LEU  54          3HD1      LEU  54   1.585  -0.009  -1.433
  415   HD21  LEU  54          3HD2      LEU  54   0.041  -0.532  -4.052
  416   HD22  LEU  54          1HD2      LEU  54   0.562  -2.199  -3.809
  417   HD23  LEU  54          2HD2      LEU  54   1.599  -0.868  -3.299
  418    H    LEU  55           H        LEU  55  -3.025  -2.981  -4.446
  419    HA   LEU  55           HA       LEU  55  -2.621  -5.721  -5.156
  420    HG   LEU  55           HG       LEU  55  -2.599  -5.063  -8.229
  421    HB2  LEU  55           2HB      LEU  55  -4.573  -4.633  -5.998
  422    HB3  LEU  55           1HB      LEU  55  -3.632  -3.321  -6.674
  423   HD11  LEU  55          1HD1      LEU  55  -5.052  -6.674  -7.671
  424   HD12  LEU  55          2HD1      LEU  55  -3.588  -6.936  -6.722
  425   HD13  LEU  55          3HD1      LEU  55  -3.554  -7.149  -8.472
  426   HD21  LEU  55          3HD2      LEU  55  -4.298  -3.375  -8.875
  427   HD22  LEU  55          1HD2      LEU  55  -5.558  -4.551  -8.501
  428   HD23  LEU  55          2HD2      LEU  55  -4.408  -4.872  -9.801
  429    H    ALA  56           H        ALA  56  -1.328  -2.596  -6.346
  430    HA   ALA  56           HA       ALA  56   1.235  -3.865  -6.843
  431    HB1  ALA  56           3HB      ALA  56  -0.487  -2.919  -9.142
  432    HB2  ALA  56           1HB      ALA  56   0.194  -4.528  -8.894
  433    HB3  ALA  56           2HB      ALA  56   1.253  -3.169  -9.281
  434    H    VAL  57           H        VAL  57   2.934  -2.353  -7.380
  435    HA   VAL  57           HA       VAL  57   2.265   0.489  -7.304
  436    HB   VAL  57           HB       VAL  57   4.361   0.555  -5.586
  437   HG11  VAL  57          1HG1      VAL  57   2.574   0.861  -3.792
  438   HG12  VAL  57          2HG1      VAL  57   1.406   0.521  -5.069
  439   HG13  VAL  57          3HG1      VAL  57   2.488   1.905  -5.210
  440   HG21  VAL  57          3HG2      VAL  57   4.348  -1.902  -5.346
  441   HG22  VAL  57          1HG2      VAL  57   2.707  -1.810  -4.706
  442   HG23  VAL  57          2HG2      VAL  57   4.041  -1.066  -3.824
  443    H    ASN  58           H        ASN  58   3.387   1.461  -8.850
  444    HA   ASN  58           HA       ASN  58   5.046   2.039 -10.292
  445    HB2  ASN  58           2HB      ASN  58   6.888   0.409  -8.528
  446    HB3  ASN  58           1HB      ASN  58   7.365   1.640  -9.692
  447   HD21  ASN  58          1HD2      ASN  58   6.572   1.012  -6.490
  448   HD22  ASN  58          2HD2      ASN  58   6.430   2.642  -5.939
  449    H    ASN  59           H        ASN  59   3.433  -0.166 -10.889
  450    HA   ASN  59           HA       ASN  59   3.258  -1.595 -12.670
  451    HB2  ASN  59           2HB      ASN  59   5.635  -0.400 -13.278
  452    HB3  ASN  59           1HB      ASN  59   6.120  -2.086 -13.127
  453   HD21  ASN  59          1HD2      ASN  59   5.497  -3.543 -14.664
  454   HD22  ASN  59          2HD2      ASN  59   4.638  -3.109 -16.099
  455    H    VAL  60           H        VAL  60   5.101  -2.242  -9.841
  456    HA   VAL  60           HA       VAL  60   5.181  -5.117 -10.394
  457    HB   VAL  60           HB       VAL  60   6.394  -5.345  -8.280
  458   HG11  VAL  60          1HG1      VAL  60   8.379  -3.787  -8.943
  459   HG12  VAL  60          2HG1      VAL  60   7.384  -3.448 -10.360
  460   HG13  VAL  60          3HG1      VAL  60   7.890  -5.102 -10.013
  461   HG21  VAL  60          3HG2      VAL  60   6.689  -3.734  -6.732
  462   HG22  VAL  60          1HG2      VAL  60   5.211  -3.089  -7.445
  463   HG23  VAL  60          2HG2      VAL  60   6.778  -2.444  -7.931
  464    H    CYS  61           H        CYS  61   4.085  -6.660  -9.117
  465    HA   CYS  61           HA       CYS  61   1.642  -5.639  -7.925
  466    HG   CYS  61           HG       CYS  61   3.629  -8.988  -8.932
  467    HB2  CYS  61           2HB      CYS  61   0.908  -7.951  -7.841
  468    HB3  CYS  61           1HB      CYS  61   1.523  -7.566  -9.442
  469    H    LEU  62           H        LEU  62   1.188  -5.543  -5.821
  470    HA   LEU  62           HA       LEU  62   3.248  -6.432  -3.944
  471    HG   LEU  62           HG       LEU  62   3.585  -5.024  -1.963
  472    HB2  LEU  62           2HB      LEU  62   1.933  -3.996  -4.266
  473    HB3  LEU  62           1HB      LEU  62   1.228  -4.693  -2.827
  474   HD11  LEU  62          1HD1      LEU  62   4.794  -2.956  -3.492
  475   HD12  LEU  62          2HD1      LEU  62   4.212  -4.205  -4.591
  476   HD13  LEU  62          3HD1      LEU  62   5.314  -4.627  -3.282
  477   HD21  LEU  62          3HD2      LEU  62   1.985  -3.093  -1.428
  478   HD22  LEU  62          1HD2      LEU  62   3.006  -2.132  -2.494
  479   HD23  LEU  62          2HD2      LEU  62   3.695  -2.880  -1.053
  480    H    GLU  63           H        GLU  63   1.219  -8.221  -5.079
  481    HA   GLU  63           HA       GLU  63  -0.305  -8.880  -2.645
  482    HB2  GLU  63           2HB      GLU  63  -1.373  -8.333  -5.044
  483    HB3  GLU  63           1HB      GLU  63  -1.106 -10.059  -5.245
  484    HG2  GLU  63           2HG      GLU  63  -2.873 -10.548  -4.007
  485    HG3  GLU  63           1HG      GLU  63  -2.308  -9.523  -2.691
  486    H    GLU  64           H        GLU  64   2.099 -10.042  -4.854
  487    HA   GLU  64           HA       GLU  64   1.960 -12.689  -3.571
  488    HB2  GLU  64           2HB      GLU  64   1.931 -11.991  -6.340
  489    HB3  GLU  64           1HB      GLU  64   3.377 -12.924  -6.000
  490    HG2  GLU  64           2HG      GLU  64   2.145 -14.751  -6.160
  491    HG3  GLU  64           1HG      GLU  64   1.330 -14.263  -4.674
  492    H    VAL  65           H        VAL  65   3.419 -10.525  -2.471
  493    HA   VAL  65           HA       VAL  65   6.144 -11.607  -2.715
  494    HB   VAL  65           HB       VAL  65   7.063  -9.308  -2.417
  495   HG11  VAL  65          1HG1      VAL  65   7.039 -10.437  -4.595
  496   HG12  VAL  65          2HG1      VAL  65   6.866  -8.689  -4.759
  497   HG13  VAL  65          3HG1      VAL  65   5.456  -9.736  -4.935
  498   HG21  VAL  65          3HG2      VAL  65   5.622  -7.402  -3.057
  499   HG22  VAL  65          1HG2      VAL  65   5.120  -8.169  -1.550
  500   HG23  VAL  65          2HG2      VAL  65   4.228  -8.482  -3.040
  501    H    THR  66           H        THR  66   7.543 -11.188  -0.910
  502    HA   THR  66           HA       THR  66   6.257 -11.572   1.599
  503    HB   THR  66           HB       THR  66   9.079 -10.752   1.707
  504    HG1  THR  66           1HG      THR  66   9.783 -11.901   0.122
  505   HG21  THR  66          3HG2      THR  66   9.294 -12.403   3.218
  506   HG22  THR  66          1HG2      THR  66   8.268 -13.517   2.314
  507   HG23  THR  66          2HG2      THR  66   7.540 -12.248   3.298
  508    H    HIS  67           H        HIS  67   7.616 -10.078   3.455
  509    HA   HIS  67           HA       HIS  67   6.266  -7.574   3.192
  510    HD1  HIS  67           1HD      HIS  67   4.933  -6.986   6.194
  511    HD2  HIS  67           2HD      HIS  67   8.707  -5.435   5.432
  512    HE1  HIS  67           1HE      HIS  67   4.841  -4.594   6.929
  513    HE2  HIS  67           2HE      HIS  67   7.093  -3.648   6.359
  514    HB2  HIS  67           2HB      HIS  67   6.508  -8.719   5.377
  515    HB3  HIS  67           1HB      HIS  67   8.221  -8.331   5.375
  516    H    GLU  68           H        GLU  68   9.661  -8.568   3.007
  517    HA   GLU  68           HA       GLU  68  10.902  -6.107   2.933
  518    HB2  GLU  68           2HB      GLU  68  11.575  -8.503   1.210
  519    HB3  GLU  68           1HB      GLU  68  12.653  -7.163   1.573
  520    HG2  GLU  68           2HG      GLU  68  13.397  -8.336   3.294
  521    HG3  GLU  68           1HG      GLU  68  11.826  -8.097   4.060
  522    H    GLU  69           H        GLU  69   9.342  -7.848   0.262
  523    HA   GLU  69           HA       GLU  69   9.921  -5.925  -1.742
  524    HB2  GLU  69           2HB      GLU  69   7.781  -8.047  -1.570
  525    HB3  GLU  69           1HB      GLU  69   8.075  -7.073  -3.003
  526    HG2  GLU  69           2HG      GLU  69   9.417  -8.746  -3.615
  527    HG3  GLU  69           1HG      GLU  69  10.566  -8.031  -2.485
  528    H    ALA  70           H        ALA  70   7.243  -6.342   0.518
  529    HA   ALA  70           HA       ALA  70   5.428  -4.469  -0.546
  530    HB1  ALA  70           3HB      ALA  70   5.834  -5.041   2.385
  531    HB2  ALA  70           1HB      ALA  70   5.009  -6.150   1.292
  532    HB3  ALA  70           2HB      ALA  70   4.354  -4.537   1.572
  533    H    VAL  71           H        VAL  71   8.102  -4.117   1.748
  534    HA   VAL  71           HA       VAL  71   7.664  -1.291   2.116
  535    HB   VAL  71           HB       VAL  71   9.826  -3.173   3.055
  536   HG11  VAL  71          1HG1      VAL  71  10.437  -1.086   4.516
  537   HG12  VAL  71          2HG1      VAL  71   9.753  -0.192   3.158
  538   HG13  VAL  71          3HG1      VAL  71  11.118  -1.278   2.900
  539   HG21  VAL  71          3HG2      VAL  71   7.431  -3.008   4.058
  540   HG22  VAL  71          1HG2      VAL  71   8.039  -1.525   4.791
  541   HG23  VAL  71          2HG2      VAL  71   8.827  -3.064   5.132
  542    H    THR  72           H        THR  72   9.873  -3.322   0.247
  543    HA   THR  72           HA       THR  72  11.630  -1.279  -0.571
  544    HB   THR  72           HB       THR  72  10.944  -3.954  -1.789
  545    HG1  THR  72           1HG      THR  72  12.208  -4.482  -0.200
  546   HG21  THR  72          3HG2      THR  72  13.074  -2.013  -2.656
  547   HG22  THR  72          1HG2      THR  72  11.768  -2.684  -3.634
  548   HG23  THR  72          2HG2      THR  72  13.071  -3.729  -3.065
  549    H    ALA  73           H        ALA  73   8.625  -2.527  -1.979
  550    HA   ALA  73           HA       ALA  73   8.775  -1.014  -4.373
  551    HB1  ALA  73           3HB      ALA  73   6.443  -2.347  -3.005
  552    HB2  ALA  73           1HB      ALA  73   7.429  -3.001  -4.314
  553    HB3  ALA  73           2HB      ALA  73   6.377  -1.617  -4.609
  554    H    LEU  74           H        LEU  74   7.277  -0.485  -1.186
  555    HA   LEU  74           HA       LEU  74   5.957   1.941  -1.945
  556    HG   LEU  74           HG       LEU  74   4.334   0.396   1.027
  557    HB2  LEU  74           2HB      LEU  74   6.614   0.578   0.644
  558    HB3  LEU  74           1HB      LEU  74   6.053   2.237   0.659
  559   HD11  LEU  74          1HD1      LEU  74   3.930   2.497  -1.089
  560   HD12  LEU  74          2HD1      LEU  74   3.646   2.654   0.645
  561   HD13  LEU  74          3HD1      LEU  74   2.623   1.594  -0.322
  562   HD21  LEU  74          3HD2      LEU  74   5.316  -0.826  -1.083
  563   HD22  LEU  74          1HD2      LEU  74   4.147   0.186  -1.931
  564   HD23  LEU  74          2HD2      LEU  74   3.603  -0.931  -0.679
  565    H    LYS  75           H        LYS  75   9.080   1.023  -0.662
  566    HA   LYS  75           HA       LYS  75   9.938   3.680  -0.005
  567    HB2  LYS  75           2HB      LYS  75  11.139   2.185   1.234
  568    HB3  LYS  75           1HB      LYS  75  11.130   0.964  -0.027
  569    HG2  LYS  75           2HG      LYS  75  13.366   1.574   0.185
  570    HG3  LYS  75           1HG      LYS  75  12.813   2.445  -1.245
  571    HD2  LYS  75           2HD      LYS  75  14.045   4.029  -0.029
  572    HD3  LYS  75           1HD      LYS  75  12.362   4.401   0.348
  573    HE2  LYS  75           2HE      LYS  75  12.541   3.678   2.508
  574    HE3  LYS  75           1HE      LYS  75  13.796   2.500   2.125
  575    HZ1  LYS  75           3HZ      LYS  75  14.197   5.443   2.219
  576    HZ2  LYS  75           1HZ      LYS  75  15.394   4.279   1.938
  577    HZ3  LYS  75           2HZ      LYS  75  14.633   4.364   3.446
  578    H    ASN  76           H        ASN  76   9.989   1.756  -2.918
  579    HA   ASN  76           HA       ASN  76  12.061   3.258  -4.208
  580    HB2  ASN  76           2HB      ASN  76  11.472   0.867  -4.715
  581    HB3  ASN  76           1HB      ASN  76  10.013   1.455  -5.506
  582   HD21  ASN  76          1HD2      ASN  76  10.158   1.746  -7.611
  583   HD22  ASN  76          2HD2      ASN  76  11.609   2.032  -8.502
  584    H    THR  77           H        THR  77  10.825   5.318  -3.509
  585    HA   THR  77           HA       THR  77   9.123   6.173  -5.758
  586    HB   THR  77           HB       THR  77   8.005   7.734  -4.193
  587    HG1  THR  77           1HG      THR  77   8.495   7.779  -2.100
  588   HG21  THR  77          3HG2      THR  77   6.889   5.641  -4.550
  589   HG22  THR  77          1HG2      THR  77   6.749   6.094  -2.850
  590   HG23  THR  77          2HG2      THR  77   7.903   4.852  -3.341
  591    H    SER  78           H        SER  78   9.748   7.951  -6.845
  592    HA   SER  78           HA       SER  78  12.011   9.493  -5.747
  593    HG   SER  78           HG       SER  78  12.806   7.223  -7.730
  594    HB2  SER  78           2HB      SER  78  11.423   8.626  -8.575
  595    HB3  SER  78           1HB      SER  78  12.528   9.956  -8.224
  596    H    ASP  79           H        ASP  79   9.928  10.107  -8.568
  597    HA   ASP  79           HA       ASP  79   9.406  12.789  -7.515
  598    HB2  ASP  79           2HB      ASP  79   8.997  11.607 -10.271
  599    HB3  ASP  79           1HB      ASP  79   8.578  13.259  -9.828
  600    H    PHE  80           H        PHE  80   7.645  10.058  -8.976
  601    HA   PHE  80           HA       PHE  80   5.273  10.873  -7.442
  602    HD1  PHE  80           1HD      PHE  80   4.952  13.190  -9.666
  603    HD2  PHE  80           2HD      PHE  80   2.292   9.953  -8.911
  604    HE1  PHE  80           1HE      PHE  80   3.115  14.786  -9.312
  605    HE2  PHE  80           2HE      PHE  80   0.452  11.548  -8.559
  606    HZ   PHE  80           HZ       PHE  80   0.866  13.963  -8.751
  607    HB2  PHE  80           2HB      PHE  80   5.525  10.893 -10.270
  608    HB3  PHE  80           1HB      PHE  80   4.451   9.561  -9.849
  609    H    VAL  81           H        VAL  81   3.585   8.996  -7.441
  610    HA   VAL  81           HA       VAL  81   4.853   6.375  -7.467
  611    HB   VAL  81           HB       VAL  81   4.391   5.790  -5.269
  612   HG11  VAL  81          1HG1      VAL  81   5.388   7.425  -3.835
  613   HG12  VAL  81          2HG1      VAL  81   4.980   8.728  -4.952
  614   HG13  VAL  81          3HG1      VAL  81   6.179   7.517  -5.409
  615   HG21  VAL  81          3HG2      VAL  81   2.954   7.283  -3.764
  616   HG22  VAL  81          1HG2      VAL  81   2.129   6.325  -4.993
  617   HG23  VAL  81          2HG2      VAL  81   2.410   8.045  -5.257
  618    H    TYR  82           H        TYR  82   3.475   4.821  -8.221
  619    HA   TYR  82           HA       TYR  82   0.660   5.623  -8.563
  620    HD1  TYR  82           1HD      TYR  82   0.227   2.119 -10.329
  621    HD2  TYR  82           2HD      TYR  82  -0.052   6.204 -11.489
  622    HE1  TYR  82           1HE      TYR  82  -1.892   1.646 -11.461
  623    HE2  TYR  82           2HE      TYR  82  -2.182   5.739 -12.622
  624    HH   TYR  82           HH       TYR  82  -3.919   2.867 -12.183
  625    HB2  TYR  82           2HB      TYR  82   2.039   5.276 -10.650
  626    HB3  TYR  82           1HB      TYR  82   2.149   3.578 -10.201
  627    H    LEU  83           H        LEU  83  -0.293   4.811  -6.813
  628    HA   LEU  83           HA       LEU  83   0.265   2.100  -5.929
  629    HG   LEU  83           HG       LEU  83  -0.494   1.489  -3.832
  630    HB2  LEU  83           2HB      LEU  83  -0.060   4.102  -4.393
  631    HB3  LEU  83           1HB      LEU  83  -1.769   3.986  -4.767
  632   HD11  LEU  83          1HD1      LEU  83  -0.937   3.825  -1.979
  633   HD12  LEU  83          2HD1      LEU  83   0.614   3.087  -2.380
  634   HD13  LEU  83          3HD1      LEU  83  -0.593   2.168  -1.481
  635   HD21  LEU  83          3HD2      LEU  83  -3.086   2.941  -3.382
  636   HD22  LEU  83          1HD2      LEU  83  -2.635   1.499  -2.469
  637   HD23  LEU  83          2HD2      LEU  83  -2.813   1.414  -4.221
  638    H    LYS  84           H        LYS  84  -0.956   0.373  -6.224
  639    HA   LYS  84           HA       LYS  84  -3.592   0.680  -7.493
  640    HB2  LYS  84           2HB      LYS  84  -1.424  -1.339  -7.983
  641    HB3  LYS  84           1HB      LYS  84  -3.097  -1.687  -8.387
  642    HG2  LYS  84           2HG      LYS  84  -2.394   0.869  -9.447
  643    HG3  LYS  84           1HG      LYS  84  -1.180  -0.317  -9.927
  644    HD2  LYS  84           2HD      LYS  84  -2.777  -0.453 -11.620
  645    HD3  LYS  84           1HD      LYS  84  -3.186  -1.802 -10.560
  646    HE2  LYS  84           2HE      LYS  84  -4.497   0.743  -9.894
  647    HE3  LYS  84           1HE      LYS  84  -4.955   0.058 -11.452
  648    HZ1  LYS  84           3HZ      LYS  84  -6.431  -0.755  -9.780
  649    HZ2  LYS  84           1HZ      LYS  84  -5.148  -1.266  -8.802
  650    HZ3  LYS  84           2HZ      LYS  84  -5.451  -2.041 -10.274
  651    H    VAL  85           H        VAL  85  -5.305  -0.575  -6.684
  652    HA   VAL  85           HA       VAL  85  -4.650  -2.197  -4.322
  653    HB   VAL  85           HB       VAL  85  -7.037  -0.363  -4.615
  654   HG11  VAL  85          1HG1      VAL  85  -6.884  -1.033  -1.981
  655   HG12  VAL  85          2HG1      VAL  85  -6.387  -2.536  -2.757
  656   HG13  VAL  85          3HG1      VAL  85  -7.945  -1.810  -3.157
  657   HG21  VAL  85          3HG2      VAL  85  -5.904   0.768  -2.611
  658   HG22  VAL  85          1HG2      VAL  85  -5.218   1.051  -4.210
  659   HG23  VAL  85          2HG2      VAL  85  -4.452  -0.097  -3.114
  660    H    ALA  86           H        ALA  86  -5.714  -4.109  -4.093
  661    HA   ALA  86           HA       ALA  86  -7.354  -4.977  -6.359
  662    HB1  ALA  86           3HB      ALA  86  -6.619  -6.952  -4.306
  663    HB2  ALA  86           1HB      ALA  86  -5.266  -6.201  -5.153
  664    HB3  ALA  86           2HB      ALA  86  -6.518  -7.046  -6.064
  665    H    LYS  87           H        LYS  87  -9.323  -6.132  -6.053
  666    HA   LYS  87           HA       LYS  87 -10.685  -5.476  -3.523
  667    HB2  LYS  87           2HB      LYS  87 -11.374  -4.622  -6.024
  668    HB3  LYS  87           1HB      LYS  87 -12.369  -6.062  -5.868
  669    HG2  LYS  87           2HG      LYS  87 -12.440  -4.371  -3.498
  670    HG3  LYS  87           1HG      LYS  87 -13.001  -3.553  -4.958
  671    HD2  LYS  87           2HD      LYS  87 -14.571  -5.387  -5.378
  672    HD3  LYS  87           1HD      LYS  87 -14.006  -6.204  -3.919
  673    HE2  LYS  87           2HE      LYS  87 -15.953  -5.129  -3.227
  674    HE3  LYS  87           1HE      LYS  87 -14.670  -4.042  -2.698
  675    HZ1  LYS  87           3HZ      LYS  87 -16.511  -2.862  -3.760
  676    HZ2  LYS  87           1HZ      LYS  87 -16.254  -3.725  -5.193
  677    HZ3  LYS  87           2HZ      LYS  87 -15.070  -2.660  -4.621
  678    HA   PRO  88           HA       PRO  88 -10.549 -10.069  -3.544
  679    HB2  PRO  88           2HB      PRO  88 -10.508 -10.326  -0.847
  680    HB3  PRO  88           1HB      PRO  88  -9.052  -9.990  -1.791
  681    HG2  PRO  88           2HG      PRO  88 -10.790  -8.098  -0.254
  682    HG3  PRO  88           1HG      PRO  88  -9.020  -8.193  -0.318
  683    HD2  PRO  88           2HD      PRO  88 -10.432  -6.383  -1.751
  684    HD3  PRO  88           1HD      PRO  88  -8.905  -7.078  -2.331
  685    H    THR  89           H        THR  89 -12.078 -11.652  -2.787
  686    HA   THR  89           HA       THR  89 -14.749 -10.518  -2.387
  687    HB   THR  89           HB       THR  89 -15.497 -12.884  -2.938
  688    HG1  THR  89           1HG      THR  89 -13.909 -14.258  -2.855
  689   HG21  THR  89          3HG2      THR  89 -15.083 -12.723  -5.327
  690   HG22  THR  89          1HG2      THR  89 -13.862 -11.482  -5.038
  691   HG23  THR  89          2HG2      THR  89 -15.553 -11.164  -4.651
  692    H    GLY  90           H        GLY  90 -12.696 -13.136  -1.084
  693    HA2  GLY  90           2HA      GLY  90 -12.471 -13.828   1.118
  694    HA3  GLY  90           1HA      GLY  90 -13.658 -12.623   1.588
  695    H    SER  91           H        SER  91 -14.915 -13.918   2.885
  696    HA   SER  91           HA       SER  91 -16.043 -16.359   1.714
  697    HG   SER  91           HG       SER  91 -14.120 -16.385   4.232
  698    HB2  SER  91           2HB      SER  91 -15.957 -15.323   4.554
  699    HB3  SER  91           1HB      SER  91 -16.885 -16.743   4.074
  700    H    HIS  92           H        HIS  92 -17.129 -13.482   3.536
  701    HA   HIS  92           HA       HIS  92 -19.844 -13.891   2.514
  702    HD1  HIS  92           1HD      HIS  92 -22.072 -12.169   5.373
  703    HD2  HIS  92           2HD      HIS  92 -19.757 -15.592   4.934
  704    HE1  HIS  92           1HE      HIS  92 -23.423 -14.029   6.390
  705    HE2  HIS  92           2HE      HIS  92 -22.044 -16.106   6.027
  706    HB2  HIS  92           2HB      HIS  92 -18.681 -12.640   4.903
  707    HB3  HIS  92           1HB      HIS  92 -19.976 -11.699   4.168
  708    HA   ARG 301           HA       ARG 301   2.449 -10.714  10.077
  709    HE   ARG 301           HE       ARG 301   2.134 -12.158  14.550
  710    H1   ARG 301           1HT      ARG 301   3.957 -11.970  11.228
  711    H2   ARG 301           2HT      ARG 301   2.429 -12.489  11.804
  712    H3   ARG 301           3HT      ARG 301   3.395 -11.439  12.756
  713    HB2  ARG 301           2HB      ARG 301   0.605  -9.502  11.261
  714    HB3  ARG 301           1HB      ARG 301   0.467 -11.253  11.327
  715    HG2  ARG 301           2HG      ARG 301   1.929 -10.246  13.600
  716    HG3  ARG 301           1HG      ARG 301   0.353  -9.468  13.457
  717    HD2  ARG 301           2HD      ARG 301  -0.418 -11.277  14.533
  718    HD3  ARG 301           1HD      ARG 301  -0.270 -12.078  12.969
  719   HH11  ARG 301          1HH1      ARG 301  -0.914 -13.753  13.889
  720   HH12  ARG 301          2HH1      ARG 301  -0.372 -15.292  14.466
  721   HH21  ARG 301          1HH2      ARG 301   2.844 -14.192  15.297
  722   HH22  ARG 301          2HH2      ARG 301   1.760 -15.542  15.264
  723    H    ARG 302           H        ARG 302   4.924 -10.069  10.622
  724    HA   ARG 302           HA       ARG 302   5.349  -7.795  12.251
  725    HE   ARG 302           HE       ARG 302   9.421  -8.665  13.013
  726    HB2  ARG 302           2HB      ARG 302   7.245  -9.116  11.701
  727    HB3  ARG 302           1HB      ARG 302   6.912  -9.009   9.978
  728    HG2  ARG 302           2HG      ARG 302   7.810  -6.917   9.787
  729    HG3  ARG 302           1HG      ARG 302   7.451  -6.488  11.460
  730    HD2  ARG 302           2HD      ARG 302   9.513  -8.553  10.729
  731    HD3  ARG 302           1HD      ARG 302   9.898  -6.837  10.848
  732   HH11  ARG 302          1HH1      ARG 302   9.365  -5.293  12.065
  733   HH12  ARG 302          2HH1      ARG 302   9.555  -4.709  13.684
  734   HH21  ARG 302          1HH2      ARG 302   9.671  -7.889  15.142
  735   HH22  ARG 302          2HH2      ARG 302   9.729  -6.182  15.431
  736    H    GLU 303           H        GLU 303   5.103  -5.678  11.884
  737    HA   GLU 303           HA       GLU 303   4.375  -4.804   9.165
  738    HB2  GLU 303           2HB      GLU 303   3.265  -3.770  11.783
  739    HB3  GLU 303           1HB      GLU 303   2.880  -3.132  10.191
  740    HG2  GLU 303           2HG      GLU 303   1.444  -4.792   9.725
  741    HG3  GLU 303           1HG      GLU 303   2.435  -6.015  10.512
  742    H    THR 304           H        THR 304   5.547  -3.166   8.342
  743    HA   THR 304           HA       THR 304   7.243  -1.626  10.192
  744    HB   THR 304           HB       THR 304   8.012  -3.350   8.027
  745    HG1  THR 304           1HG      THR 304   9.242  -3.451   9.772
  746   HG21  THR 304          3HG2      THR 304   9.595  -1.990   6.858
  747   HG22  THR 304          1HG2      THR 304   9.101  -0.561   7.766
  748   HG23  THR 304          2HG2      THR 304   7.979  -1.321   6.637
  749    H    GLN 305           H        GLN 305   7.790   0.520   9.576
  750    HA   GLN 305           HA       GLN 305   5.672   1.849   8.124
  751    HB2  GLN 305           2HB      GLN 305   7.976   2.782   9.800
  752    HB3  GLN 305           1HB      GLN 305   7.111   3.916   8.770
  753    HG2  GLN 305           2HG      GLN 305   5.165   3.754   9.990
  754    HG3  GLN 305           1HG      GLN 305   5.588   2.177  10.653
  755   HE21  GLN 305          1HE2      GLN 305   6.591   2.067  12.579
  756   HE22  GLN 305          2HE2      GLN 305   7.096   3.438  13.502
  757    H    VAL 306           H        VAL 306   5.979   3.270   6.359
  758    HA   VAL 306           HA       VAL 306   8.518   3.103   4.923
  759    HB   VAL 306           HB       VAL 306   7.336   2.557   2.793
  760   HG11  VAL 306          1HG1      VAL 306   8.567   0.879   4.167
  761   HG12  VAL 306          2HG1      VAL 306   7.286   0.192   3.171
  762   HG13  VAL 306          3HG1      VAL 306   7.029   0.420   4.901
  763   HG21  VAL 306          3HG2      VAL 306   5.091   3.073   3.128
  764   HG22  VAL 306          1HG2      VAL 306   5.027   2.240   4.681
  765   HG23  VAL 306          2HG2      VAL 306   5.104   1.311   3.184
  Start of MODEL   27
    1    HA   MET   1           HA       MET   1  -9.264   2.331  -8.052
    2    H1   MET   1           1HT      MET   1  -8.688   1.492 -10.209
    3    H2   MET   1           2HT      MET   1  -9.932   0.568  -9.472
    4    H3   MET   1           3HT      MET   1  -8.327  -0.039  -9.530
    5    HB2  MET   1           2HB      MET   1  -8.579  -0.503  -7.305
    6    HB3  MET   1           1HB      MET   1  -8.446   0.793  -6.125
    7    HG2  MET   1           2HG      MET   1 -10.938   1.228  -7.094
    8    HG3  MET   1           1HG      MET   1 -10.818  -0.525  -7.227
    9    HE1  MET   1           3HE      MET   1 -11.479   2.064  -3.671
   10    HE2  MET   1           1HE      MET   1 -12.769   1.463  -4.712
   11    HE3  MET   1           2HE      MET   1 -11.459   2.427  -5.396
   12    H    GLU   2           H        GLU   2  -7.618   3.636  -8.976
   13    HA   GLU   2           HA       GLU   2  -4.929   3.038  -7.943
   14    HB2  GLU   2           2HB      GLU   2  -3.992   4.118  -9.987
   15    HB3  GLU   2           1HB      GLU   2  -4.835   2.610 -10.309
   16    HG2  GLU   2           2HG      GLU   2  -6.569   4.937 -10.513
   17    HG3  GLU   2           1HG      GLU   2  -5.203   4.995 -11.624
   18    H    ILE   3           H        ILE   3  -3.567   4.960  -7.623
   19    HA   ILE   3           HA       ILE   3  -4.974   7.510  -7.433
   20    HB   ILE   3           HB       ILE   3  -3.470   6.236  -5.133
   21   HG12  ILE   3          2HG1      ILE   3  -5.885   6.872  -4.113
   22   HG13  ILE   3          1HG1      ILE   3  -6.351   6.535  -5.777
   23   HG21  ILE   3          1HG2      ILE   3  -4.152   8.282  -3.890
   24   HG22  ILE   3          2HG2      ILE   3  -4.680   8.973  -5.425
   25   HG23  ILE   3          3HG2      ILE   3  -2.982   8.567  -5.179
   26   HD11  ILE   3          3HD1      ILE   3  -4.635   4.453  -4.958
   27   HD12  ILE   3          1HD1      ILE   3  -6.362   4.379  -5.304
   28   HD13  ILE   3          2HD1      ILE   3  -5.805   4.715  -3.665
   29    H    LYS   4           H        LYS   4  -3.586   9.271  -7.813
   30    HA   LYS   4           HA       LYS   4  -0.829   8.514  -8.491
   31    HB2  LYS   4           2HB      LYS   4  -2.672   9.809 -10.020
   32    HB3  LYS   4           1HB      LYS   4  -1.810  11.171  -9.320
   33    HG2  LYS   4           2HG      LYS   4  -0.209  10.922 -10.821
   34    HG3  LYS   4           1HG      LYS   4   0.130   9.307 -10.202
   35    HD2  LYS   4           2HD      LYS   4  -0.856   8.317 -11.952
   36    HD3  LYS   4           1HD      LYS   4  -2.240   9.410 -11.898
   37    HE2  LYS   4           2HE      LYS   4   0.420  10.303 -12.959
   38    HE3  LYS   4           1HE      LYS   4  -0.735   9.450 -13.981
   39    HZ1  LYS   4           3HZ      LYS   4  -0.952  11.850 -14.190
   40    HZ2  LYS   4           1HZ      LYS   4  -1.268  11.989 -12.533
   41    HZ3  LYS   4           2HZ      LYS   4  -2.360  11.177 -13.538
   42    H    LEU   5           H        LEU   5   0.070   8.639  -6.488
   43    HA   LEU   5           HA       LEU   5  -0.089  11.112  -4.961
   44    HG   LEU   5           HG       LEU   5  -0.883  10.082  -2.946
   45    HB2  LEU   5           2HB      LEU   5   0.402   8.406  -4.329
   46    HB3  LEU   5           1HB      LEU   5   1.860   9.285  -3.912
   47   HD11  LEU   5          1HD1      LEU   5   1.206   8.371  -1.609
   48   HD12  LEU   5          2HD1      LEU   5  -0.425   7.889  -2.078
   49   HD13  LEU   5          3HD1      LEU   5  -0.191   9.072  -0.791
   50   HD21  LEU   5          3HD2      LEU   5   1.912  10.891  -2.159
   51   HD22  LEU   5          1HD2      LEU   5   0.465  11.304  -1.239
   52   HD23  LEU   5          2HD2      LEU   5   0.667  11.906  -2.885
   53    H    ILE   6           H        ILE   6   1.353  12.705  -4.960
   54    HA   ILE   6           HA       ILE   6   3.708  12.456  -6.659
   55    HB   ILE   6           HB       ILE   6   2.246  14.426  -6.941
   56   HG12  ILE   6          2HG1      ILE   6   4.989  15.156  -5.890
   57   HG13  ILE   6          1HG1      ILE   6   4.673  14.505  -7.495
   58   HG21  ILE   6          1HG2      ILE   6   3.241  15.453  -4.303
   59   HG22  ILE   6          2HG2      ILE   6   1.727  14.560  -4.440
   60   HG23  ILE   6          3HG2      ILE   6   1.937  16.077  -5.313
   61   HD11  ILE   6          3HD1      ILE   6   3.007  16.604  -7.524
   62   HD12  ILE   6          1HD1      ILE   6   4.689  16.683  -8.050
   63   HD13  ILE   6          2HD1      ILE   6   4.247  17.214  -6.428
   64    H    LYS   7           H        LYS   7   5.716  12.212  -5.903
   65    HA   LYS   7           HA       LYS   7   6.198  11.916  -3.105
   66    HB2  LYS   7           2HB      LYS   7   7.360  10.618  -4.915
   67    HB3  LYS   7           1HB      LYS   7   8.244  12.081  -5.320
   68    HG2  LYS   7           2HG      LYS   7   9.763  11.091  -3.957
   69    HG3  LYS   7           1HG      LYS   7   8.854  12.006  -2.753
   70    HD2  LYS   7           2HD      LYS   7   7.443   9.645  -2.954
   71    HD3  LYS   7           1HD      LYS   7   9.122   9.127  -3.106
   72    HE2  LYS   7           2HE      LYS   7   8.345  11.040  -0.947
   73    HE3  LYS   7           1HE      LYS   7   8.014   9.320  -0.752
   74    HZ1  LYS   7           3HZ      LYS   7  10.143   9.926   0.209
   75    HZ2  LYS   7           1HZ      LYS   7  10.683  10.513  -1.284
   76    HZ3  LYS   7           2HZ      LYS   7  10.362   8.864  -1.088
   77    H    GLY   8           H        GLY   8   6.224  13.650  -1.812
   78    HA2  GLY   8           2HA      GLY   8   7.426  16.149  -2.784
   79    HA3  GLY   8           1HA      GLY   8   6.367  15.990  -1.392
   80    HA   PRO   9           HA       PRO   9  10.723  16.186   0.194
   81    HB2  PRO   9           2HB      PRO   9   9.937  18.446   1.805
   82    HB3  PRO   9           1HB      PRO   9  11.088  18.401   0.469
   83    HG2  PRO   9           2HG      PRO   9   8.693  19.718   0.369
   84    HG3  PRO   9           1HG      PRO   9   9.525  19.079  -1.059
   85    HD2  PRO   9           2HD      PRO   9   7.261  17.887   0.506
   86    HD3  PRO   9           1HD      PRO   9   7.478  17.988  -1.257
   87    H    LYS  10           H        LYS  10   8.325  14.659   1.189
   88    HA   LYS  10           HA       LYS  10   9.094  14.605   4.022
   89    HB2  LYS  10           2HB      LYS  10   6.282  14.492   2.919
   90    HB3  LYS  10           1HB      LYS  10   6.700  14.067   4.573
   91    HG2  LYS  10           2HG      LYS  10   7.734  16.670   3.835
   92    HG3  LYS  10           1HG      LYS  10   5.984  16.565   3.634
   93    HD2  LYS  10           2HD      LYS  10   5.942  15.560   5.978
   94    HD3  LYS  10           1HD      LYS  10   7.611  16.116   6.122
   95    HE2  LYS  10           2HE      LYS  10   6.112  18.278   5.105
   96    HE3  LYS  10           1HE      LYS  10   5.179  17.594   6.436
   97    HZ1  LYS  10           3HZ      LYS  10   8.022  18.445   6.582
   98    HZ2  LYS  10           1HZ      LYS  10   7.116  17.804   7.860
   99    HZ3  LYS  10           2HZ      LYS  10   6.704  19.306   7.200
  100    H    GLY  11           H        GLY  11   6.813  12.739   1.996
  101    HA2  GLY  11           2HA      GLY  11   7.710  10.560   1.117
  102    HA3  GLY  11           1HA      GLY  11   8.322  10.308   2.742
  103    H    LEU  12           H        LEU  12   6.806   8.365   1.747
  104    HA   LEU  12           HA       LEU  12   4.153   8.215   1.728
  105    HG   LEU  12           HG       LEU  12   5.504   6.662   0.435
  106    HB2  LEU  12           2HB      LEU  12   5.946   6.376   3.310
  107    HB3  LEU  12           1HB      LEU  12   4.304   5.997   2.833
  108   HD11  LEU  12          1HD1      LEU  12   7.643   5.927   0.309
  109   HD12  LEU  12          2HD1      LEU  12   7.431   4.738   1.594
  110   HD13  LEU  12          3HD1      LEU  12   7.652   6.441   1.996
  111   HD21  LEU  12          3HD2      LEU  12   5.591   4.098   0.187
  112   HD22  LEU  12          1HD2      LEU  12   4.034   4.869   0.480
  113   HD23  LEU  12          2HD2      LEU  12   4.885   4.072   1.803
  114    H    GLY  13           H        GLY  13   5.857   7.900   4.867
  115    HA2  GLY  13           2HA      GLY  13   5.281   8.685   6.950
  116    HA3  GLY  13           1HA      GLY  13   4.050   9.674   6.187
  117    H    PHE  14           H        PHE  14   4.440   6.135   6.231
  118    HA   PHE  14           HA       PHE  14   2.338   5.754   8.126
  119    HD1  PHE  14           2HD      PHE  14   1.947   2.880   5.227
  120    HD2  PHE  14           1HD      PHE  14   1.546   6.954   4.057
  121    HE1  PHE  14           2HE      PHE  14   2.376   2.248   2.891
  122    HE2  PHE  14           1HE      PHE  14   1.969   6.325   1.718
  123    HZ   PHE  14           HZ       PHE  14   2.385   3.971   1.133
  124    HB2  PHE  14           2HB      PHE  14   0.757   4.599   6.632
  125    HB3  PHE  14           1HB      PHE  14   0.931   6.297   6.221
  126    H    SER  15           H        SER  15   1.638   3.139   7.728
  127    HA   SER  15           HA       SER  15   4.184   1.730   7.422
  128    HG   SER  15           HG       SER  15   2.364   2.793  10.198
  129    HB2  SER  15           2HB      SER  15   3.093   0.223   9.330
  130    HB3  SER  15           1HB      SER  15   4.124   1.601   9.703
  131    H    ILE  16           H        ILE  16   3.780  -0.722   7.308
  132    HA   ILE  16           HA       ILE  16   1.199  -1.515   6.239
  133    HB   ILE  16           HB       ILE  16   1.811  -2.071   4.076
  134   HG12  ILE  16          2HG1      ILE  16   4.124  -2.988   4.910
  135   HG13  ILE  16          1HG1      ILE  16   3.886  -2.558   3.225
  136   HG21  ILE  16          1HG2      ILE  16   3.284   0.500   4.561
  137   HG22  ILE  16          2HG2      ILE  16   1.547   0.332   4.310
  138   HG23  ILE  16          3HG2      ILE  16   2.667  -0.073   3.013
  139   HD11  ILE  16          3HD1      ILE  16   5.942  -1.738   4.793
  140   HD12  ILE  16          1HD1      ILE  16   4.842  -0.358   4.871
  141   HD13  ILE  16          2HD1      ILE  16   5.408  -0.946   3.305
  142    H    ALA  17           H        ALA  17   1.303  -3.820   5.487
  143    HA   ALA  17           HA       ALA  17   3.359  -5.461   6.776
  144    HB1  ALA  17           3HB      ALA  17   1.828  -5.863   8.414
  145    HB2  ALA  17           1HB      ALA  17   1.199  -7.002   7.224
  146    HB3  ALA  17           2HB      ALA  17   0.463  -5.406   7.397
  147    H    GLY  18           H        GLY  18   3.182  -7.822   5.742
  148    HA2  GLY  18           2HA      GLY  18   1.624  -8.347   3.557
  149    HA3  GLY  18           1HA      GLY  18   2.887  -7.339   2.903
  150    H    GLY  19           H        GLY  19   1.965 -10.396   2.797
  151    HA2  GLY  19           2HA      GLY  19   3.435 -11.957   1.739
  152    HA3  GLY  19           1HA      GLY  19   4.755 -11.317   2.700
  153    H    VAL  20           H        VAL  20   4.089 -14.064   2.419
  154    HA   VAL  20           HA       VAL  20   2.606 -15.033   4.624
  155    HB   VAL  20           HB       VAL  20   3.168 -16.391   2.604
  156   HG11  VAL  20          1HG1      VAL  20   5.276 -17.262   2.182
  157   HG12  VAL  20          2HG1      VAL  20   5.844 -16.955   3.824
  158   HG13  VAL  20          3HG1      VAL  20   5.635 -15.613   2.698
  159   HG21  VAL  20          3HG2      VAL  20   3.329 -18.470   3.758
  160   HG22  VAL  20          1HG2      VAL  20   2.408 -17.368   4.782
  161   HG23  VAL  20          2HG2      VAL  20   4.099 -17.707   5.149
  162    H    GLY  21           H        GLY  21   3.267 -15.742   6.667
  163    HA2  GLY  21           2HA      GLY  21   4.710 -16.055   8.482
  164    HA3  GLY  21           1HA      GLY  21   6.057 -15.574   7.461
  165    H    ASN  22           H        ASN  22   4.307 -13.147   6.737
  166    HA   ASN  22           HA       ASN  22   4.500 -11.566   9.178
  167    HB2  ASN  22           2HB      ASN  22   5.415  -9.720   7.455
  168    HB3  ASN  22           1HB      ASN  22   6.504 -10.756   8.357
  169   HD21  ASN  22          1HD2      ASN  22   4.649 -10.790   5.329
  170   HD22  ASN  22          2HD2      ASN  22   5.906 -11.498   4.381
  171    H    GLN  23           H        GLN  23   2.330 -12.735   7.429
  172    HA   GLN  23           HA       GLN  23   1.088 -10.831   5.844
  173    HB2  GLN  23           2HB      GLN  23  -0.347 -12.898   7.509
  174    HB3  GLN  23           1HB      GLN  23  -0.895 -12.171   6.008
  175    HG2  GLN  23           2HG      GLN  23   0.284 -13.592   4.740
  176    HG3  GLN  23           1HG      GLN  23   1.674 -13.568   5.820
  177   HE21  GLN  23          1HE2      GLN  23  -0.941 -15.361   4.721
  178   HE22  GLN  23          2HE2      GLN  23  -0.895 -16.624   5.898
  179    H    HIS  24           H        HIS  24  -0.592  -9.416   6.133
  180    HA   HIS  24           HA       HIS  24  -0.716  -8.142   8.738
  181    HD1  HIS  24           1HD      HIS  24  -0.662  -5.231   8.889
  182    HD2  HIS  24           2HD      HIS  24  -4.209  -6.077   6.904
  183    HE1  HIS  24           1HE      HIS  24  -2.292  -3.523   9.694
  184    HE2  HIS  24           2HE      HIS  24  -4.481  -4.133   8.604
  185    HB2  HIS  24           2HB      HIS  24  -0.473  -6.760   6.713
  186    HB3  HIS  24           1HB      HIS  24  -1.991  -7.380   6.100
  187    H    ILE  25           H        ILE  25  -2.700 -10.238   6.808
  188    HA   ILE  25           HA       ILE  25  -4.652 -10.419   8.916
  189    HB   ILE  25           HB       ILE  25  -6.549  -9.996   7.181
  190   HG12  ILE  25          2HG1      ILE  25  -5.163  -7.794   5.987
  191   HG13  ILE  25          1HG1      ILE  25  -4.282  -9.278   5.637
  192   HG21  ILE  25          1HG2      ILE  25  -5.822  -8.659   9.282
  193   HG22  ILE  25          2HG2      ILE  25  -6.931  -7.932   8.120
  194   HG23  ILE  25          3HG2      ILE  25  -5.223  -7.492   8.103
  195   HD11  ILE  25          3HD1      ILE  25  -6.761 -10.101   5.078
  196   HD12  ILE  25          1HD1      ILE  25  -5.699  -9.336   3.895
  197   HD13  ILE  25          2HD1      ILE  25  -6.931  -8.382   4.722
  198    HA   PRO  26           HA       PRO  26  -4.523 -14.624   7.422
  199    HB2  PRO  26           2HB      PRO  26  -7.219 -14.752   8.681
  200    HB3  PRO  26           1HB      PRO  26  -5.816 -15.801   8.914
  201    HG2  PRO  26           2HG      PRO  26  -6.494 -14.012  10.763
  202    HG3  PRO  26           1HG      PRO  26  -4.791 -14.325  10.379
  203    HD2  PRO  26           2HD      PRO  26  -6.522 -12.021   9.589
  204    HD3  PRO  26           1HD      PRO  26  -4.802 -12.046  10.030
  205    H    GLY  27           H        GLY  27  -4.938 -15.211   5.392
  206    HA2  GLY  27           2HA      GLY  27  -6.686 -16.013   3.861
  207    HA3  GLY  27           1HA      GLY  27  -7.588 -14.559   4.255
  208    H    ASP  28           H        ASP  28  -5.829 -12.541   3.981
  209    HA   ASP  28           HA       ASP  28  -5.027 -12.754   1.155
  210    HB2  ASP  28           2HB      ASP  28  -6.655 -10.854   2.507
  211    HB3  ASP  28           1HB      ASP  28  -5.181 -10.029   2.006
  212    H    ASN  29           H        ASN  29  -2.920 -12.935   0.877
  213    HA   ASN  29           HA       ASN  29  -1.041 -12.002   2.889
  214    HB2  ASN  29           2HB      ASN  29  -0.524 -13.406   0.263
  215    HB3  ASN  29           1HB      ASN  29   0.658 -13.126   1.537
  216   HD21  ASN  29          1HD2      ASN  29   0.174 -15.650   0.585
  217   HD22  ASN  29          2HD2      ASN  29  -0.608 -16.588   1.806
  218    H    SER  30           H        SER  30  -2.610 -10.140   0.924
  219    HA   SER  30           HA       SER  30  -0.453  -8.889  -0.550
  220    HG   SER  30           HG       SER  30  -4.274  -7.590  -0.353
  221    HB2  SER  30           2HB      SER  30  -2.305  -7.132  -0.998
  222    HB3  SER  30           1HB      SER  30  -2.472  -8.728  -1.720
  223    H    ILE  31           H        ILE  31   0.016  -6.566  -0.282
  224    HA   ILE  31           HA       ILE  31   0.629  -6.054   2.439
  225    HB   ILE  31           HB       ILE  31   0.940  -4.014   0.255
  226   HG12  ILE  31          2HG1      ILE  31   1.996  -5.718  -0.857
  227   HG13  ILE  31          1HG1      ILE  31   3.324  -5.126   0.125
  228   HG21  ILE  31          1HG2      ILE  31   2.856  -4.553   2.471
  229   HG22  ILE  31          2HG2      ILE  31   1.409  -3.585   2.749
  230   HG23  ILE  31          3HG2      ILE  31   2.595  -3.074   1.547
  231   HD11  ILE  31          3HD1      ILE  31   2.409  -7.737  -0.063
  232   HD12  ILE  31          1HD1      ILE  31   1.840  -7.179   1.509
  233   HD13  ILE  31          2HD1      ILE  31   3.555  -7.098   1.115
  234    H    TYR  32           H        TYR  32  -0.475  -5.057   3.944
  235    HA   TYR  32           HA       TYR  32  -2.630  -3.185   3.220
  236    HD1  TYR  32           2HD      TYR  32  -2.472  -6.679   3.376
  237    HD2  TYR  32           1HD      TYR  32  -5.688  -4.234   4.658
  238    HE1  TYR  32           2HE      TYR  32  -4.025  -8.107   2.125
  239    HE2  TYR  32           1HE      TYR  32  -7.274  -5.642   3.424
  240    HH   TYR  32           HH       TYR  32  -6.616  -7.524   1.068
  241    HB2  TYR  32           2HB      TYR  32  -2.412  -5.149   5.491
  242    HB3  TYR  32           1HB      TYR  32  -3.577  -3.833   5.495
  243    H    VAL  33           H        VAL  33  -2.820  -1.290   4.446
  244    HA   VAL  33           HA       VAL  33  -0.397  -0.355   5.679
  245    HB   VAL  33           HB       VAL  33  -3.066   0.984   5.215
  246   HG11  VAL  33          1HG1      VAL  33  -2.519   2.396   6.861
  247   HG12  VAL  33          2HG1      VAL  33  -1.267   2.994   5.773
  248   HG13  VAL  33          3HG1      VAL  33  -0.877   1.763   6.975
  249   HG21  VAL  33          3HG2      VAL  33  -2.178   1.179   3.168
  250   HG22  VAL  33          1HG2      VAL  33  -0.562   0.745   3.725
  251   HG23  VAL  33          2HG2      VAL  33  -1.136   2.404   3.890
  252    H    THR  34           H        THR  34   0.062  -0.405   7.779
  253    HA   THR  34           HA       THR  34  -1.974  -1.370   9.629
  254    HB   THR  34           HB       THR  34  -0.232  -2.071  11.041
  255    HG1  THR  34           1HG      THR  34   1.546  -0.994  11.264
  256   HG21  THR  34          3HG2      THR  34  -0.154  -2.854   8.381
  257   HG22  THR  34          1HG2      THR  34   0.596  -3.667   9.752
  258   HG23  THR  34          2HG2      THR  34   1.525  -2.511   8.800
  259    H    LYS  35           H        LYS  35  -0.198   1.582   9.002
  260    HA   LYS  35           HA       LYS  35  -1.818   3.044  10.838
  261    HB2  LYS  35           2HB      LYS  35  -0.338   2.061  12.494
  262    HB3  LYS  35           1HB      LYS  35   1.075   2.583  11.587
  263    HG2  LYS  35           2HG      LYS  35   0.839   4.782  12.218
  264    HG3  LYS  35           1HG      LYS  35  -0.887   4.616  12.546
  265    HD2  LYS  35           2HD      LYS  35  -0.485   3.471  14.579
  266    HD3  LYS  35           1HD      LYS  35   1.218   3.225  14.188
  267    HE2  LYS  35           2HE      LYS  35   1.761   5.158  15.140
  268    HE3  LYS  35           1HE      LYS  35   0.610   6.024  14.124
  269    HZ1  LYS  35           3HZ      LYS  35  -1.134   5.498  15.714
  270    HZ2  LYS  35           1HZ      LYS  35   0.129   6.336  16.468
  271    HZ3  LYS  35           2HZ      LYS  35  -0.028   4.667  16.688
  272    H    ILE  36           H        ILE  36  -1.998   5.086  10.099
  273    HA   ILE  36           HA       ILE  36   0.016   6.015   8.177
  274    HB   ILE  36           HB       ILE  36  -2.815   6.967   8.623
  275   HG12  ILE  36          2HG1      ILE  36  -1.473   5.257   6.539
  276   HG13  ILE  36          1HG1      ILE  36  -2.917   4.908   7.481
  277   HG21  ILE  36          1HG2      ILE  36  -2.465   8.398   6.663
  278   HG22  ILE  36          2HG2      ILE  36  -0.774   7.903   6.604
  279   HG23  ILE  36          3HG2      ILE  36  -1.375   8.828   7.980
  280   HD11  ILE  36          3HD1      ILE  36  -2.612   6.716   5.117
  281   HD12  ILE  36          1HD1      ILE  36  -3.990   6.845   6.210
  282   HD13  ILE  36          2HD1      ILE  36  -3.696   5.343   5.333
  283    H    ILE  37           H        ILE  37   1.382   7.604   8.704
  284    HA   ILE  37           HA       ILE  37   1.189   8.924  11.265
  285    HB   ILE  37           HB       ILE  37   3.236   8.934   9.057
  286   HG12  ILE  37          2HG1      ILE  37   4.512   8.356  11.401
  287   HG13  ILE  37          1HG1      ILE  37   2.914   7.680  11.699
  288   HG21  ILE  37          1HG2      ILE  37   3.145  10.749  11.447
  289   HG22  ILE  37          2HG2      ILE  37   3.310  11.185   9.745
  290   HG23  ILE  37          3HG2      ILE  37   4.635  10.373  10.580
  291   HD11  ILE  37          3HD1      ILE  37   3.124   6.117  10.024
  292   HD12  ILE  37          1HD1      ILE  37   4.770   6.214  10.645
  293   HD13  ILE  37          2HD1      ILE  37   4.340   7.054   9.156
  294    H    GLU  38           H        GLU  38   1.097  11.204  11.579
  295    HA   GLU  38           HA       GLU  38  -0.736  12.553   9.898
  296    HB2  GLU  38           2HB      GLU  38   0.909  13.348  12.271
  297    HB3  GLU  38           1HB      GLU  38   0.075  14.585  11.342
  298    HG2  GLU  38           2HG      GLU  38  -2.021  13.161  11.667
  299    HG3  GLU  38           1HG      GLU  38  -1.095  12.316  12.906
  300    H    GLY  39           H        GLY  39  -0.468  14.333   8.541
  301    HA2  GLY  39           2HA      GLY  39   0.543  15.634   6.955
  302    HA3  GLY  39           1HA      GLY  39   1.960  15.627   7.988
  303    H    GLY  40           H        GLY  40   0.918  12.501   6.994
  304    HA2  GLY  40           2HA      GLY  40   3.285  12.263   5.309
  305    HA3  GLY  40           1HA      GLY  40   2.279  10.946   5.886
  306    H    ALA  41           H        ALA  41   3.135  10.935   3.308
  307    HA   ALA  41           HA       ALA  41   1.724  12.139   1.305
  308    HB1  ALA  41           3HB      ALA  41   2.221  10.212  -0.081
  309    HB2  ALA  41           1HB      ALA  41   2.535   9.235   1.355
  310    HB3  ALA  41           2HB      ALA  41   3.597  10.587   0.958
  311    H    ALA  42           H        ALA  42   0.786   9.018   2.796
  312    HA   ALA  42           HA       ALA  42  -1.690   8.823   1.455
  313    HB1  ALA  42           3HB      ALA  42  -2.235   7.115   3.178
  314    HB2  ALA  42           1HB      ALA  42  -0.743   7.542   4.014
  315    HB3  ALA  42           2HB      ALA  42  -0.678   6.858   2.390
  316    H    HIS  43           H        HIS  43  -0.907   9.881   4.766
  317    HA   HIS  43           HA       HIS  43  -3.438  10.446   5.704
  318    HD1  HIS  43           1HD      HIS  43  -2.098  14.177   6.956
  319    HD2  HIS  43           2HD      HIS  43  -3.425  10.798   8.976
  320    HE1  HIS  43           1HE      HIS  43  -3.454  15.041   8.887
  321    HE2  HIS  43           2HE      HIS  43  -4.186  12.980  10.140
  322    HB2  HIS  43           2HB      HIS  43  -1.378  10.528   7.066
  323    HB3  HIS  43           1HB      HIS  43  -0.908  12.015   6.253
  324    H    LYS  44           H        LYS  44  -1.269  12.612   3.892
  325    HA   LYS  44           HA       LYS  44  -3.023  14.835   3.875
  326    HB2  LYS  44           2HB      LYS  44  -0.648  14.077   2.183
  327    HB3  LYS  44           1HB      LYS  44  -1.551  15.560   1.904
  328    HG2  LYS  44           2HG      LYS  44  -1.031  16.339   4.133
  329    HG3  LYS  44           1HG      LYS  44  -0.206  14.822   4.496
  330    HD2  LYS  44           2HD      LYS  44   1.480  15.280   2.844
  331    HD3  LYS  44           1HD      LYS  44   0.608  16.711   2.289
  332    HE2  LYS  44           2HE      LYS  44   1.298  16.620   5.162
  333    HE3  LYS  44           1HE      LYS  44   2.645  16.800   4.038
  334    HZ1  LYS  44           3HZ      LYS  44   1.526  18.724   3.077
  335    HZ2  LYS  44           1HZ      LYS  44   1.804  18.945   4.732
  336    HZ3  LYS  44           2HZ      LYS  44   0.254  18.557   4.180
  337    H    ASP  45           H        ASP  45  -2.507  12.160   1.611
  338    HA   ASP  45           HA       ASP  45  -4.116  13.124  -0.486
  339    HB2  ASP  45           2HB      ASP  45  -2.469  11.046  -0.309
  340    HB3  ASP  45           1HB      ASP  45  -3.964  10.186   0.040
  341    H    GLY  46           H        GLY  46  -4.897  10.832   2.142
  342    HA2  GLY  46           2HA      GLY  46  -6.935  10.762   3.322
  343    HA3  GLY  46           1HA      GLY  46  -7.670  11.753   2.075
  344    H    LYS  47           H        LYS  47  -6.500   9.870  -0.014
  345    HA   LYS  47           HA       LYS  47  -8.776   8.211  -0.295
  346    HB2  LYS  47           2HB      LYS  47  -6.851   9.119  -1.994
  347    HB3  LYS  47           1HB      LYS  47  -6.363   7.442  -1.804
  348    HG2  LYS  47           2HG      LYS  47  -8.081   6.674  -3.013
  349    HG3  LYS  47           1HG      LYS  47  -9.224   7.811  -2.296
  350    HD2  LYS  47           2HD      LYS  47  -7.899   9.563  -3.736
  351    HD3  LYS  47           1HD      LYS  47  -7.453   8.139  -4.677
  352    HE2  LYS  47           2HE      LYS  47  -9.573   7.804  -5.437
  353    HE3  LYS  47           1HE      LYS  47 -10.316   8.460  -3.979
  354    HZ1  LYS  47           3HZ      LYS  47 -10.672   9.886  -5.905
  355    HZ2  LYS  47           1HZ      LYS  47  -9.001  10.068  -6.105
  356    HZ3  LYS  47           2HZ      LYS  47  -9.760  10.681  -4.723
  357    H    LEU  48           H        LEU  48  -5.465   7.589   0.803
  358    HA   LEU  48           HA       LEU  48  -6.011   4.763   1.163
  359    HG   LEU  48           HG       LEU  48  -4.156   3.407   1.022
  360    HB2  LEU  48           2HB      LEU  48  -3.770   5.915   0.445
  361    HB3  LEU  48           1HB      LEU  48  -3.540   6.109   2.173
  362   HD11  LEU  48          1HD1      LEU  48  -2.039   3.013   0.329
  363   HD12  LEU  48          2HD1      LEU  48  -1.328   4.138   1.486
  364   HD13  LEU  48          3HD1      LEU  48  -2.082   4.747   0.013
  365   HD21  LEU  48          3HD2      LEU  48  -2.304   3.806   3.279
  366   HD22  LEU  48          1HD2      LEU  48  -3.578   2.609   3.042
  367   HD23  LEU  48          2HD2      LEU  48  -3.988   4.239   3.573
  368    H    GLN  49           H        GLN  49  -6.709   3.854   2.959
  369    HA   GLN  49           HA       GLN  49  -6.371   5.232   5.526
  370    HB2  GLN  49           2HB      GLN  49  -8.649   4.569   6.170
  371    HB3  GLN  49           1HB      GLN  49  -8.653   5.655   4.790
  372    HG2  GLN  49           2HG      GLN  49  -8.738   2.705   4.349
  373    HG3  GLN  49           1HG      GLN  49 -10.199   3.565   4.827
  374   HE21  GLN  49          1HE2      GLN  49  -8.336   2.571   2.252
  375   HE22  GLN  49          2HE2      GLN  49  -9.005   3.590   1.028
  376    H    ILE  50           H        ILE  50  -6.047   3.886   7.302
  377    HA   ILE  50           HA       ILE  50  -4.681   1.529   6.982
  378    HB   ILE  50           HB       ILE  50  -6.383   2.297   9.363
  379   HG12  ILE  50          2HG1      ILE  50  -3.503   2.579   9.641
  380   HG13  ILE  50          1HG1      ILE  50  -4.117   3.549   8.305
  381   HG21  ILE  50          1HG2      ILE  50  -5.051   0.774  10.662
  382   HG22  ILE  50          2HG2      ILE  50  -4.060   0.378   9.259
  383   HG23  ILE  50          3HG2      ILE  50  -5.755  -0.103   9.304
  384   HD11  ILE  50          3HD1      ILE  50  -5.245   3.635  11.089
  385   HD12  ILE  50          1HD1      ILE  50  -5.602   4.723   9.749
  386   HD13  ILE  50          2HD1      ILE  50  -4.001   4.731  10.489
  387    H    GLY  51           H        GLY  51  -5.219  -0.443   6.290
  388    HA2  GLY  51           2HA      GLY  51  -6.662  -2.404   6.770
  389    HA3  GLY  51           1HA      GLY  51  -8.028  -1.322   6.588
  390    H    ASP  52           H        ASP  52  -6.514  -0.020   4.221
  391    HA   ASP  52           HA       ASP  52  -7.751  -1.586   2.226
  392    HB2  ASP  52           2HB      ASP  52  -6.449  -0.043   0.644
  393    HB3  ASP  52           1HB      ASP  52  -7.621   0.698   1.722
  394    H    LYS  53           H        LYS  53  -6.675  -2.550   0.350
  395    HA   LYS  53           HA       LYS  53  -4.156  -3.843   1.147
  396    HB2  LYS  53           2HB      LYS  53  -4.858  -5.591  -0.595
  397    HB3  LYS  53           1HB      LYS  53  -5.716  -5.562   0.934
  398    HG2  LYS  53           2HG      LYS  53  -6.874  -3.966  -1.263
  399    HG3  LYS  53           1HG      LYS  53  -6.941  -5.722  -1.422
  400    HD2  LYS  53           2HD      LYS  53  -8.436  -5.948   0.255
  401    HD3  LYS  53           1HD      LYS  53  -7.709  -4.659   1.216
  402    HE2  LYS  53           2HE      LYS  53  -8.699  -3.142  -0.702
  403    HE3  LYS  53           1HE      LYS  53  -9.792  -4.509  -0.908
  404    HZ1  LYS  53           3HZ      LYS  53  -9.357  -3.014   1.622
  405    HZ2  LYS  53           1HZ      LYS  53 -10.416  -4.318   1.417
  406    HZ3  LYS  53           2HZ      LYS  53 -10.700  -2.861   0.606
  407    H    LEU  54           H        LEU  54  -2.559  -4.147  -0.330
  408    HA   LEU  54           HA       LEU  54  -2.530  -2.199  -2.516
  409    HG   LEU  54           HG       LEU  54  -1.293  -0.709  -1.208
  410    HB2  LEU  54           2HB      LEU  54  -0.574  -3.137  -0.602
  411    HB3  LEU  54           1HB      LEU  54   0.053  -3.179  -2.238
  412   HD11  LEU  54          1HD1      LEU  54   0.282  -0.320   0.297
  413   HD12  LEU  54          2HD1      LEU  54   1.504  -0.406  -0.971
  414   HD13  LEU  54          3HD1      LEU  54   1.055  -1.859  -0.080
  415   HD21  LEU  54          3HD2      LEU  54   0.407   0.302  -2.786
  416   HD22  LEU  54          1HD2      LEU  54  -0.871  -0.660  -3.528
  417   HD23  LEU  54          2HD2      LEU  54   0.743  -1.342  -3.328
  418    H    LEU  55           H        LEU  55  -2.974  -2.910  -4.443
  419    HA   LEU  55           HA       LEU  55  -2.662  -5.673  -5.197
  420    HG   LEU  55           HG       LEU  55  -2.601  -4.735  -8.304
  421    HB2  LEU  55           2HB      LEU  55  -4.596  -4.612  -6.045
  422    HB3  LEU  55           1HB      LEU  55  -3.689  -3.226  -6.611
  423   HD11  LEU  55          1HD1      LEU  55  -4.781  -6.683  -8.116
  424   HD12  LEU  55          2HD1      LEU  55  -3.609  -6.765  -6.801
  425   HD13  LEU  55          3HD1      LEU  55  -3.069  -6.919  -8.473
  426   HD21  LEU  55          3HD2      LEU  55  -4.627  -3.227  -8.665
  427   HD22  LEU  55          1HD2      LEU  55  -5.588  -4.703  -8.600
  428   HD23  LEU  55          2HD2      LEU  55  -4.353  -4.510  -9.844
  429    H    ALA  56           H        ALA  56  -1.399  -2.554  -6.471
  430    HA   ALA  56           HA       ALA  56   1.172  -3.853  -6.960
  431    HB1  ALA  56           3HB      ALA  56  -0.522  -2.723  -9.198
  432    HB2  ALA  56           1HB      ALA  56   0.063  -4.379  -9.030
  433    HB3  ALA  56           2HB      ALA  56   1.200  -3.067  -9.355
  434    H    VAL  57           H        VAL  57   2.913  -2.344  -7.317
  435    HA   VAL  57           HA       VAL  57   2.244   0.501  -7.088
  436    HB   VAL  57           HB       VAL  57   4.312   0.572  -5.430
  437   HG11  VAL  57          1HG1      VAL  57   2.589   0.375  -3.533
  438   HG12  VAL  57          2HG1      VAL  57   1.419   0.093  -4.822
  439   HG13  VAL  57          3HG1      VAL  57   2.333   1.601  -4.775
  440   HG21  VAL  57          3HG2      VAL  57   3.046  -2.072  -4.727
  441   HG22  VAL  57          1HG2      VAL  57   4.356  -1.257  -3.874
  442   HG23  VAL  57          2HG2      VAL  57   4.621  -1.890  -5.499
  443    H    ASN  58           H        ASN  58   3.298   1.572  -8.611
  444    HA   ASN  58           HA       ASN  58   4.891   2.247 -10.083
  445    HB2  ASN  58           2HB      ASN  58   6.764   0.572  -8.392
  446    HB3  ASN  58           1HB      ASN  58   7.259   1.739  -9.614
  447   HD21  ASN  58          1HD2      ASN  58   6.839   3.970  -9.240
  448   HD22  ASN  58          2HD2      ASN  58   6.650   4.569  -7.631
  449    H    ASN  59           H        ASN  59   3.286  -0.024 -10.651
  450    HA   ASN  59           HA       ASN  59   3.043  -1.326 -12.536
  451    HB2  ASN  59           2HB      ASN  59   5.172  -0.054 -13.362
  452    HB3  ASN  59           1HB      ASN  59   6.001  -1.553 -12.956
  453   HD21  ASN  59          1HD2      ASN  59   5.827  -3.275 -14.290
  454   HD22  ASN  59          2HD2      ASN  59   4.910  -3.279 -15.753
  455    H    VAL  60           H        VAL  60   5.071  -2.091  -9.852
  456    HA   VAL  60           HA       VAL  60   5.138  -4.934 -10.505
  457    HB   VAL  60           HB       VAL  60   6.399  -5.245  -8.455
  458   HG11  VAL  60          1HG1      VAL  60   8.264  -3.437  -8.999
  459   HG12  VAL  60          2HG1      VAL  60   7.264  -3.216 -10.436
  460   HG13  VAL  60          3HG1      VAL  60   7.941  -4.802 -10.068
  461   HG21  VAL  60          3HG2      VAL  60   5.124  -3.039  -7.495
  462   HG22  VAL  60          1HG2      VAL  60   6.745  -2.418  -7.803
  463   HG23  VAL  60          2HG2      VAL  60   6.520  -3.812  -6.747
  464    H    CYS  61           H        CYS  61   4.107  -6.549  -9.249
  465    HA   CYS  61           HA       CYS  61   1.646  -5.631  -8.017
  466    HG   CYS  61           HG       CYS  61   2.899  -9.492  -7.540
  467    HB2  CYS  61           2HB      CYS  61   0.973  -7.948  -7.978
  468    HB3  CYS  61           1HB      CYS  61   1.617  -7.555  -9.567
  469    H    LEU  62           H        LEU  62   1.232  -5.546  -5.901
  470    HA   LEU  62           HA       LEU  62   3.351  -6.391  -4.065
  471    HG   LEU  62           HG       LEU  62   3.441  -5.076  -1.886
  472    HB2  LEU  62           2HB      LEU  62   2.064  -3.981  -4.336
  473    HB3  LEU  62           1HB      LEU  62   1.209  -4.712  -2.996
  474   HD11  LEU  62          1HD1      LEU  62   4.312  -3.734  -4.379
  475   HD12  LEU  62          2HD1      LEU  62   5.119  -4.966  -3.409
  476   HD13  LEU  62          3HD1      LEU  62   5.128  -3.284  -2.882
  477   HD21  LEU  62          3HD2      LEU  62   2.703  -2.222  -2.518
  478   HD22  LEU  62          1HD2      LEU  62   3.647  -2.774  -1.135
  479   HD23  LEU  62          2HD2      LEU  62   1.950  -3.228  -1.282
  480    H    GLU  63           H        GLU  63   1.136  -8.123  -5.224
  481    HA   GLU  63           HA       GLU  63  -0.274  -8.809  -2.739
  482    HB2  GLU  63           2HB      GLU  63  -0.883  -9.597  -5.591
  483    HB3  GLU  63           1HB      GLU  63  -1.822 -10.080  -4.185
  484    HG2  GLU  63           2HG      GLU  63  -1.714  -7.337  -3.963
  485    HG3  GLU  63           1HG      GLU  63  -1.863  -7.602  -5.698
  486    H    GLU  64           H        GLU  64   2.184  -9.976  -4.871
  487    HA   GLU  64           HA       GLU  64   2.172 -12.533  -3.416
  488    HB2  GLU  64           2HB      GLU  64   1.955 -12.086  -6.234
  489    HB3  GLU  64           1HB      GLU  64   3.440 -12.958  -5.897
  490    HG2  GLU  64           2HG      GLU  64   1.541 -14.442  -6.368
  491    HG3  GLU  64           1HG      GLU  64   2.220 -14.691  -4.760
  492    H    VAL  65           H        VAL  65   3.569 -10.569  -2.313
  493    HA   VAL  65           HA       VAL  65   6.346 -11.373  -2.814
  494    HB   VAL  65           HB       VAL  65   7.091  -8.999  -2.454
  495   HG11  VAL  65          1HG1      VAL  65   6.777  -8.351  -4.780
  496   HG12  VAL  65          2HG1      VAL  65   5.477  -9.531  -4.947
  497   HG13  VAL  65          3HG1      VAL  65   7.130 -10.074  -4.654
  498   HG21  VAL  65          3HG2      VAL  65   5.107  -8.028  -1.524
  499   HG22  VAL  65          1HG2      VAL  65   4.170  -8.443  -2.960
  500   HG23  VAL  65          2HG2      VAL  65   5.446  -7.230  -3.059
  501    H    THR  66           H        THR  66   7.796 -11.003  -1.083
  502    HA   THR  66           HA       THR  66   6.684 -11.492   1.488
  503    HB   THR  66           HB       THR  66   8.976 -11.435   2.309
  504    HG1  THR  66           1HG      THR  66   9.648 -10.378  -0.238
  505   HG21  THR  66          3HG2      THR  66   9.127 -12.658  -0.427
  506   HG22  THR  66          1HG2      THR  66   8.255 -13.398   0.915
  507   HG23  THR  66          2HG2      THR  66   9.994 -13.131   1.034
  508    H    HIS  67           H        HIS  67   7.398 -10.109   3.436
  509    HA   HIS  67           HA       HIS  67   6.177  -7.609   3.202
  510    HD1  HIS  67           1HD      HIS  67   4.932  -7.075   6.424
  511    HD2  HIS  67           2HD      HIS  67   8.592  -5.451   5.340
  512    HE1  HIS  67           1HE      HIS  67   4.859  -4.684   7.161
  513    HE2  HIS  67           2HE      HIS  67   7.027  -3.693   6.383
  514    HB2  HIS  67           2HB      HIS  67   6.381  -8.748   5.369
  515    HB3  HIS  67           1HB      HIS  67   8.108  -8.417   5.398
  516    H    GLU  68           H        GLU  68   9.608  -8.457   3.031
  517    HA   GLU  68           HA       GLU  68  10.768  -5.961   3.069
  518    HB2  GLU  68           2HB      GLU  68  11.516  -8.303   1.303
  519    HB3  GLU  68           1HB      GLU  68  12.541  -6.910   1.616
  520    HG2  GLU  68           2HG      GLU  68  11.949  -7.737   4.143
  521    HG3  GLU  68           1HG      GLU  68  12.006  -9.264   3.263
  522    H    GLU  69           H        GLU  69   9.392  -7.654   0.257
  523    HA   GLU  69           HA       GLU  69   9.919  -5.671  -1.657
  524    HB2  GLU  69           2HB      GLU  69   8.131  -8.021  -1.470
  525    HB3  GLU  69           1HB      GLU  69   7.688  -6.805  -2.661
  526    HG2  GLU  69           2HG      GLU  69  10.395  -8.105  -2.491
  527    HG3  GLU  69           1HG      GLU  69   9.094  -8.640  -3.552
  528    H    ALA  70           H        ALA  70   7.240  -6.053   0.608
  529    HA   ALA  70           HA       ALA  70   5.460  -4.143  -0.447
  530    HB1  ALA  70           3HB      ALA  70   5.796  -4.570   2.499
  531    HB2  ALA  70           1HB      ALA  70   5.142  -5.844   1.473
  532    HB3  ALA  70           2HB      ALA  70   4.326  -4.287   1.572
  533    H    VAL  71           H        VAL  71   8.175  -3.858   1.789
  534    HA   VAL  71           HA       VAL  71   7.824  -1.020   2.192
  535    HB   VAL  71           HB       VAL  71  10.000  -2.936   3.038
  536   HG11  VAL  71          1HG1      VAL  71   9.891   0.032   3.182
  537   HG12  VAL  71          2HG1      VAL  71  11.273  -1.042   2.969
  538   HG13  VAL  71          3HG1      VAL  71  10.548  -0.845   4.563
  539   HG21  VAL  71          3HG2      VAL  71   8.399  -1.419   4.997
  540   HG22  VAL  71          1HG2      VAL  71   8.946  -3.095   5.031
  541   HG23  VAL  71          2HG2      VAL  71   7.532  -2.646   4.077
  542    H    THR  72           H        THR  72   9.951  -3.123   0.311
  543    HA   THR  72           HA       THR  72  11.739  -1.143  -0.581
  544    HB   THR  72           HB       THR  72  10.977  -3.783  -1.843
  545    HG1  THR  72           1HG      THR  72  13.068  -3.036  -0.079
  546   HG21  THR  72          3HG2      THR  72  13.331  -1.990  -2.391
  547   HG22  THR  72          1HG2      THR  72  12.085  -2.501  -3.529
  548   HG23  THR  72          2HG2      THR  72  13.229  -3.680  -2.886
  549    H    ALA  73           H        ALA  73   8.668  -2.320  -1.901
  550    HA   ALA  73           HA       ALA  73   8.885  -0.858  -4.346
  551    HB1  ALA  73           3HB      ALA  73   6.734  -1.676  -4.855
  552    HB2  ALA  73           1HB      ALA  73   6.349  -1.950  -3.156
  553    HB3  ALA  73           2HB      ALA  73   7.536  -2.971  -3.967
  554    H    LEU  74           H        LEU  74   7.270  -0.340  -1.215
  555    HA   LEU  74           HA       LEU  74   5.912   2.031  -2.031
  556    HG   LEU  74           HG       LEU  74   3.978   2.018  -0.558
  557    HB2  LEU  74           2HB      LEU  74   6.378   0.532   0.468
  558    HB3  LEU  74           1HB      LEU  74   6.064   2.248   0.655
  559   HD11  LEU  74          1HD1      LEU  74   3.386  -0.656  -0.638
  560   HD12  LEU  74          2HD1      LEU  74   5.061  -0.611  -1.184
  561   HD13  LEU  74          3HD1      LEU  74   3.837   0.340  -2.022
  562   HD21  LEU  74          3HD2      LEU  74   4.383   0.155   1.759
  563   HD22  LEU  74          1HD2      LEU  74   2.793   0.550   1.105
  564   HD23  LEU  74          2HD2      LEU  74   3.803   1.821   1.793
  565    H    LYS  75           H        LYS  75   9.056   1.287  -0.767
  566    HA   LYS  75           HA       LYS  75   9.679   4.072  -0.193
  567    HB2  LYS  75           2HB      LYS  75  11.681   3.333   0.770
  568    HB3  LYS  75           1HB      LYS  75  10.514   2.085   1.174
  569    HG2  LYS  75           2HG      LYS  75  11.653   0.514   0.078
  570    HG3  LYS  75           1HG      LYS  75  11.930   1.556  -1.318
  571    HD2  LYS  75           2HD      LYS  75  14.075   1.173  -0.502
  572    HD3  LYS  75           1HD      LYS  75  13.656   2.742   0.188
  573    HE2  LYS  75           2HE      LYS  75  12.877   0.445   1.836
  574    HE3  LYS  75           1HE      LYS  75  14.615   0.611   1.598
  575    HZ1  LYS  75           3HZ      LYS  75  13.905   1.807   3.556
  576    HZ2  LYS  75           1HZ      LYS  75  12.791   2.706   2.653
  577    HZ3  LYS  75           2HZ      LYS  75  14.450   2.903   2.389
  578    H    ASN  76           H        ASN  76  10.065   1.866  -2.842
  579    HA   ASN  76           HA       ASN  76  12.248   3.273  -4.075
  580    HB2  ASN  76           2HB      ASN  76  11.756   0.823  -4.406
  581    HB3  ASN  76           1HB      ASN  76  10.368   1.297  -5.381
  582   HD21  ASN  76          1HD2      ASN  76  10.683   1.584  -7.484
  583   HD22  ASN  76          2HD2      ASN  76  12.219   1.755  -8.255
  584    H    THR  77           H        THR  77  11.057   5.386  -3.801
  585    HA   THR  77           HA       THR  77   9.494   5.937  -6.236
  586    HB   THR  77           HB       THR  77   8.643   7.877  -4.498
  587    HG1  THR  77           1HG      THR  77   9.111   7.168  -2.575
  588   HG21  THR  77          3HG2      THR  77   6.638   6.281  -4.128
  589   HG22  THR  77          1HG2      THR  77   7.471   5.263  -5.303
  590   HG23  THR  77          2HG2      THR  77   6.987   6.902  -5.741
  591    H    SER  78           H        SER  78   9.883   7.862  -7.291
  592    HA   SER  78           HA       SER  78  12.224   9.383  -6.343
  593    HG   SER  78           HG       SER  78  11.400   8.822 -10.263
  594    HB2  SER  78           2HB      SER  78  12.526   9.928  -8.835
  595    HB3  SER  78           1HB      SER  78  12.920   8.288  -8.320
  596    H    ASP  79           H        ASP  79   9.869  10.056  -8.929
  597    HA   ASP  79           HA       ASP  79   9.382  12.667  -7.681
  598    HB2  ASP  79           2HB      ASP  79   8.553  13.371  -9.903
  599    HB3  ASP  79           1HB      ASP  79  10.216  12.797  -9.958
  600    H    PHE  80           H        PHE  80   7.628   9.968  -9.224
  601    HA   PHE  80           HA       PHE  80   5.261  10.737  -7.652
  602    HD1  PHE  80           1HD      PHE  80   4.977  13.061  -9.858
  603    HD2  PHE  80           2HD      PHE  80   2.260   9.857  -9.170
  604    HE1  PHE  80           1HE      PHE  80   3.155  14.682  -9.540
  605    HE2  PHE  80           2HE      PHE  80   0.434  11.477  -8.850
  606    HZ   PHE  80           HZ       PHE  80   0.883  13.889  -9.031
  607    HB2  PHE  80           2HB      PHE  80   5.510  10.748 -10.490
  608    HB3  PHE  80           1HB      PHE  80   4.424   9.434 -10.048
  609    H    VAL  81           H        VAL  81   3.614   8.873  -7.560
  610    HA   VAL  81           HA       VAL  81   4.850   6.241  -7.693
  611    HB   VAL  81           HB       VAL  81   5.191   7.136  -5.359
  612   HG11  VAL  81          1HG1      VAL  81   2.781   8.194  -5.464
  613   HG12  VAL  81          2HG1      VAL  81   3.485   7.658  -3.939
  614   HG13  VAL  81          3HG1      VAL  81   2.321   6.635  -4.782
  615   HG21  VAL  81          3HG2      VAL  81   3.402   4.718  -5.532
  616   HG22  VAL  81          1HG2      VAL  81   4.589   5.075  -4.278
  617   HG23  VAL  81          2HG2      VAL  81   5.122   4.723  -5.922
  618    H    TYR  82           H        TYR  82   3.440   4.795  -8.533
  619    HA   TYR  82           HA       TYR  82   0.629   5.630  -8.739
  620    HD1  TYR  82           1HD      TYR  82  -0.173   2.239 -10.400
  621    HD2  TYR  82           2HD      TYR  82   0.129   6.265 -11.742
  622    HE1  TYR  82           1HE      TYR  82  -2.316   2.005 -11.563
  623    HE2  TYR  82           2HE      TYR  82  -2.022   6.041 -12.910
  624    HH   TYR  82           HH       TYR  82  -3.383   3.333 -13.748
  625    HB2  TYR  82           2HB      TYR  82   2.041   5.129 -10.805
  626    HB3  TYR  82           1HB      TYR  82   1.946   3.439 -10.326
  627    H    LEU  83           H        LEU  83  -0.318   4.913  -6.937
  628    HA   LEU  83           HA       LEU  83   0.164   2.247  -5.924
  629    HG   LEU  83           HG       LEU  83  -0.310   1.897  -3.742
  630    HB2  LEU  83           2HB      LEU  83  -0.265   4.431  -4.582
  631    HB3  LEU  83           1HB      LEU  83  -1.957   4.090  -4.888
  632   HD11  LEU  83          1HD1      LEU  83   0.356   3.937  -2.482
  633   HD12  LEU  83          2HD1      LEU  83  -0.477   2.728  -1.504
  634   HD13  LEU  83          3HD1      LEU  83  -1.338   4.167  -2.051
  635   HD21  LEU  83          3HD2      LEU  83  -2.879   2.044  -4.373
  636   HD22  LEU  83          1HD2      LEU  83  -2.980   2.721  -2.748
  637   HD23  LEU  83          2HD2      LEU  83  -2.307   1.108  -2.991
  638    H    LYS  84           H        LYS  84  -0.973   0.500  -6.351
  639    HA   LYS  84           HA       LYS  84  -3.633   0.771  -7.577
  640    HB2  LYS  84           2HB      LYS  84  -1.440  -1.206  -8.130
  641    HB3  LYS  84           1HB      LYS  84  -3.107  -1.517  -8.587
  642    HG2  LYS  84           2HG      LYS  84  -2.502   1.052  -9.541
  643    HG3  LYS  84           1HG      LYS  84  -1.117   0.033  -9.934
  644    HD2  LYS  84           2HD      LYS  84  -2.561  -0.178 -11.773
  645    HD3  LYS  84           1HD      LYS  84  -2.818  -1.646 -10.828
  646    HE2  LYS  84           2HE      LYS  84  -4.982  -1.176 -10.667
  647    HE3  LYS  84           1HE      LYS  84  -4.604   0.354  -9.875
  648    HZ1  LYS  84           3HZ      LYS  84  -4.400   1.384 -12.056
  649    HZ2  LYS  84           1HZ      LYS  84  -5.933   0.694 -11.858
  650    HZ3  LYS  84           2HZ      LYS  84  -4.772  -0.085 -12.810
  651    H    VAL  85           H        VAL  85  -5.309  -0.168  -6.516
  652    HA   VAL  85           HA       VAL  85  -4.633  -2.115  -4.412
  653    HB   VAL  85           HB       VAL  85  -6.797  -0.004  -4.371
  654   HG11  VAL  85          1HG1      VAL  85  -6.414  -2.469  -2.804
  655   HG12  VAL  85          2HG1      VAL  85  -7.879  -1.533  -3.115
  656   HG13  VAL  85          3HG1      VAL  85  -6.751  -1.017  -1.861
  657   HG21  VAL  85          3HG2      VAL  85  -5.446   0.584  -2.219
  658   HG22  VAL  85          1HG2      VAL  85  -4.870   1.128  -3.795
  659   HG23  VAL  85          2HG2      VAL  85  -4.142  -0.284  -3.029
  660    H    ALA  86           H        ALA  86  -5.737  -3.973  -4.364
  661    HA   ALA  86           HA       ALA  86  -7.842  -4.385  -6.382
  662    HB1  ALA  86           3HB      ALA  86  -7.280  -6.874  -5.795
  663    HB2  ALA  86           1HB      ALA  86  -5.781  -6.179  -5.179
  664    HB3  ALA  86           2HB      ALA  86  -6.228  -5.955  -6.870
  665    H    LYS  87           H        LYS  87  -9.706  -5.702  -5.792
  666    HA   LYS  87           HA       LYS  87 -10.321  -5.515  -2.918
  667    HB2  LYS  87           2HB      LYS  87 -11.660  -4.092  -4.576
  668    HB3  LYS  87           1HB      LYS  87 -12.373  -5.603  -5.122
  669    HG2  LYS  87           2HG      LYS  87 -13.639  -5.840  -3.267
  670    HG3  LYS  87           1HG      LYS  87 -12.422  -5.118  -2.211
  671    HD2  LYS  87           2HD      LYS  87 -12.996  -2.898  -3.260
  672    HD3  LYS  87           1HD      LYS  87 -14.361  -3.705  -4.035
  673    HE2  LYS  87           2HE      LYS  87 -13.975  -3.924  -1.078
  674    HE3  LYS  87           1HE      LYS  87 -14.694  -2.467  -1.765
  675    HZ1  LYS  87           3HZ      LYS  87 -16.381  -4.071  -1.122
  676    HZ2  LYS  87           1HZ      LYS  87 -15.704  -5.237  -2.145
  677    HZ3  LYS  87           2HZ      LYS  87 -16.396  -3.838  -2.797
  678    HA   PRO  88           HA       PRO  88 -10.088 -10.018  -3.396
  679    HB2  PRO  88           2HB      PRO  88 -10.598 -10.478  -0.718
  680    HB3  PRO  88           1HB      PRO  88  -8.998 -10.210  -1.412
  681    HG2  PRO  88           2HG      PRO  88 -10.803  -8.287  -0.011
  682    HG3  PRO  88           1HG      PRO  88  -9.042  -8.462   0.104
  683    HD2  PRO  88           2HD      PRO  88 -10.167  -6.501  -1.340
  684    HD3  PRO  88           1HD      PRO  88  -8.673  -7.302  -1.869
  685    H    THR  89           H        THR  89 -11.646 -11.556  -3.657
  686    HA   THR  89           HA       THR  89 -14.195 -11.433  -2.359
  687    HB   THR  89           HB       THR  89 -14.577  -9.720  -4.053
  688    HG1  THR  89           1HG      THR  89 -16.403 -10.835  -3.728
  689   HG21  THR  89          3HG2      THR  89 -14.507 -10.115  -6.396
  690   HG22  THR  89          1HG2      THR  89 -14.069 -11.807  -6.155
  691   HG23  THR  89          2HG2      THR  89 -12.927 -10.532  -5.728
  692    H    GLY  90           H        GLY  90 -15.258 -13.374  -2.416
  693    HA2  GLY  90           2HA      GLY  90 -15.772 -15.532  -3.155
  694    HA3  GLY  90           1HA      GLY  90 -14.501 -15.402  -4.357
  695    H    SER  91           H        SER  91 -13.365 -14.472  -1.302
  696    HA   SER  91           HA       SER  91 -11.698 -16.797  -1.120
  697    HG   SER  91           HG       SER  91  -9.681 -14.344  -0.269
  698    HB2  SER  91           2HB      SER  91 -12.015 -14.397   0.697
  699    HB3  SER  91           1HB      SER  91 -10.819 -15.671   0.943
  700    H    HIS  92           H        HIS  92 -14.417 -15.488   0.751
  701    HA   HIS  92           HA       HIS  92 -14.356 -17.583   2.706
  702    HD1  HIS  92           1HD      HIS  92 -16.358 -13.592   3.943
  703    HD2  HIS  92           2HD      HIS  92 -13.461 -16.529   4.440
  704    HE1  HIS  92           1HE      HIS  92 -14.819 -12.721   5.730
  705    HE2  HIS  92           2HE      HIS  92 -13.140 -14.564   6.092
  706    HB2  HIS  92           2HB      HIS  92 -16.299 -15.380   2.054
  707    HB3  HIS  92           1HB      HIS  92 -16.705 -16.627   3.228
  708    HA   ARG 301           HA       ARG 301   2.384 -10.596  10.869
  709    HE   ARG 301           HE       ARG 301   0.351 -13.757  11.727
  710    H1   ARG 301           1HT      ARG 301   3.361 -11.431  13.510
  711    H2   ARG 301           2HT      ARG 301   4.239 -11.698  12.060
  712    H3   ARG 301           3HT      ARG 301   2.683 -12.391  12.261
  713    HB2  ARG 301           2HB      ARG 301   1.741  -9.626  13.663
  714    HB3  ARG 301           1HB      ARG 301   0.907  -9.194  12.177
  715    HG2  ARG 301           2HG      ARG 301   0.954 -11.923  13.454
  716    HG3  ARG 301           1HG      ARG 301  -0.389 -10.779  13.481
  717    HD2  ARG 301           2HD      ARG 301  -0.923 -11.145  11.284
  718    HD3  ARG 301           1HD      ARG 301   0.724 -11.581  10.844
  719   HH11  ARG 301          1HH1      ARG 301  -2.550 -11.782  11.633
  720   HH12  ARG 301          2HH1      ARG 301  -3.617 -13.140  11.725
  721   HH21  ARG 301          1HH2      ARG 301  -1.067 -15.531  11.846
  722   HH22  ARG 301          2HH2      ARG 301  -2.779 -15.265  11.843
  723    H    ARG 302           H        ARG 302   4.250  -9.696  10.005
  724    HA   ARG 302           HA       ARG 302   5.786  -7.783  11.557
  725    HE   ARG 302           HE       ARG 302   8.284  -8.607  12.269
  726    HB2  ARG 302           2HB      ARG 302   6.924  -9.354  10.025
  727    HB3  ARG 302           1HB      ARG 302   6.082  -8.622   8.668
  728    HG2  ARG 302           2HG      ARG 302   7.975  -7.434   8.481
  729    HG3  ARG 302           1HG      ARG 302   7.225  -6.432   9.724
  730    HD2  ARG 302           2HD      ARG 302   9.199  -8.670  10.177
  731    HD3  ARG 302           1HD      ARG 302   9.534  -6.945  10.300
  732   HH11  ARG 302          1HH1      ARG 302   8.497  -5.322  11.069
  733   HH12  ARG 302          2HH1      ARG 302   8.024  -4.613  12.574
  734   HH21  ARG 302          1HH2      ARG 302   7.662  -7.664  14.247
  735   HH22  ARG 302          2HH2      ARG 302   7.549  -5.941  14.379
  736    H    GLU 303           H        GLU 303   5.335  -5.700  11.648
  737    HA   GLU 303           HA       GLU 303   3.961  -4.426   9.381
  738    HB2  GLU 303           2HB      GLU 303   3.399  -3.691  12.255
  739    HB3  GLU 303           1HB      GLU 303   2.510  -3.202  10.820
  740    HG2  GLU 303           2HG      GLU 303   1.988  -5.699  10.538
  741    HG3  GLU 303           1HG      GLU 303   2.522  -5.856  12.209
  742    H    THR 304           H        THR 304   5.791  -3.485   8.592
  743    HA   THR 304           HA       THR 304   7.361  -1.767  10.372
  744    HB   THR 304           HB       THR 304   7.966  -3.434   8.084
  745    HG1  THR 304           1HG      THR 304   9.368  -3.757   9.612
  746   HG21  THR 304          3HG2      THR 304   9.108  -0.656   7.963
  747   HG22  THR 304          1HG2      THR 304   8.003  -1.378   6.792
  748   HG23  THR 304          2HG2      THR 304   9.623  -2.043   7.004
  749    H    GLN 305           H        GLN 305   7.795   0.399   9.866
  750    HA   GLN 305           HA       GLN 305   5.671   1.714   8.393
  751    HB2  GLN 305           2HB      GLN 305   7.953   2.783  10.055
  752    HB3  GLN 305           1HB      GLN 305   6.804   3.810   9.208
  753    HG2  GLN 305           2HG      GLN 305   5.152   3.425  10.690
  754    HG3  GLN 305           1HG      GLN 305   5.635   1.752  10.960
  755   HE21  GLN 305          1HE2      GLN 305   6.238   5.088  11.833
  756   HE22  GLN 305          2HE2      GLN 305   7.071   4.751  13.308
  757    H    VAL 306           H        VAL 306   5.984   3.128   6.649
  758    HA   VAL 306           HA       VAL 306   8.603   3.019   5.327
  759    HB   VAL 306           HB       VAL 306   7.453   2.685   3.134
  760   HG11  VAL 306          1HG1      VAL 306   7.061   0.462   5.135
  761   HG12  VAL 306          2HG1      VAL 306   8.576   0.851   4.319
  762   HG13  VAL 306          3HG1      VAL 306   7.193   0.284   3.385
  763   HG21  VAL 306          3HG2      VAL 306   5.210   3.389   3.759
  764   HG22  VAL 306          1HG2      VAL 306   5.077   2.029   4.876
  765   HG23  VAL 306          2HG2      VAL 306   5.187   1.738   3.138
  Start of MODEL   28
    1    HA   MET   1           HA       MET   1  -8.858   1.293  -8.805
    2    H1   MET   1           1HT      MET   1  -9.612  -0.409  -7.363
    3    H2   MET   1           2HT      MET   1  -8.338  -0.089  -6.257
    4    H3   MET   1           3HT      MET   1  -7.987  -0.698  -7.822
    5    HB2  MET   1           2HB      MET   1  -9.571   1.754  -5.969
    6    HB3  MET   1           1HB      MET   1  -8.977   3.160  -6.842
    7    HG2  MET   1           2HG      MET   1 -10.858   3.373  -8.011
    8    HG3  MET   1           1HG      MET   1 -10.971   1.644  -8.328
    9    HE1  MET   1           3HE      MET   1 -11.060   4.206  -5.525
   10    HE2  MET   1           1HE      MET   1 -12.518   3.833  -4.604
   11    HE3  MET   1           2HE      MET   1 -12.648   4.582  -6.195
   12    H    GLU   2           H        GLU   2  -7.518   3.235  -9.054
   13    HA   GLU   2           HA       GLU   2  -4.824   2.823  -7.939
   14    HB2  GLU   2           2HB      GLU   2  -3.857   3.546  -9.944
   15    HB3  GLU   2           1HB      GLU   2  -5.199   2.538 -10.461
   16    HG2  GLU   2           2HG      GLU   2  -5.352   4.357 -11.871
   17    HG3  GLU   2           1HG      GLU   2  -6.518   4.747 -10.610
   18    H    ILE   3           H        ILE   3  -3.493   4.751  -7.630
   19    HA   ILE   3           HA       ILE   3  -4.938   7.266  -7.307
   20    HB   ILE   3           HB       ILE   3  -3.302   5.948  -5.123
   21   HG12  ILE   3          2HG1      ILE   3  -5.660   6.524  -3.956
   22   HG13  ILE   3          1HG1      ILE   3  -6.219   6.255  -5.603
   23   HG21  ILE   3          1HG2      ILE   3  -4.065   7.987  -3.809
   24   HG22  ILE   3          2HG2      ILE   3  -4.454   8.705  -5.373
   25   HG23  ILE   3          3HG2      ILE   3  -2.796   8.228  -5.009
   26   HD11  ILE   3          3HD1      ILE   3  -4.418   4.166  -4.843
   27   HD12  ILE   3          1HD1      ILE   3  -6.114   4.067  -5.318
   28   HD13  ILE   3          2HD1      ILE   3  -5.686   4.344  -3.630
   29    H    LYS   4           H        LYS   4  -3.592   9.073  -7.664
   30    HA   LYS   4           HA       LYS   4  -0.860   8.387  -8.510
   31    HB2  LYS   4           2HB      LYS   4  -2.906   9.979  -9.698
   32    HB3  LYS   4           1HB      LYS   4  -1.558  11.035  -9.304
   33    HG2  LYS   4           2HG      LYS   4  -0.046   9.580 -10.553
   34    HG3  LYS   4           1HG      LYS   4  -1.395   8.511 -10.941
   35    HD2  LYS   4           2HD      LYS   4  -1.174   9.847 -12.844
   36    HD3  LYS   4           1HD      LYS   4  -2.497  10.602 -11.952
   37    HE2  LYS   4           2HE      LYS   4  -1.190  12.417 -12.559
   38    HE3  LYS   4           1HE      LYS   4  -0.642  12.077 -10.918
   39    HZ1  LYS   4           3HZ      LYS   4   0.717  11.382 -13.460
   40    HZ2  LYS   4           1HZ      LYS   4   1.183  10.741 -11.965
   41    HZ3  LYS   4           2HZ      LYS   4   1.273  12.408 -12.236
   42    H    LEU   5           H        LEU   5   0.124   8.459  -6.538
   43    HA   LEU   5           HA       LEU   5  -0.043  10.874  -4.923
   44    HG   LEU   5           HG       LEU   5   0.072  10.638  -2.841
   45    HB2  LEU   5           2HB      LEU   5   0.389   8.216  -4.317
   46    HB3  LEU   5           1HB      LEU   5   1.973   8.936  -4.102
   47   HD11  LEU   5          1HD1      LEU   5  -1.318   8.522  -2.866
   48   HD12  LEU   5          2HD1      LEU   5  -1.024   9.249  -1.285
   49   HD13  LEU   5          3HD1      LEU   5  -0.106   7.829  -1.789
   50   HD21  LEU   5          3HD2      LEU   5   1.585   9.086  -0.981
   51   HD22  LEU   5          1HD2      LEU   5   1.800  10.770  -1.461
   52   HD23  LEU   5          2HD2      LEU   5   2.600   9.486  -2.367
   53    H    ILE   6           H        ILE   6   1.295  12.526  -4.982
   54    HA   ILE   6           HA       ILE   6   3.676  12.379  -6.667
   55    HB   ILE   6           HB       ILE   6   2.096  14.253  -7.006
   56   HG12  ILE   6          2HG1      ILE   6   4.797  15.139  -5.966
   57   HG13  ILE   6          1HG1      ILE   6   4.501  14.471  -7.568
   58   HG21  ILE   6          1HG2      ILE   6   1.639  15.890  -5.423
   59   HG22  ILE   6          2HG2      ILE   6   3.015  15.442  -4.416
   60   HG23  ILE   6          3HG2      ILE   6   1.594  14.399  -4.481
   61   HD11  ILE   6          3HD1      ILE   6   2.734  16.496  -7.570
   62   HD12  ILE   6          1HD1      ILE   6   4.398  16.641  -8.136
   63   HD13  ILE   6          2HD1      ILE   6   3.973  17.160  -6.505
   64    H    LYS   7           H        LYS   7   5.697  12.308  -5.870
   65    HA   LYS   7           HA       LYS   7   6.275  11.803  -3.210
   66    HB2  LYS   7           2HB      LYS   7   7.796  11.238  -5.042
   67    HB3  LYS   7           1HB      LYS   7   8.115  12.944  -5.315
   68    HG2  LYS   7           2HG      LYS   7   9.958  12.268  -4.100
   69    HG3  LYS   7           1HG      LYS   7   8.910  12.956  -2.859
   70    HD2  LYS   7           2HD      LYS   7   8.042  10.470  -2.698
   71    HD3  LYS   7           1HD      LYS   7   9.628  10.113  -3.385
   72    HE2  LYS   7           2HE      LYS   7  10.525  11.655  -1.515
   73    HE3  LYS   7           1HE      LYS   7   8.948  11.407  -0.768
   74    HZ1  LYS   7           3HZ      LYS   7   9.342   9.045  -0.738
   75    HZ2  LYS   7           1HZ      LYS   7  10.631   9.832   0.024
   76    HZ3  LYS   7           2HZ      LYS   7  10.815   9.231  -1.546
   77    H    GLY   8           H        GLY   8   6.092  13.049  -1.492
   78    HA2  GLY   8           2HA      GLY   8   6.123  15.950  -1.756
   79    HA3  GLY   8           1HA      GLY   8   5.683  15.040  -0.320
   80    HA   PRO   9           HA       PRO   9   9.967  16.781   0.279
   81    HB2  PRO   9           2HB      PRO   9   8.961  18.167   2.615
   82    HB3  PRO   9           1HB      PRO   9   9.639  18.847   1.135
   83    HG2  PRO   9           2HG      PRO   9   7.020  19.104   1.846
   84    HG3  PRO   9           1HG      PRO   9   7.582  19.106   0.164
   85    HD2  PRO   9           2HD      PRO   9   6.379  16.866   1.756
   86    HD3  PRO   9           1HD      PRO   9   6.050  17.357   0.078
   87    H    LYS  10           H        LYS  10   9.011  14.195   1.109
   88    HA   LYS  10           HA       LYS  10  10.772  13.683   3.250
   89    HB2  LYS  10           2HB      LYS  10   8.018  14.301   3.970
   90    HB3  LYS  10           1HB      LYS  10   8.489  12.696   4.509
   91    HG2  LYS  10           2HG      LYS  10  10.009  13.483   6.001
   92    HG3  LYS  10           1HG      LYS  10  10.364  14.927   5.051
   93    HD2  LYS  10           2HD      LYS  10   8.533  16.077   5.872
   94    HD3  LYS  10           1HD      LYS  10   7.662  14.599   6.285
   95    HE2  LYS  10           2HE      LYS  10   9.880  14.424   7.874
   96    HE3  LYS  10           1HE      LYS  10   9.580  16.162   7.853
   97    HZ1  LYS  10           3HZ      LYS  10   7.244  15.644   8.484
   98    HZ2  LYS  10           1HZ      LYS  10   8.385  15.229   9.663
   99    HZ3  LYS  10           2HZ      LYS  10   7.698  14.027   8.693
  100    H    GLY  11           H        GLY  11   7.703  11.966   2.959
  101    HA2  GLY  11           2HA      GLY  11   8.637  10.085   1.012
  102    HA3  GLY  11           1HA      GLY  11   8.757   9.451   2.644
  103    H    LEU  12           H        LEU  12   7.158   8.052   2.934
  104    HA   LEU  12           HA       LEU  12   4.575   8.465   1.670
  105    HG   LEU  12           HG       LEU  12   4.168   6.106   0.631
  106    HB2  LEU  12           2HB      LEU  12   5.897   6.203   3.096
  107    HB3  LEU  12           1HB      LEU  12   4.150   6.230   3.014
  108   HD11  LEU  12          1HD1      LEU  12   5.991   7.602   0.131
  109   HD12  LEU  12          2HD1      LEU  12   6.277   6.048  -0.653
  110   HD13  LEU  12          3HD1      LEU  12   7.154   6.470   0.818
  111   HD21  LEU  12          3HD2      LEU  12   6.352   4.220   1.436
  112   HD22  LEU  12          1HD2      LEU  12   5.006   3.955   0.327
  113   HD23  LEU  12          2HD2      LEU  12   4.713   4.047   2.063
  114    H    GLY  13           H        GLY  13   5.823   8.048   4.989
  115    HA2  GLY  13           2HA      GLY  13   5.085   9.067   6.935
  116    HA3  GLY  13           1HA      GLY  13   3.827   9.869   6.009
  117    H    PHE  14           H        PHE  14   4.425   6.392   6.146
  118    HA   PHE  14           HA       PHE  14   2.386   5.858   8.062
  119    HD1  PHE  14           2HD      PHE  14   2.160   3.116   5.066
  120    HD2  PHE  14           1HD      PHE  14   1.331   7.170   4.063
  121    HE1  PHE  14           2HE      PHE  14   2.577   2.612   2.698
  122    HE2  PHE  14           1HE      PHE  14   1.741   6.669   1.691
  123    HZ   PHE  14           HZ       PHE  14   2.365   4.389   1.006
  124    HB2  PHE  14           2HB      PHE  14   0.814   4.691   6.558
  125    HB3  PHE  14           1HB      PHE  14   0.903   6.413   6.221
  126    H    SER  15           H        SER  15   1.759   3.249   7.577
  127    HA   SER  15           HA       SER  15   4.304   1.898   7.112
  128    HG   SER  15           HG       SER  15   2.069   1.095  10.376
  129    HB2  SER  15           2HB      SER  15   3.506   0.333   9.014
  130    HB3  SER  15           1HB      SER  15   4.254   1.861   9.453
  131    H    ILE  16           H        ILE  16   3.799  -0.611   7.059
  132    HA   ILE  16           HA       ILE  16   1.177  -1.297   6.031
  133    HB   ILE  16           HB       ILE  16   1.711  -1.848   3.846
  134   HG12  ILE  16          2HG1      ILE  16   3.847  -3.019   4.376
  135   HG13  ILE  16          1HG1      ILE  16   3.872  -2.113   2.869
  136   HG21  ILE  16          1HG2      ILE  16   2.719   0.128   2.787
  137   HG22  ILE  16          2HG2      ILE  16   3.251   0.674   4.377
  138   HG23  ILE  16          3HG2      ILE  16   1.529   0.540   4.021
  139   HD11  ILE  16          3HD1      ILE  16   5.586  -0.909   3.545
  140   HD12  ILE  16          1HD1      ILE  16   5.708  -1.988   4.937
  141   HD13  ILE  16          2HD1      ILE  16   4.776  -0.492   5.054
  142    H    ALA  17           H        ALA  17   1.233  -3.601   5.185
  143    HA   ALA  17           HA       ALA  17   3.233  -5.307   6.475
  144    HB1  ALA  17           3HB      ALA  17   1.717  -5.822   8.063
  145    HB2  ALA  17           1HB      ALA  17   0.944  -6.773   6.796
  146    HB3  ALA  17           2HB      ALA  17   0.378  -5.136   7.144
  147    H    GLY  18           H        GLY  18   3.002  -7.644   5.440
  148    HA2  GLY  18           2HA      GLY  18   1.507  -8.145   3.203
  149    HA3  GLY  18           1HA      GLY  18   2.828  -7.182   2.588
  150    H    GLY  19           H        GLY  19   1.803 -10.249   2.618
  151    HA2  GLY  19           2HA      GLY  19   3.280 -11.870   1.633
  152    HA3  GLY  19           1HA      GLY  19   4.578 -11.229   2.624
  153    H    VAL  20           H        VAL  20   3.827 -13.963   2.391
  154    HA   VAL  20           HA       VAL  20   2.247 -14.830   4.566
  155    HB   VAL  20           HB       VAL  20   4.481 -16.334   3.177
  156   HG11  VAL  20          1HG1      VAL  20   2.265 -17.228   5.005
  157   HG12  VAL  20          2HG1      VAL  20   4.002 -17.480   5.184
  158   HG13  VAL  20          3HG1      VAL  20   3.112 -18.334   3.924
  159   HG21  VAL  20          3HG2      VAL  20   2.923 -15.722   1.509
  160   HG22  VAL  20          1HG2      VAL  20   1.549 -16.065   2.559
  161   HG23  VAL  20          2HG2      VAL  20   2.536 -17.388   1.940
  162    H    GLY  21           H        GLY  21   2.825 -15.502   6.653
  163    HA2  GLY  21           2HA      GLY  21   4.192 -15.799   8.527
  164    HA3  GLY  21           1HA      GLY  21   5.586 -15.390   7.540
  165    H    ASN  22           H        ASN  22   3.978 -12.910   6.696
  166    HA   ASN  22           HA       ASN  22   4.151 -11.298   9.126
  167    HB2  ASN  22           2HB      ASN  22   5.181  -9.510   7.413
  168    HB3  ASN  22           1HB      ASN  22   6.206 -10.591   8.340
  169   HD21  ASN  22          1HD2      ASN  22   4.425 -10.518   5.269
  170   HD22  ASN  22          2HD2      ASN  22   5.657 -11.307   4.352
  171    H    GLN  23           H        GLN  23   2.004 -12.421   7.318
  172    HA   GLN  23           HA       GLN  23   0.861 -10.462   5.707
  173    HB2  GLN  23           2HB      GLN  23   0.021 -13.003   6.932
  174    HB3  GLN  23           1HB      GLN  23  -1.293 -11.900   6.549
  175    HG2  GLN  23           2HG      GLN  23  -0.424 -11.766   4.230
  176    HG3  GLN  23           1HG      GLN  23   0.762 -13.000   4.650
  177   HE21  GLN  23          1HE2      GLN  23   0.062 -15.113   5.080
  178   HE22  GLN  23          2HE2      GLN  23  -1.488 -15.674   4.564
  179    H    HIS  24           H        HIS  24  -0.833  -9.058   5.960
  180    HA   HIS  24           HA       HIS  24  -1.122  -7.892   8.610
  181    HD1  HIS  24           1HD      HIS  24  -0.671  -5.123   8.847
  182    HD2  HIS  24           2HD      HIS  24  -4.335  -5.413   6.923
  183    HE1  HIS  24           1HE      HIS  24  -2.065  -3.279   9.791
  184    HE2  HIS  24           2HE      HIS  24  -4.235  -3.373   8.520
  185    HB2  HIS  24           2HB      HIS  24  -0.728  -6.501   6.542
  186    HB3  HIS  24           1HB      HIS  24  -2.333  -6.955   6.002
  187    H    ILE  25           H        ILE  25  -2.943  -9.840   6.389
  188    HA   ILE  25           HA       ILE  25  -5.092 -10.076   8.325
  189    HB   ILE  25           HB       ILE  25  -5.821  -9.403   5.475
  190   HG12  ILE  25          2HG1      ILE  25  -5.754  -7.533   7.856
  191   HG13  ILE  25          1HG1      ILE  25  -4.688  -7.455   6.457
  192   HG21  ILE  25          1HG2      ILE  25  -7.810  -8.756   7.404
  193   HG22  ILE  25          2HG2      ILE  25  -7.263 -10.407   7.689
  194   HG23  ILE  25          3HG2      ILE  25  -7.876  -9.944   6.103
  195   HD11  ILE  25          3HD1      ILE  25  -6.500  -5.793   6.400
  196   HD12  ILE  25          1HD1      ILE  25  -7.674  -7.109   6.359
  197   HD13  ILE  25          2HD1      ILE  25  -6.538  -6.900   5.026
  198    HA   PRO  26           HA       PRO  26  -4.526 -14.316   7.041
  199    HB2  PRO  26           2HB      PRO  26  -6.987 -15.208   7.987
  200    HB3  PRO  26           1HB      PRO  26  -5.499 -15.113   8.932
  201    HG2  PRO  26           2HG      PRO  26  -7.795 -13.212   8.812
  202    HG3  PRO  26           1HG      PRO  26  -6.810 -13.699  10.203
  203    HD2  PRO  26           2HD      PRO  26  -6.460 -11.332   9.007
  204    HD3  PRO  26           1HD      PRO  26  -5.083 -12.254   9.645
  205    H    GLY  27           H        GLY  27  -4.832 -15.150   5.080
  206    HA2  GLY  27           2HA      GLY  27  -6.323 -16.063   3.413
  207    HA3  GLY  27           1HA      GLY  27  -7.432 -14.740   3.747
  208    H    ASP  28           H        ASP  28  -6.125 -12.491   3.497
  209    HA   ASP  28           HA       ASP  28  -5.225 -12.512   0.718
  210    HB2  ASP  28           2HB      ASP  28  -6.825 -10.752   2.275
  211    HB3  ASP  28           1HB      ASP  28  -5.385  -9.863   1.794
  212    H    ASN  29           H        ASN  29  -3.119 -12.691   0.381
  213    HA   ASN  29           HA       ASN  29  -1.197 -11.844   2.388
  214    HB2  ASN  29           2HB      ASN  29  -0.318 -12.841  -0.281
  215    HB3  ASN  29           1HB      ASN  29   0.368 -13.139   1.313
  216   HD21  ASN  29          1HD2      ASN  29  -1.824 -14.219  -1.096
  217   HD22  ASN  29          2HD2      ASN  29  -2.340 -15.659  -0.293
  218    H    SER  30           H        SER  30  -2.837  -9.928   0.536
  219    HA   SER  30           HA       SER  30  -0.765  -8.545  -0.929
  220    HG   SER  30           HG       SER  30  -3.195  -9.535  -1.983
  221    HB2  SER  30           2HB      SER  30  -3.349  -7.178  -0.409
  222    HB3  SER  30           1HB      SER  30  -2.448  -7.349  -1.913
  223    H    ILE  31           H        ILE  31  -0.113  -6.328  -0.480
  224    HA   ILE  31           HA       ILE  31   0.438  -5.953   2.271
  225    HB   ILE  31           HB       ILE  31   1.042  -4.395  -0.215
  226   HG12  ILE  31          2HG1      ILE  31   3.333  -4.822   0.390
  227   HG13  ILE  31          1HG1      ILE  31   2.848  -5.489   1.943
  228   HG21  ILE  31          1HG2      ILE  31   1.408  -3.406   2.601
  229   HG22  ILE  31          2HG2      ILE  31   0.595  -2.603   1.258
  230   HG23  ILE  31          3HG2      ILE  31   2.348  -2.797   1.238
  231   HD11  ILE  31          3HD1      ILE  31   3.363  -7.340   0.633
  232   HD12  ILE  31          1HD1      ILE  31   2.561  -6.674  -0.787
  233   HD13  ILE  31          2HD1      ILE  31   1.604  -7.256   0.575
  234    H    TYR  32           H        TYR  32  -0.615  -4.879   3.803
  235    HA   TYR  32           HA       TYR  32  -2.689  -2.928   3.039
  236    HD1  TYR  32           2HD      TYR  32  -2.623  -6.568   3.428
  237    HD2  TYR  32           1HD      TYR  32  -5.783  -3.834   4.150
  238    HE1  TYR  32           2HE      TYR  32  -4.137  -8.003   2.132
  239    HE2  TYR  32           1HE      TYR  32  -7.324  -5.249   2.876
  240    HH   TYR  32           HH       TYR  32  -6.378  -7.586   0.801
  241    HB2  TYR  32           2HB      TYR  32  -2.616  -4.873   5.346
  242    HB3  TYR  32           1HB      TYR  32  -3.760  -3.541   5.248
  243    H    VAL  33           H        VAL  33  -2.851  -1.041   4.291
  244    HA   VAL  33           HA       VAL  33  -0.415  -0.165   5.529
  245    HB   VAL  33           HB       VAL  33  -3.082   1.177   5.098
  246   HG11  VAL  33          1HG1      VAL  33  -1.802   3.267   5.886
  247   HG12  VAL  33          2HG1      VAL  33  -0.728   2.128   6.697
  248   HG13  VAL  33          3HG1      VAL  33  -2.441   2.172   7.110
  249   HG21  VAL  33          3HG2      VAL  33  -2.080   1.438   3.101
  250   HG22  VAL  33          1HG2      VAL  33  -0.472   1.119   3.750
  251   HG23  VAL  33          2HG2      VAL  33  -1.189   2.720   3.922
  252    H    THR  34           H        THR  34   0.072  -0.135   7.644
  253    HA   THR  34           HA       THR  34  -1.931  -1.199   9.500
  254    HB   THR  34           HB       THR  34  -0.142  -1.952  10.861
  255    HG1  THR  34           1HG      THR  34   1.700  -0.568   9.222
  256   HG21  THR  34          3HG2      THR  34  -0.240  -2.698   8.154
  257   HG22  THR  34          1HG2      THR  34   0.394  -3.617   9.518
  258   HG23  THR  34          2HG2      THR  34   1.463  -2.569   8.589
  259    H    LYS  35           H        LYS  35   0.091   1.652   9.041
  260    HA   LYS  35           HA       LYS  35  -1.463   3.091  11.006
  261    HB2  LYS  35           2HB      LYS  35   1.412   2.379  11.517
  262    HB3  LYS  35           1HB      LYS  35   0.741   3.870  12.153
  263    HG2  LYS  35           2HG      LYS  35  -0.288   1.100  12.734
  264    HG3  LYS  35           1HG      LYS  35   0.715   2.078  13.803
  265    HD2  LYS  35           2HD      LYS  35  -1.032   3.753  13.965
  266    HD3  LYS  35           1HD      LYS  35  -2.028   2.861  12.814
  267    HE2  LYS  35           2HE      LYS  35  -1.086   1.487  15.288
  268    HE3  LYS  35           1HE      LYS  35  -2.419   2.635  15.402
  269    HZ1  LYS  35           3HZ      LYS  35  -3.225   0.390  15.063
  270    HZ2  LYS  35           1HZ      LYS  35  -2.335   0.251  13.631
  271    HZ3  LYS  35           2HZ      LYS  35  -3.613   1.356  13.730
  272    H    ILE  36           H        ILE  36  -1.816   5.050  10.153
  273    HA   ILE  36           HA       ILE  36   0.118   6.098   8.217
  274    HB   ILE  36           HB       ILE  36  -2.720   6.978   8.766
  275   HG12  ILE  36          2HG1      ILE  36  -1.447   5.262   6.637
  276   HG13  ILE  36          1HG1      ILE  36  -2.810   4.874   7.680
  277   HG21  ILE  36          1HG2      ILE  36  -2.502   8.423   6.847
  278   HG22  ILE  36          2HG2      ILE  36  -0.855   7.860   6.564
  279   HG23  ILE  36          3HG2      ILE  36  -1.229   8.807   8.005
  280   HD11  ILE  36          3HD1      ILE  36  -2.742   6.685   5.296
  281   HD12  ILE  36          1HD1      ILE  36  -4.057   6.725   6.471
  282   HD13  ILE  36          2HD1      ILE  36  -3.726   5.248   5.566
  283    H    ILE  37           H        ILE  37   1.514   7.623   8.838
  284    HA   ILE  37           HA       ILE  37   1.356   8.874  11.406
  285    HB   ILE  37           HB       ILE  37   3.265   9.118   9.090
  286   HG12  ILE  37          2HG1      ILE  37   4.841   8.387  11.018
  287   HG13  ILE  37          1HG1      ILE  37   3.355   7.956  11.858
  288   HG21  ILE  37          1HG2      ILE  37   3.148  10.827  11.552
  289   HG22  ILE  37          2HG2      ILE  37   3.306  11.321   9.866
  290   HG23  ILE  37          3HG2      ILE  37   4.657  10.540  10.686
  291   HD11  ILE  37          3HD1      ILE  37   4.036   6.918   9.126
  292   HD12  ILE  37          1HD1      ILE  37   2.812   6.324  10.247
  293   HD13  ILE  37          2HD1      ILE  37   4.522   6.106  10.614
  294    H    GLU  38           H        GLU  38   0.998  11.054  11.897
  295    HA   GLU  38           HA       GLU  38  -0.922  12.414  10.358
  296    HB2  GLU  38           2HB      GLU  38   0.712  13.093  12.756
  297    HB3  GLU  38           1HB      GLU  38  -0.048  14.419  11.889
  298    HG2  GLU  38           2HG      GLU  38  -2.074  12.562  12.126
  299    HG3  GLU  38           1HG      GLU  38  -1.214  12.444  13.661
  300    H    GLY  39           H        GLY  39  -0.812  14.307   9.126
  301    HA2  GLY  39           2HA      GLY  39   0.043  15.688   7.518
  302    HA3  GLY  39           1HA      GLY  39   1.471  15.790   8.534
  303    H    GLY  40           H        GLY  40   0.638  12.625   7.416
  304    HA2  GLY  40           2HA      GLY  40   3.040  12.591   5.772
  305    HA3  GLY  40           1HA      GLY  40   2.089  11.197   6.258
  306    H    ALA  41           H        ALA  41   2.950  11.246   3.730
  307    HA   ALA  41           HA       ALA  41   1.573  12.521   1.739
  308    HB1  ALA  41           3HB      ALA  41   2.361  10.917   0.276
  309    HB2  ALA  41           1HB      ALA  41   2.175   9.608   1.444
  310    HB3  ALA  41           2HB      ALA  41   3.485  10.776   1.626
  311    H    ALA  42           H        ALA  42   0.623   9.364   3.155
  312    HA   ALA  42           HA       ALA  42  -1.832   9.229   1.732
  313    HB1  ALA  42           3HB      ALA  42  -0.904   7.187   2.492
  314    HB2  ALA  42           1HB      ALA  42  -2.383   7.434   3.420
  315    HB3  ALA  42           2HB      ALA  42  -0.814   7.764   4.156
  316    H    HIS  43           H        HIS  43  -1.080  10.042   5.119
  317    HA   HIS  43           HA       HIS  43  -3.600  10.531   6.098
  318    HD1  HIS  43           1HD      HIS  43  -2.496  14.153   7.626
  319    HD2  HIS  43           2HD      HIS  43  -3.412  10.522   9.429
  320    HE1  HIS  43           1HE      HIS  43  -3.809  14.739   9.685
  321    HE2  HIS  43           2HE      HIS  43  -4.307  12.532  10.792
  322    HB2  HIS  43           2HB      HIS  43  -1.478  10.568   7.406
  323    HB3  HIS  43           1HB      HIS  43  -1.129  12.153   6.732
  324    H    LYS  44           H        LYS  44  -1.494  12.840   4.389
  325    HA   LYS  44           HA       LYS  44  -3.374  14.989   4.516
  326    HB2  LYS  44           2HB      LYS  44  -0.850  14.545   2.930
  327    HB3  LYS  44           1HB      LYS  44  -1.829  15.993   2.742
  328    HG2  LYS  44           2HG      LYS  44  -1.473  16.605   5.033
  329    HG3  LYS  44           1HG      LYS  44  -0.650  15.078   5.355
  330    HD2  LYS  44           2HD      LYS  44   1.238  15.694   4.151
  331    HD3  LYS  44           1HD      LYS  44   0.370  16.926   3.231
  332    HE2  LYS  44           2HE      LYS  44   0.389  18.437   5.008
  333    HE3  LYS  44           1HE      LYS  44   0.712  17.178   6.198
  334    HZ1  LYS  44           3HZ      LYS  44   2.670  18.524   5.797
  335    HZ2  LYS  44           1HZ      LYS  44   2.626  18.154   4.146
  336    HZ3  LYS  44           2HZ      LYS  44   2.937  16.936   5.278
  337    H    ASP  45           H        ASP  45  -2.587  12.521   2.110
  338    HA   ASP  45           HA       ASP  45  -4.053  13.588  -0.043
  339    HB2  ASP  45           2HB      ASP  45  -2.388  11.788  -0.297
  340    HB3  ASP  45           1HB      ASP  45  -3.438  10.689   0.589
  341    H    GLY  46           H        GLY  46  -4.960  11.027   2.272
  342    HA2  GLY  46           2HA      GLY  46  -7.085  10.885   3.329
  343    HA3  GLY  46           1HA      GLY  46  -7.754  11.902   2.067
  344    H    LYS  47           H        LYS  47  -6.495  10.270  -0.076
  345    HA   LYS  47           HA       LYS  47  -8.630   8.497  -0.548
  346    HB2  LYS  47           2HB      LYS  47  -6.569   9.544  -2.054
  347    HB3  LYS  47           1HB      LYS  47  -6.166   7.835  -1.982
  348    HG2  LYS  47           2HG      LYS  47  -8.224   7.217  -2.981
  349    HG3  LYS  47           1HG      LYS  47  -8.875   8.847  -2.802
  350    HD2  LYS  47           2HD      LYS  47  -6.390   8.390  -4.403
  351    HD3  LYS  47           1HD      LYS  47  -7.972   8.066  -5.114
  352    HE2  LYS  47           2HE      LYS  47  -7.988  10.233  -5.665
  353    HE3  LYS  47           1HE      LYS  47  -8.318  10.536  -3.960
  354    HZ1  LYS  47           3HZ      LYS  47  -5.626  10.480  -5.216
  355    HZ2  LYS  47           1HZ      LYS  47  -5.942  10.774  -3.581
  356    HZ3  LYS  47           2HZ      LYS  47  -6.471  11.869  -4.756
  357    H    LEU  48           H        LEU  48  -5.368   7.976   0.722
  358    HA   LEU  48           HA       LEU  48  -5.843   5.117   0.976
  359    HG   LEU  48           HG       LEU  48  -3.954   3.798   0.883
  360    HB2  LEU  48           2HB      LEU  48  -3.607   6.319   0.339
  361    HB3  LEU  48           1HB      LEU  48  -3.430   6.504   2.073
  362   HD11  LEU  48          1HD1      LEU  48  -2.069   4.413  -0.361
  363   HD12  LEU  48          2HD1      LEU  48  -1.421   3.525   1.017
  364   HD13  LEU  48          3HD1      LEU  48  -1.349   5.287   0.991
  365   HD21  LEU  48          3HD2      LEU  48  -3.406   2.989   2.911
  366   HD22  LEU  48          1HD2      LEU  48  -3.895   4.597   3.442
  367   HD23  LEU  48          2HD2      LEU  48  -2.187   4.230   3.205
  368    H    GLN  49           H        GLN  49  -6.709   4.236   2.704
  369    HA   GLN  49           HA       GLN  49  -6.422   5.540   5.317
  370    HB2  GLN  49           2HB      GLN  49  -8.718   4.984   5.869
  371    HB3  GLN  49           1HB      GLN  49  -8.679   5.981   4.425
  372    HG2  GLN  49           2HG      GLN  49  -8.808   2.999   4.214
  373    HG3  GLN  49           1HG      GLN  49 -10.261   3.945   4.526
  374   HE21  GLN  49          1HE2      GLN  49  -8.198   2.732   2.171
  375   HE22  GLN  49          2HE2      GLN  49  -8.798   3.625   0.820
  376    H    ILE  50           H        ILE  50  -6.156   4.150   7.073
  377    HA   ILE  50           HA       ILE  50  -4.828   1.777   6.745
  378    HB   ILE  50           HB       ILE  50  -5.630   1.179   9.096
  379   HG12  ILE  50          2HG1      ILE  50  -6.588   3.984   9.366
  380   HG13  ILE  50          1HG1      ILE  50  -7.696   2.830   8.632
  381   HG21  ILE  50          1HG2      ILE  50  -3.515   2.275   8.678
  382   HG22  ILE  50          2HG2      ILE  50  -4.268   2.951  10.122
  383   HG23  ILE  50          3HG2      ILE  50  -4.313   3.845   8.603
  384   HD11  ILE  50          3HD1      ILE  50  -7.004   1.400  10.753
  385   HD12  ILE  50          1HD1      ILE  50  -8.304   2.590  10.797
  386   HD13  ILE  50          2HD1      ILE  50  -6.706   3.008  11.412
  387    H    GLY  51           H        GLY  51  -5.357  -0.180   6.004
  388    HA2  GLY  51           2HA      GLY  51  -6.859  -2.121   6.370
  389    HA3  GLY  51           1HA      GLY  51  -8.192  -1.009   6.132
  390    H    ASP  52           H        ASP  52  -6.493   0.309   3.891
  391    HA   ASP  52           HA       ASP  52  -7.658  -1.148   1.784
  392    HB2  ASP  52           2HB      ASP  52  -6.126   0.346   0.342
  393    HB3  ASP  52           1HB      ASP  52  -7.377   1.111   1.309
  394    H    LYS  53           H        LYS  53  -6.609  -2.250   0.041
  395    HA   LYS  53           HA       LYS  53  -4.188  -3.665   0.925
  396    HB2  LYS  53           2HB      LYS  53  -4.891  -5.430  -0.715
  397    HB3  LYS  53           1HB      LYS  53  -5.983  -5.205   0.640
  398    HG2  LYS  53           2HG      LYS  53  -6.660  -3.600  -1.702
  399    HG3  LYS  53           1HG      LYS  53  -6.722  -5.340  -1.974
  400    HD2  LYS  53           2HD      LYS  53  -7.994  -4.177   0.468
  401    HD3  LYS  53           1HD      LYS  53  -8.825  -4.062  -1.084
  402    HE2  LYS  53           2HE      LYS  53  -7.965  -6.557   0.363
  403    HE3  LYS  53           1HE      LYS  53  -9.608  -6.027   0.026
  404    HZ1  LYS  53           3HZ      LYS  53  -9.255  -7.597  -1.593
  405    HZ2  LYS  53           1HZ      LYS  53  -7.625  -7.200  -1.803
  406    HZ3  LYS  53           2HZ      LYS  53  -8.829  -6.189  -2.425
  407    H    LEU  54           H        LEU  54  -2.538  -4.060  -0.495
  408    HA   LEU  54           HA       LEU  54  -2.363  -2.136  -2.706
  409    HG   LEU  54           HG       LEU  54  -1.105  -0.592  -1.754
  410    HB2  LEU  54           2HB      LEU  54  -0.524  -2.963  -0.659
  411    HB3  LEU  54           1HB      LEU  54   0.185  -3.224  -2.240
  412   HD11  LEU  54          1HD1      LEU  54   1.022   0.246  -0.752
  413   HD12  LEU  54          2HD1      LEU  54   1.504  -1.433  -0.511
  414   HD13  LEU  54          3HD1      LEU  54   0.074  -0.799   0.304
  415   HD21  LEU  54          3HD2      LEU  54   1.284  -1.615  -3.265
  416   HD22  LEU  54          1HD2      LEU  54   0.957   0.106  -3.050
  417   HD23  LEU  54          2HD2      LEU  54  -0.201  -0.913  -3.907
  418    H    LEU  55           H        LEU  55  -3.032  -3.034  -4.522
  419    HA   LEU  55           HA       LEU  55  -2.570  -5.773  -5.217
  420    HG   LEU  55           HG       LEU  55  -2.699  -5.438  -8.226
  421    HB2  LEU  55           2HB      LEU  55  -4.548  -4.571  -6.013
  422    HB3  LEU  55           1HB      LEU  55  -3.531  -3.437  -6.880
  423   HD11  LEU  55          1HD1      LEU  55  -3.840  -7.451  -8.190
  424   HD12  LEU  55          2HD1      LEU  55  -5.242  -6.760  -7.373
  425   HD13  LEU  55          3HD1      LEU  55  -3.747  -7.036  -6.478
  426   HD21  LEU  55          3HD2      LEU  55  -4.974  -5.503  -9.501
  427   HD22  LEU  55          1HD2      LEU  55  -4.046  -4.006  -9.421
  428   HD23  LEU  55          2HD2      LEU  55  -5.430  -4.242  -8.355
  429    H    ALA  56           H        ALA  56  -1.361  -2.641  -6.474
  430    HA   ALA  56           HA       ALA  56   1.232  -3.874  -6.984
  431    HB1  ALA  56           3HB      ALA  56   1.245  -3.059  -9.376
  432    HB2  ALA  56           1HB      ALA  56  -0.490  -2.785  -9.220
  433    HB3  ALA  56           2HB      ALA  56   0.159  -4.417  -9.065
  434    H    VAL  57           H        VAL  57   2.938  -2.315  -7.252
  435    HA   VAL  57           HA       VAL  57   2.162   0.501  -7.054
  436    HB   VAL  57           HB       VAL  57   2.438  -0.262  -4.731
  437   HG11  VAL  57          1HG1      VAL  57   4.240  -1.981  -5.443
  438   HG12  VAL  57          2HG1      VAL  57   4.367  -1.199  -3.868
  439   HG13  VAL  57          3HG1      VAL  57   5.362  -0.641  -5.212
  440   HG21  VAL  57          3HG2      VAL  57   4.686   1.566  -5.561
  441   HG22  VAL  57          1HG2      VAL  57   3.869   1.518  -3.999
  442   HG23  VAL  57          2HG2      VAL  57   2.998   2.058  -5.434
  443    H    ASN  58           H        ASN  58   3.290   1.678  -8.455
  444    HA   ASN  58           HA       ASN  58   4.938   2.410  -9.840
  445    HB2  ASN  58           2HB      ASN  58   6.283   1.573  -7.555
  446    HB3  ASN  58           1HB      ASN  58   7.146   0.771  -8.864
  447   HD21  ASN  58          1HD2      ASN  58   6.544   3.716  -7.245
  448   HD22  ASN  58          2HD2      ASN  58   7.549   4.723  -8.224
  449    H    ASN  59           H        ASN  59   3.354   0.100 -10.500
  450    HA   ASN  59           HA       ASN  59   3.166  -1.129 -12.441
  451    HB2  ASN  59           2HB      ASN  59   5.355   0.192 -13.133
  452    HB3  ASN  59           1HB      ASN  59   6.110  -1.375 -12.856
  453   HD21  ASN  59          1HD2      ASN  59   3.922   0.451 -14.832
  454   HD22  ASN  59          2HD2      ASN  59   3.768  -0.717 -16.096
  455    H    VAL  60           H        VAL  60   5.194  -1.937  -9.759
  456    HA   VAL  60           HA       VAL  60   5.306  -4.760 -10.477
  457    HB   VAL  60           HB       VAL  60   6.524  -5.097  -8.397
  458   HG11  VAL  60          1HG1      VAL  60   8.380  -3.263  -8.881
  459   HG12  VAL  60          2HG1      VAL  60   7.408  -3.035 -10.335
  460   HG13  VAL  60          3HG1      VAL  60   8.094  -4.619  -9.973
  461   HG21  VAL  60          3HG2      VAL  60   5.201  -2.973  -7.394
  462   HG22  VAL  60          1HG2      VAL  60   6.771  -2.247  -7.736
  463   HG23  VAL  60          2HG2      VAL  60   6.661  -3.656  -6.682
  464    H    CYS  61           H        CYS  61   4.325  -6.432  -9.226
  465    HA   CYS  61           HA       CYS  61   1.806  -5.601  -8.039
  466    HG   CYS  61           HG       CYS  61   3.217  -9.390  -7.612
  467    HB2  CYS  61           2HB      CYS  61   1.196  -7.942  -8.059
  468    HB3  CYS  61           1HB      CYS  61   1.845  -7.489  -9.628
  469    H    LEU  62           H        LEU  62   1.370  -5.539  -5.928
  470    HA   LEU  62           HA       LEU  62   3.470  -6.394  -4.074
  471    HG   LEU  62           HG       LEU  62   3.500  -5.161  -1.866
  472    HB2  LEU  62           2HB      LEU  62   2.175  -3.995  -4.311
  473    HB3  LEU  62           1HB      LEU  62   1.274  -4.763  -3.021
  474   HD11  LEU  62          1HD1      LEU  62   5.041  -4.930  -3.647
  475   HD12  LEU  62          2HD1      LEU  62   5.293  -3.543  -2.587
  476   HD13  LEU  62          3HD1      LEU  62   4.395  -3.349  -4.093
  477   HD21  LEU  62          3HD2      LEU  62   1.832  -3.293  -1.402
  478   HD22  LEU  62          1HD2      LEU  62   2.927  -2.249  -2.307
  479   HD23  LEU  62          2HD2      LEU  62   3.485  -3.053  -0.841
  480    H    GLU  63           H        GLU  63   1.460  -8.223  -5.266
  481    HA   GLU  63           HA       GLU  63  -0.009  -8.999  -2.834
  482    HB2  GLU  63           2HB      GLU  63  -1.332  -8.439  -4.903
  483    HB3  GLU  63           1HB      GLU  63  -0.615  -9.852  -5.664
  484    HG2  GLU  63           2HG      GLU  63  -1.723 -10.582  -3.127
  485    HG3  GLU  63           1HG      GLU  63  -2.928  -9.722  -4.083
  486    H    GLU  64           H        GLU  64   2.467 -10.018  -5.031
  487    HA   GLU  64           HA       GLU  64   2.480 -12.666  -3.744
  488    HB2  GLU  64           2HB      GLU  64   2.248 -12.057  -6.489
  489    HB3  GLU  64           1HB      GLU  64   3.851 -12.728  -6.250
  490    HG2  GLU  64           2HG      GLU  64   1.890 -14.270  -4.822
  491    HG3  GLU  64           1HG      GLU  64   1.454 -14.116  -6.523
  492    H    VAL  65           H        VAL  65   3.805 -10.774  -2.421
  493    HA   VAL  65           HA       VAL  65   6.586 -11.579  -2.786
  494    HB   VAL  65           HB       VAL  65   7.389  -9.226  -2.475
  495   HG11  VAL  65          1HG1      VAL  65   7.347 -10.457  -4.663
  496   HG12  VAL  65          2HG1      VAL  65   7.334  -8.698  -4.794
  497   HG13  VAL  65          3HG1      VAL  65   5.844  -9.611  -5.032
  498   HG21  VAL  65          3HG2      VAL  65   5.836  -7.416  -3.191
  499   HG22  VAL  65          1HG2      VAL  65   5.401  -8.163  -1.654
  500   HG23  VAL  65          2HG2      VAL  65   4.514  -8.580  -3.121
  501    H    THR  66           H        THR  66   7.925 -11.289  -0.987
  502    HA   THR  66           HA       THR  66   6.664 -11.613   1.539
  503    HB   THR  66           HB       THR  66   9.547 -10.827   1.353
  504    HG1  THR  66           1HG      THR  66   9.884 -12.286  -0.101
  505   HG21  THR  66          3HG2      THR  66   9.201 -11.500   3.488
  506   HG22  THR  66          1HG2      THR  66   9.577 -13.062   2.762
  507   HG23  THR  66          2HG2      THR  66   7.899 -12.605   3.051
  508    H    HIS  67           H        HIS  67   7.313 -10.206   3.476
  509    HA   HIS  67           HA       HIS  67   6.268  -7.652   3.104
  510    HD1  HIS  67           1HD      HIS  67   4.813  -6.989   6.149
  511    HD2  HIS  67           2HD      HIS  67   8.619  -5.522   5.381
  512    HE1  HIS  67           1HE      HIS  67   4.765  -4.578   6.845
  513    HE2  HIS  67           2HE      HIS  67   7.029  -3.686   6.248
  514    HB2  HIS  67           2HB      HIS  67   6.325  -8.751   5.319
  515    HB3  HIS  67           1HB      HIS  67   8.053  -8.439   5.422
  516    H    GLU  68           H        GLU  68   9.670  -8.661   3.104
  517    HA   GLU  68           HA       GLU  68  10.925  -6.215   3.151
  518    HB2  GLU  68           2HB      GLU  68  12.704  -7.254   1.744
  519    HB3  GLU  68           1HB      GLU  68  12.221  -8.245   3.113
  520    HG2  GLU  68           2HG      GLU  68  10.591  -9.268   1.267
  521    HG3  GLU  68           1HG      GLU  68  11.888  -8.710   0.215
  522    H    GLU  69           H        GLU  69   9.601  -7.870   0.295
  523    HA   GLU  69           HA       GLU  69  10.204  -5.836  -1.576
  524    HB2  GLU  69           2HB      GLU  69   8.311  -8.156  -1.540
  525    HB3  GLU  69           1HB      GLU  69   8.207  -6.975  -2.837
  526    HG2  GLU  69           2HG      GLU  69   9.606  -8.512  -3.776
  527    HG3  GLU  69           1HG      GLU  69  10.776  -7.417  -3.043
  528    H    ALA  70           H        ALA  70   7.479  -6.374   0.574
  529    HA   ALA  70           HA       ALA  70   5.606  -4.570  -0.474
  530    HB1  ALA  70           3HB      ALA  70   4.928  -6.106   1.211
  531    HB2  ALA  70           1HB      ALA  70   4.769  -4.491   1.903
  532    HB3  ALA  70           2HB      ALA  70   6.137  -5.505   2.340
  533    H    VAL  71           H        VAL  71   8.256  -4.118   1.820
  534    HA   VAL  71           HA       VAL  71   7.697  -1.313   2.200
  535    HB   VAL  71           HB       VAL  71   9.914  -3.119   3.159
  536   HG11  VAL  71          1HG1      VAL  71  10.317  -0.909   4.631
  537   HG12  VAL  71          2HG1      VAL  71   9.834  -0.168   3.106
  538   HG13  VAL  71          3HG1      VAL  71  11.211  -1.269   3.154
  539   HG21  VAL  71          3HG2      VAL  71   8.890  -3.047   5.222
  540   HG22  VAL  71          1HG2      VAL  71   7.504  -3.021   4.134
  541   HG23  VAL  71          2HG2      VAL  71   8.067  -1.526   4.879
  542    H    THR  72           H        THR  72   9.928  -3.272   0.310
  543    HA   THR  72           HA       THR  72  11.672  -1.219  -0.487
  544    HB   THR  72           HB       THR  72  10.966  -3.818  -1.855
  545    HG1  THR  72           1HG      THR  72  12.129  -4.580  -0.299
  546   HG21  THR  72          3HG2      THR  72  13.239  -1.921  -2.387
  547   HG22  THR  72          1HG2      THR  72  11.999  -2.460  -3.520
  548   HG23  THR  72          2HG2      THR  72  13.207  -3.600  -2.925
  549    H    ALA  73           H        ALA  73   8.595  -2.335  -1.815
  550    HA   ALA  73           HA       ALA  73   8.800  -0.721  -4.180
  551    HB1  ALA  73           3HB      ALA  73   7.491  -2.966  -3.747
  552    HB2  ALA  73           1HB      ALA  73   6.896  -1.761  -4.889
  553    HB3  ALA  73           2HB      ALA  73   6.206  -1.856  -3.269
  554    H    LEU  74           H        LEU  74   7.262  -0.467  -0.996
  555    HA   LEU  74           HA       LEU  74   5.669   1.818  -1.618
  556    HG   LEU  74           HG       LEU  74   4.388  -0.046   1.320
  557    HB2  LEU  74           2HB      LEU  74   6.577   0.448   0.883
  558    HB3  LEU  74           1HB      LEU  74   5.876   2.048   0.997
  559   HD11  LEU  74          1HD1      LEU  74   2.487   1.191   0.708
  560   HD12  LEU  74          2HD1      LEU  74   3.353   2.041  -0.572
  561   HD13  LEU  74          3HD1      LEU  74   3.713   2.392   1.117
  562   HD21  LEU  74          3HD2      LEU  74   5.222  -0.953  -0.941
  563   HD22  LEU  74          1HD2      LEU  74   4.057   0.165  -1.644
  564   HD23  LEU  74          2HD2      LEU  74   3.513  -1.101  -0.547
  565    H    LYS  75           H        LYS  75   8.930   1.256  -0.529
  566    HA   LYS  75           HA       LYS  75   9.367   4.114  -0.063
  567    HB2  LYS  75           2HB      LYS  75  11.479   3.570   0.874
  568    HB3  LYS  75           1HB      LYS  75  10.307   2.428   1.508
  569    HG2  LYS  75           2HG      LYS  75  11.122   0.836  -0.304
  570    HG3  LYS  75           1HG      LYS  75  12.471   1.957  -0.512
  571    HD2  LYS  75           2HD      LYS  75  13.143   1.671   1.774
  572    HD3  LYS  75           1HD      LYS  75  11.697   0.726   2.130
  573    HE2  LYS  75           2HE      LYS  75  12.661  -1.152   1.440
  574    HE3  LYS  75           1HE      LYS  75  13.161  -0.411  -0.081
  575    HZ1  LYS  75           3HZ      LYS  75  14.615  -0.207   2.504
  576    HZ2  LYS  75           1HZ      LYS  75  15.096   0.506   1.045
  577    HZ3  LYS  75           2HZ      LYS  75  15.062  -1.179   1.194
  578    H    ASN  76           H        ASN  76   9.686   1.932  -2.657
  579    HA   ASN  76           HA       ASN  76  11.891   3.268  -3.948
  580    HB2  ASN  76           2HB      ASN  76  11.409   0.862  -4.322
  581    HB3  ASN  76           1HB      ASN  76   9.900   1.304  -5.113
  582   HD21  ASN  76          1HD2      ASN  76   9.970   1.430  -7.241
  583   HD22  ASN  76          2HD2      ASN  76  11.383   1.700  -8.197
  584    H    THR  77           H        THR  77  10.654   5.391  -3.534
  585    HA   THR  77           HA       THR  77   9.052   6.017  -5.928
  586    HB   THR  77           HB       THR  77   7.939   7.782  -4.509
  587    HG1  THR  77           1HG      THR  77   9.117   8.026  -2.734
  588   HG21  THR  77          3HG2      THR  77   6.303   6.394  -3.626
  589   HG22  THR  77          1HG2      THR  77   7.447   5.090  -3.301
  590   HG23  THR  77          2HG2      THR  77   6.975   5.457  -4.960
  591    H    SER  78           H        SER  78   9.727   7.665  -7.151
  592    HA   SER  78           HA       SER  78  11.976   9.286  -6.153
  593    HG   SER  78           HG       SER  78  13.879   8.367  -8.095
  594    HB2  SER  78           2HB      SER  78  11.276   8.305  -8.913
  595    HB3  SER  78           1HB      SER  78  12.352   9.683  -8.685
  596    H    ASP  79           H        ASP  79   9.830   9.856  -8.927
  597    HA   ASP  79           HA       ASP  79   9.287  12.535  -7.873
  598    HB2  ASP  79           2HB      ASP  79   8.835  11.376 -10.635
  599    HB3  ASP  79           1HB      ASP  79   8.496  13.039 -10.169
  600    H    PHE  80           H        PHE  80   7.548   9.820  -9.394
  601    HA   PHE  80           HA       PHE  80   5.180  10.548  -7.808
  602    HD1  PHE  80           1HD      PHE  80   4.804  12.943  -9.928
  603    HD2  PHE  80           2HD      PHE  80   2.188   9.641  -9.310
  604    HE1  PHE  80           1HE      PHE  80   2.946  14.498  -9.514
  605    HE2  PHE  80           2HE      PHE  80   0.326  11.195  -8.896
  606    HZ   PHE  80           HZ       PHE  80   0.708  13.625  -8.991
  607    HB2  PHE  80           2HB      PHE  80   5.400  10.673 -10.639
  608    HB3  PHE  80           1HB      PHE  80   4.350   9.312 -10.253
  609    H    VAL  81           H        VAL  81   3.551   8.665  -7.746
  610    HA   VAL  81           HA       VAL  81   4.821   6.060  -7.981
  611    HB   VAL  81           HB       VAL  81   5.262   6.806  -5.653
  612   HG11  VAL  81          1HG1      VAL  81   2.426   6.472  -4.886
  613   HG12  VAL  81          2HG1      VAL  81   2.868   7.988  -5.668
  614   HG13  VAL  81          3HG1      VAL  81   3.682   7.492  -4.185
  615   HG21  VAL  81          3HG2      VAL  81   3.478   4.447  -6.155
  616   HG22  VAL  81          1HG2      VAL  81   4.140   4.779  -4.555
  617   HG23  VAL  81          2HG2      VAL  81   5.225   4.487  -5.914
  618    H    TYR  82           H        TYR  82   3.456   4.740  -8.995
  619    HA   TYR  82           HA       TYR  82   0.617   5.454  -9.093
  620    HD1  TYR  82           1HD      TYR  82   0.106   1.888 -10.660
  621    HD2  TYR  82           2HD      TYR  82  -0.142   5.888 -12.080
  622    HE1  TYR  82           1HE      TYR  82  -2.030   1.364 -11.738
  623    HE2  TYR  82           2HE      TYR  82  -2.288   5.375 -13.163
  624    HH   TYR  82           HH       TYR  82  -4.095   2.663 -12.483
  625    HB2  TYR  82           2HB      TYR  82   1.930   5.022 -11.196
  626    HB3  TYR  82           1HB      TYR  82   2.061   3.342 -10.689
  627    H    LEU  83           H        LEU  83  -0.283   4.712  -7.274
  628    HA   LEU  83           HA       LEU  83   0.256   2.034  -6.312
  629    HG   LEU  83           HG       LEU  83  -0.354   1.540  -4.164
  630    HB2  LEU  83           2HB      LEU  83  -0.056   4.135  -4.873
  631    HB3  LEU  83           1HB      LEU  83  -1.772   3.932  -5.171
  632   HD11  LEU  83          1HD1      LEU  83  -0.926   3.871  -2.341
  633   HD12  LEU  83          2HD1      LEU  83   0.684   3.384  -2.873
  634   HD13  LEU  83          3HD1      LEU  83  -0.285   2.292  -1.884
  635   HD21  LEU  83          3HD2      LEU  83  -2.856   1.865  -4.632
  636   HD22  LEU  83          1HD2      LEU  83  -2.874   2.801  -3.138
  637   HD23  LEU  83          2HD2      LEU  83  -2.388   1.106  -3.110
  638    H    LYS  84           H        LYS  84  -0.972   0.310  -6.528
  639    HA   LYS  84           HA       LYS  84  -3.630   0.576  -7.758
  640    HB2  LYS  84           2HB      LYS  84  -1.381  -1.275  -8.330
  641    HB3  LYS  84           1HB      LYS  84  -3.006  -1.938  -8.413
  642    HG2  LYS  84           2HG      LYS  84  -2.528   0.614  -9.831
  643    HG3  LYS  84           1HG      LYS  84  -1.783  -0.837 -10.504
  644    HD2  LYS  84           2HD      LYS  84  -3.891  -0.643 -11.556
  645    HD3  LYS  84           1HD      LYS  84  -4.068  -1.921 -10.353
  646    HE2  LYS  84           2HE      LYS  84  -5.498  -0.710  -9.079
  647    HE3  LYS  84           1HE      LYS  84  -4.701   0.818  -9.448
  648    HZ1  LYS  84           3HZ      LYS  84  -6.912   0.742 -10.396
  649    HZ2  LYS  84           1HZ      LYS  84  -6.532  -0.667 -11.255
  650    HZ3  LYS  84           2HZ      LYS  84  -5.755   0.789 -11.630
  651    H    VAL  85           H        VAL  85  -5.336  -0.553  -6.817
  652    HA   VAL  85           HA       VAL  85  -4.646  -2.167  -4.459
  653    HB   VAL  85           HB       VAL  85  -6.931  -0.198  -4.695
  654   HG11  VAL  85          1HG1      VAL  85  -6.382  -2.403  -2.836
  655   HG12  VAL  85          2HG1      VAL  85  -7.903  -1.605  -3.236
  656   HG13  VAL  85          3HG1      VAL  85  -6.800  -0.870  -2.071
  657   HG21  VAL  85          3HG2      VAL  85  -5.672   0.819  -2.685
  658   HG22  VAL  85          1HG2      VAL  85  -5.048   1.113  -4.308
  659   HG23  VAL  85          2HG2      VAL  85  -4.291  -0.102  -3.280
  660    H    ALA  86           H        ALA  86  -5.823  -3.987  -4.115
  661    HA   ALA  86           HA       ALA  86  -7.395  -4.973  -6.339
  662    HB1  ALA  86           3HB      ALA  86  -7.433  -7.095  -5.030
  663    HB2  ALA  86           1HB      ALA  86  -6.516  -6.276  -3.766
  664    HB3  ALA  86           2HB      ALA  86  -5.811  -6.490  -5.368
  665    H    LYS  87           H        LYS  87  -9.565  -5.407  -6.352
  666    HA   LYS  87           HA       LYS  87 -11.136  -4.153  -4.241
  667    HB2  LYS  87           2HB      LYS  87 -11.822  -5.158  -7.000
  668    HB3  LYS  87           1HB      LYS  87 -13.048  -4.612  -5.864
  669    HG2  LYS  87           2HG      LYS  87 -10.800  -2.761  -6.314
  670    HG3  LYS  87           1HG      LYS  87 -11.875  -3.026  -7.687
  671    HD2  LYS  87           2HD      LYS  87 -13.312  -1.589  -6.787
  672    HD3  LYS  87           1HD      LYS  87 -13.531  -2.700  -5.434
  673    HE2  LYS  87           2HE      LYS  87 -11.164  -0.889  -5.444
  674    HE3  LYS  87           1HE      LYS  87 -12.744  -0.215  -5.051
  675    HZ1  LYS  87           3HZ      LYS  87 -11.194  -2.261  -3.599
  676    HZ2  LYS  87           1HZ      LYS  87 -12.874  -2.171  -3.411
  677    HZ3  LYS  87           2HZ      LYS  87 -11.905  -0.845  -3.007
  678    HA   PRO  88           HA       PRO  88 -11.717  -8.321  -2.579
  679    HB2  PRO  88           2HB      PRO  88 -12.820  -7.532  -0.236
  680    HB3  PRO  88           1HB      PRO  88 -11.080  -7.468  -0.539
  681    HG2  PRO  88           2HG      PRO  88 -13.110  -5.271  -0.692
  682    HG3  PRO  88           1HG      PRO  88 -11.485  -5.244   0.019
  683    HD2  PRO  88           2HD      PRO  88 -12.025  -4.235  -2.438
  684    HD3  PRO  88           1HD      PRO  88 -10.460  -4.961  -2.023
  685    H    THR  89           H        THR  89 -13.381  -9.468  -3.440
  686    HA   THR  89           HA       THR  89 -16.111  -8.607  -2.821
  687    HB   THR  89           HB       THR  89 -16.760  -9.383  -5.170
  688    HG1  THR  89           1HG      THR  89 -14.050  -8.829  -5.768
  689   HG21  THR  89          3HG2      THR  89 -16.748  -7.011  -4.546
  690   HG22  THR  89          1HG2      THR  89 -16.292  -7.273  -6.229
  691   HG23  THR  89          2HG2      THR  89 -15.054  -6.910  -5.028
  692    H    GLY  90           H        GLY  90 -14.532 -11.245  -4.663
  693    HA2  GLY  90           2HA      GLY  90 -14.483 -13.515  -4.256
  694    HA3  GLY  90           1HA      GLY  90 -15.188 -13.209  -2.678
  695    H    SER  91           H        SER  91 -15.802 -15.314  -4.607
  696    HA   SER  91           HA       SER  91 -18.267 -14.780  -5.901
  697    HG   SER  91           HG       SER  91 -15.945 -17.642  -4.996
  698    HB2  SER  91           2HB      SER  91 -18.454 -17.256  -6.079
  699    HB3  SER  91           1HB      SER  91 -16.887 -16.650  -6.613
  700    H    HIS  92           H        HIS  92 -17.441 -16.063  -2.710
  701    HA   HIS  92           HA       HIS  92 -20.133 -16.692  -1.979
  702    HD1  HIS  92           1HD      HIS  92 -18.594 -16.259   2.191
  703    HD2  HIS  92           2HD      HIS  92 -20.903 -18.677  -0.277
  704    HE1  HIS  92           1HE      HIS  92 -20.327 -17.291   3.692
  705    HE2  HIS  92           2HE      HIS  92 -21.765 -18.685   2.161
  706    HB2  HIS  92           2HB      HIS  92 -18.076 -17.737  -0.971
  707    HB3  HIS  92           1HB      HIS  92 -17.784 -16.217  -0.134
  708    HA   ARG 301           HA       ARG 301   1.720 -10.533  10.481
  709    HE   ARG 301           HE       ARG 301  -2.522 -12.631  12.222
  710    H1   ARG 301           1HT      ARG 301   1.681 -12.472  11.737
  711    H2   ARG 301           2HT      ARG 301   2.366 -11.694  13.104
  712    H3   ARG 301           3HT      ARG 301   3.308 -11.935  11.689
  713    HB2  ARG 301           2HB      ARG 301   0.780 -10.000  13.310
  714    HB3  ARG 301           1HB      ARG 301   0.310  -9.054  11.906
  715    HG2  ARG 301           2HG      ARG 301  -1.456 -10.417  11.829
  716    HG3  ARG 301           1HG      ARG 301  -0.339 -11.575  11.105
  717    HD2  ARG 301           2HD      ARG 301   0.131 -12.502  13.322
  718    HD3  ARG 301           1HD      ARG 301  -0.989 -11.348  14.043
  719   HH11  ARG 301          1HH1      ARG 301  -0.436 -13.773  14.794
  720   HH12  ARG 301          2HH1      ARG 301  -1.367 -15.204  15.079
  721   HH21  ARG 301          1HH2      ARG 301  -3.744 -14.519  12.604
  722   HH22  ARG 301          2HH2      ARG 301  -3.244 -15.628  13.837
  723    H    ARG 302           H        ARG 302   3.534  -9.487   9.842
  724    HA   ARG 302           HA       ARG 302   4.949  -7.819  11.805
  725    HE   ARG 302           HE       ARG 302   7.800  -8.938   8.150
  726    HB2  ARG 302           2HB      ARG 302   6.303  -9.496  10.576
  727    HB3  ARG 302           1HB      ARG 302   5.869  -8.706   9.066
  728    HG2  ARG 302           2HG      ARG 302   7.130  -6.802   9.560
  729    HG3  ARG 302           1HG      ARG 302   7.236  -7.209  11.273
  730    HD2  ARG 302           2HD      ARG 302   9.359  -7.608  10.133
  731    HD3  ARG 302           1HD      ARG 302   8.669  -9.109  10.746
  732   HH11  ARG 302          1HH1      ARG 302  10.929  -8.961   9.718
  733   HH12  ARG 302          2HH1      ARG 302  11.732  -9.712   8.382
  734   HH21  ARG 302          1HH2      ARG 302   8.861  -9.930   6.392
  735   HH22  ARG 302          2HH2      ARG 302  10.558 -10.261   6.490
  736    H    GLU 303           H        GLU 303   4.854  -5.678  11.690
  737    HA   GLU 303           HA       GLU 303   3.853  -4.430   9.215
  738    HB2  GLU 303           2HB      GLU 303   3.210  -3.387  11.970
  739    HB3  GLU 303           1HB      GLU 303   2.468  -2.944  10.439
  740    HG2  GLU 303           2HG      GLU 303   1.361  -5.063  10.290
  741    HG3  GLU 303           1HG      GLU 303   2.232  -5.668  11.697
  742    H    THR 304           H        THR 304   5.352  -3.139   8.382
  743    HA   THR 304           HA       THR 304   7.157  -1.714  10.219
  744    HB   THR 304           HB       THR 304   7.738  -3.451   7.964
  745    HG1  THR 304           1HG      THR 304   9.002  -3.917   9.569
  746   HG21  THR 304          3HG2      THR 304   8.049  -1.391   6.713
  747   HG22  THR 304          1HG2      THR 304   9.582  -2.207   7.015
  748   HG23  THR 304          2HG2      THR 304   9.135  -0.790   7.966
  749    H    GLN 305           H        GLN 305   7.792   0.396   9.668
  750    HA   GLN 305           HA       GLN 305   5.793   1.878   8.215
  751    HB2  GLN 305           2HB      GLN 305   8.171   2.601   9.882
  752    HB3  GLN 305           1HB      GLN 305   7.457   3.812   8.825
  753    HG2  GLN 305           2HG      GLN 305   5.509   3.918  10.027
  754    HG3  GLN 305           1HG      GLN 305   5.688   2.286  10.667
  755   HE21  GLN 305          1HE2      GLN 305   6.735   5.612  10.957
  756   HE22  GLN 305          2HE2      GLN 305   7.363   5.475  12.561
  757    H    VAL 306           H        VAL 306   6.187   3.301   6.470
  758    HA   VAL 306           HA       VAL 306   8.659   2.911   4.955
  759    HB   VAL 306           HB       VAL 306   7.293   2.572   2.852
  760   HG11  VAL 306          1HG1      VAL 306   7.075   0.362   4.895
  761   HG12  VAL 306          2HG1      VAL 306   8.559   0.781   4.034
  762   HG13  VAL 306          3HG1      VAL 306   7.158   0.192   3.141
  763   HG21  VAL 306          3HG2      VAL 306   5.132   3.291   3.816
  764   HG22  VAL 306          1HG2      VAL 306   5.124   1.843   4.822
  765   HG23  VAL 306          2HG2      VAL 306   5.044   1.698   3.066
  Start of MODEL   29
    1    HA   MET   1           HA       MET   1  -9.148   2.490  -7.820
    2    H1   MET   1           1HT      MET   1  -8.360  -0.244  -8.555
    3    H2   MET   1           2HT      MET   1  -8.343   1.079  -9.650
    4    H3   MET   1           3HT      MET   1  -9.816   0.582  -8.922
    5    HB2  MET   1           2HB      MET   1  -8.613  -0.094  -6.373
    6    HB3  MET   1           1HB      MET   1  -8.513   1.448  -5.535
    7    HG2  MET   1           2HG      MET   1 -10.688   1.337  -5.180
    8    HG3  MET   1           1HG      MET   1 -10.943   1.500  -6.917
    9    HE1  MET   1           3HE      MET   1 -12.573   0.277  -7.808
   10    HE2  MET   1           1HE      MET   1 -12.864  -1.459  -7.705
   11    HE3  MET   1           2HE      MET   1 -11.446  -0.853  -8.561
   12    H    GLU   2           H        GLU   2  -7.488   3.747  -8.525
   13    HA   GLU   2           HA       GLU   2  -4.819   3.115  -7.471
   14    HB2  GLU   2           2HB      GLU   2  -3.840   4.137  -9.527
   15    HB3  GLU   2           1HB      GLU   2  -4.700   2.634  -9.824
   16    HG2  GLU   2           2HG      GLU   2  -6.183   5.188 -10.141
   17    HG3  GLU   2           1HG      GLU   2  -5.005   4.741 -11.373
   18    H    ILE   3           H        ILE   3  -3.415   5.029  -7.192
   19    HA   ILE   3           HA       ILE   3  -4.813   7.587  -7.048
   20    HB   ILE   3           HB       ILE   3  -3.276   6.359  -4.746
   21   HG12  ILE   3          2HG1      ILE   3  -5.684   7.036  -3.716
   22   HG13  ILE   3          1HG1      ILE   3  -6.163   6.637  -5.363
   23   HG21  ILE   3          1HG2      ILE   3  -2.783   8.686  -4.847
   24   HG22  ILE   3          2HG2      ILE   3  -3.942   8.436  -3.541
   25   HG23  ILE   3          3HG2      ILE   3  -4.481   9.093  -5.086
   26   HD11  ILE   3          3HD1      ILE   3  -6.293   4.543  -4.632
   27   HD12  ILE   3          1HD1      ILE   3  -5.376   4.904  -3.170
   28   HD13  ILE   3          2HD1      ILE   3  -4.530   4.542  -4.676
   29    H    LYS   4           H        LYS   4  -3.463   9.300  -7.595
   30    HA   LYS   4           HA       LYS   4  -0.713   8.549  -8.274
   31    HB2  LYS   4           2HB      LYS   4  -2.652  10.537  -9.327
   32    HB3  LYS   4           1HB      LYS   4  -0.953  10.984  -9.376
   33    HG2  LYS   4           2HG      LYS   4  -1.835   8.334 -10.436
   34    HG3  LYS   4           1HG      LYS   4  -2.026   9.794 -11.408
   35    HD2  LYS   4           2HD      LYS   4   0.052   8.996 -12.073
   36    HD3  LYS   4           1HD      LYS   4   0.467  10.207 -10.859
   37    HE2  LYS   4           2HE      LYS   4   0.928   8.565  -9.232
   38    HE3  LYS   4           1HE      LYS   4   0.137   7.299 -10.170
   39    HZ1  LYS   4           3HZ      LYS   4   2.573   8.702 -11.109
   40    HZ2  LYS   4           1HZ      LYS   4   1.900   7.271 -11.711
   41    HZ3  LYS   4           2HZ      LYS   4   2.633   7.286 -10.188
   42    H    LEU   5           H        LEU   5   0.244   8.674  -6.305
   43    HA   LEU   5           HA       LEU   5   0.114  11.144  -4.769
   44    HG   LEU   5           HG       LEU   5  -1.068   9.350  -3.360
   45    HB2  LEU   5           2HB      LEU   5   1.127   8.403  -4.286
   46    HB3  LEU   5           1HB      LEU   5   1.921   9.700  -3.414
   47   HD11  LEU   5          1HD1      LEU   5  -0.835   8.117  -1.294
   48   HD12  LEU   5          2HD1      LEU   5   0.922   8.188  -1.417
   49   HD13  LEU   5          3HD1      LEU   5  -0.008   7.266  -2.597
   50   HD21  LEU   5          3HD2      LEU   5  -0.387  11.494  -2.607
   51   HD22  LEU   5          1HD2      LEU   5   0.934  10.816  -1.656
   52   HD23  LEU   5          2HD2      LEU   5  -0.738  10.541  -1.166
   53    H    ILE   6           H        ILE   6   1.503  12.761  -4.909
   54    HA   ILE   6           HA       ILE   6   3.870  12.469  -6.581
   55    HB   ILE   6           HB       ILE   6   2.388  14.420  -6.916
   56   HG12  ILE   6          2HG1      ILE   6   5.131  15.210  -5.911
   57   HG13  ILE   6          1HG1      ILE   6   4.817  14.484  -7.484
   58   HG21  ILE   6          1HG2      ILE   6   3.399  15.550  -4.328
   59   HG22  ILE   6          2HG2      ILE   6   1.897  14.628  -4.409
   60   HG23  ILE   6          3HG2      ILE   6   2.071  16.114  -5.342
   61   HD11  ILE   6          3HD1      ILE   6   3.140  16.553  -7.634
   62   HD12  ILE   6          1HD1      ILE   6   4.835  16.649  -8.112
   63   HD13  ILE   6          2HD1      ILE   6   4.333  17.232  -6.526
   64    H    LYS   7           H        LYS   7   5.886  12.274  -5.812
   65    HA   LYS   7           HA       LYS   7   6.438  11.817  -3.113
   66    HB2  LYS   7           2HB      LYS   7   7.818  11.047  -5.061
   67    HB3  LYS   7           1HB      LYS   7   8.435  12.685  -5.204
   68    HG2  LYS   7           2HG      LYS   7  10.090  11.632  -3.996
   69    HG3  LYS   7           1HG      LYS   7   9.125  12.389  -2.728
   70    HD2  LYS   7           2HD      LYS   7   7.901   9.949  -3.050
   71    HD3  LYS   7           1HD      LYS   7   9.605   9.563  -3.290
   72    HE2  LYS   7           2HE      LYS   7   8.769  11.262  -0.976
   73    HE3  LYS   7           1HE      LYS   7   8.579   9.512  -0.894
   74    HZ1  LYS   7           3HZ      LYS   7  11.120  10.968  -1.394
   75    HZ2  LYS   7           1HZ      LYS   7  10.950   9.284  -1.367
   76    HZ3  LYS   7           2HZ      LYS   7  10.686  10.183   0.040
   77    H    GLY   8           H        GLY   8   6.338  13.225  -1.497
   78    HA2  GLY   8           2HA      GLY   8   6.897  16.059  -2.002
   79    HA3  GLY   8           1HA      GLY   8   6.094  15.398  -0.586
   80    HA   PRO   9           HA       PRO   9  10.598  16.234   0.415
   81    HB2  PRO   9           2HB      PRO   9   9.767  18.358   2.194
   82    HB3  PRO   9           1HB      PRO   9  10.772  18.466   0.749
   83    HG2  PRO   9           2HG      PRO   9   8.267  19.535   0.933
   84    HG3  PRO   9           1HG      PRO   9   8.997  19.005  -0.594
   85    HD2  PRO   9           2HD      PRO   9   7.038  17.571   1.167
   86    HD3  PRO   9           1HD      PRO   9   7.055  17.723  -0.605
   87    H    LYS  10           H        LYS  10   9.023  14.188   1.493
   88    HA   LYS  10           HA       LYS  10  10.042  14.085   4.180
   89    HB2  LYS  10           2HB      LYS  10   7.770  15.290   4.279
   90    HB3  LYS  10           1HB      LYS  10   7.065  13.730   3.882
   91    HG2  LYS  10           2HG      LYS  10   7.814  12.763   5.895
   92    HG3  LYS  10           1HG      LYS  10   8.898  14.117   6.228
   93    HD2  LYS  10           2HD      LYS  10   7.220  15.449   7.001
   94    HD3  LYS  10           1HD      LYS  10   6.014  14.737   5.927
   95    HE2  LYS  10           2HE      LYS  10   5.251  13.653   7.719
   96    HE3  LYS  10           1HE      LYS  10   6.695  12.650   7.601
   97    HZ1  LYS  10           3HZ      LYS  10   6.380  13.578   9.826
   98    HZ2  LYS  10           1HZ      LYS  10   6.480  15.146   9.198
   99    HZ3  LYS  10           2HZ      LYS  10   7.823  14.118   9.127
  100    H    GLY  11           H        GLY  11   7.504  12.504   2.211
  101    HA2  GLY  11           2HA      GLY  11   8.572  10.307   1.239
  102    HA3  GLY  11           1HA      GLY  11   8.601   9.890   2.945
  103    H    LEU  12           H        LEU  12   7.106   8.262   2.994
  104    HA   LEU  12           HA       LEU  12   4.521   8.629   1.713
  105    HG   LEU  12           HG       LEU  12   6.435   6.805   0.827
  106    HB2  LEU  12           2HB      LEU  12   5.699   6.346   3.292
  107    HB3  LEU  12           1HB      LEU  12   4.083   6.330   2.618
  108   HD11  LEU  12          1HD1      LEU  12   5.754   4.083   0.680
  109   HD12  LEU  12          2HD1      LEU  12   6.020   4.445   2.384
  110   HD13  LEU  12          3HD1      LEU  12   7.280   4.793   1.202
  111   HD21  LEU  12          3HD2      LEU  12   4.071   5.178   0.092
  112   HD22  LEU  12          1HD2      LEU  12   5.002   6.328  -0.868
  113   HD23  LEU  12          2HD2      LEU  12   3.824   6.911   0.309
  114    H    GLY  13           H        GLY  13   5.794   8.086   4.995
  115    HA2  GLY  13           2HA      GLY  13   5.054   8.913   7.013
  116    HA3  GLY  13           1HA      GLY  13   3.827   9.827   6.162
  117    H    PHE  14           H        PHE  14   4.349   6.316   6.155
  118    HA   PHE  14           HA       PHE  14   2.223   5.813   7.986
  119    HD1  PHE  14           2HD      PHE  14   2.198   3.074   5.005
  120    HD2  PHE  14           1HD      PHE  14   1.229   7.077   3.929
  121    HE1  PHE  14           2HE      PHE  14   2.677   2.553   2.651
  122    HE2  PHE  14           1HE      PHE  14   1.700   6.560   1.572
  123    HZ   PHE  14           HZ       PHE  14   2.424   4.298   0.930
  124    HB2  PHE  14           2HB      PHE  14   0.712   4.644   6.429
  125    HB3  PHE  14           1HB      PHE  14   0.825   6.361   6.086
  126    H    SER  15           H        SER  15   1.603   3.204   7.503
  127    HA   SER  15           HA       SER  15   4.187   1.853   7.209
  128    HG   SER  15           HG       SER  15   2.325   2.773  10.065
  129    HB2  SER  15           2HB      SER  15   3.074   0.279   9.059
  130    HB3  SER  15           1HB      SER  15   4.073   1.661   9.495
  131    H    ILE  16           H        ILE  16   3.798  -0.617   7.023
  132    HA   ILE  16           HA       ILE  16   1.242  -1.375   5.895
  133    HB   ILE  16           HB       ILE  16   1.827  -1.794   3.713
  134   HG12  ILE  16          2HG1      ILE  16   3.938  -3.018   4.258
  135   HG13  ILE  16          1HG1      ILE  16   3.995  -2.077   2.775
  136   HG21  ILE  16          1HG2      ILE  16   2.917   0.202   2.760
  137   HG22  ILE  16          2HG2      ILE  16   3.378   0.684   4.393
  138   HG23  ILE  16          3HG2      ILE  16   1.674   0.581   3.951
  139   HD11  ILE  16          3HD1      ILE  16   5.700  -0.888   3.503
  140   HD12  ILE  16          1HD1      ILE  16   5.820  -2.033   4.842
  141   HD13  ILE  16          2HD1      ILE  16   4.895  -0.541   5.035
  142    H    ALA  17           H        ALA  17   1.360  -3.632   5.020
  143    HA   ALA  17           HA       ALA  17   3.384  -5.332   6.275
  144    HB1  ALA  17           3HB      ALA  17   1.047  -6.811   6.466
  145    HB2  ALA  17           1HB      ALA  17   0.571  -5.199   7.007
  146    HB3  ALA  17           2HB      ALA  17   1.904  -6.043   7.799
  147    H    GLY  18           H        GLY  18   3.156  -7.652   5.203
  148    HA2  GLY  18           2HA      GLY  18   1.702  -8.114   2.935
  149    HA3  GLY  18           1HA      GLY  18   3.043  -7.156   2.355
  150    H    GLY  19           H        GLY  19   1.974 -10.269   2.506
  151    HA2  GLY  19           2HA      GLY  19   3.430 -11.911   1.519
  152    HA3  GLY  19           1HA      GLY  19   4.756 -11.229   2.441
  153    H    VAL  20           H        VAL  20   4.097 -13.960   2.343
  154    HA   VAL  20           HA       VAL  20   2.571 -14.809   4.562
  155    HB   VAL  20           HB       VAL  20   3.747 -16.984   4.327
  156   HG11  VAL  20          1HG1      VAL  20   2.922 -15.906   1.640
  157   HG12  VAL  20          2HG1      VAL  20   1.780 -16.309   2.923
  158   HG13  VAL  20          3HG1      VAL  20   2.802 -17.565   2.225
  159   HG21  VAL  20          3HG2      VAL  20   5.608 -15.332   2.780
  160   HG22  VAL  20          1HG2      VAL  20   5.162 -16.847   1.997
  161   HG23  VAL  20          2HG2      VAL  20   5.871 -16.864   3.612
  162    H    GLY  21           H        GLY  21   3.223 -15.500   6.635
  163    HA2  GLY  21           2HA      GLY  21   4.654 -15.705   8.479
  164    HA3  GLY  21           1HA      GLY  21   5.976 -15.106   7.489
  165    H    ASN  22           H        ASN  22   4.069 -12.820   6.709
  166    HA   ASN  22           HA       ASN  22   4.126 -11.255   9.185
  167    HB2  ASN  22           2HB      ASN  22   5.162  -9.375   8.123
  168    HB3  ASN  22           1HB      ASN  22   6.176 -10.761   7.735
  169   HD21  ASN  22          1HD2      ASN  22   6.127 -11.611   5.632
  170   HD22  ASN  22          2HD2      ASN  22   5.559 -10.667   4.302
  171    H    GLN  23           H        GLN  23   2.113 -12.596   7.194
  172    HA   GLN  23           HA       GLN  23   0.639 -10.894   5.722
  173    HB2  GLN  23           2HB      GLN  23  -0.224 -13.165   7.492
  174    HB3  GLN  23           1HB      GLN  23  -1.366 -12.308   6.465
  175    HG2  GLN  23           2HG      GLN  23  -0.155 -12.948   4.493
  176    HG3  GLN  23           1HG      GLN  23   1.123 -13.674   5.468
  177   HE21  GLN  23          1HE2      GLN  23   1.033 -15.801   5.506
  178   HE22  GLN  23          2HE2      GLN  23  -0.401 -16.763   5.454
  179    H    HIS  24           H        HIS  24  -0.819  -9.308   5.958
  180    HA   HIS  24           HA       HIS  24  -1.161  -8.128   8.597
  181    HD1  HIS  24           1HD      HIS  24  -0.507  -5.234   8.718
  182    HD2  HIS  24           2HD      HIS  24  -4.205  -5.613   6.884
  183    HE1  HIS  24           1HE      HIS  24  -1.892  -3.367   9.629
  184    HE2  HIS  24           2HE      HIS  24  -4.105  -3.542   8.440
  185    HB2  HIS  24           2HB      HIS  24  -0.577  -6.752   6.575
  186    HB3  HIS  24           1HB      HIS  24  -2.164  -7.116   5.931
  187    H    ILE  25           H        ILE  25  -2.979  -9.944   6.263
  188    HA   ILE  25           HA       ILE  25  -5.224 -10.059   8.091
  189    HB   ILE  25           HB       ILE  25  -5.302  -8.243   5.982
  190   HG12  ILE  25          2HG1      ILE  25  -7.828  -9.335   7.154
  191   HG13  ILE  25          1HG1      ILE  25  -6.644  -8.570   8.212
  192   HG21  ILE  25          1HG2      ILE  25  -7.063  -9.014   4.499
  193   HG22  ILE  25          2HG2      ILE  25  -7.045 -10.597   5.277
  194   HG23  ILE  25          3HG2      ILE  25  -5.636 -10.040   4.373
  195   HD11  ILE  25          3HD1      ILE  25  -8.550  -7.148   7.244
  196   HD12  ILE  25          1HD1      ILE  25  -7.612  -7.178   5.750
  197   HD13  ILE  25          2HD1      ILE  25  -6.910  -6.497   7.219
  198    HA   PRO  26           HA       PRO  26  -4.981 -14.277   6.741
  199    HB2  PRO  26           2HB      PRO  26  -7.388 -15.128   7.721
  200    HB3  PRO  26           1HB      PRO  26  -5.950 -14.892   8.720
  201    HG2  PRO  26           2HG      PRO  26  -8.294 -13.078   8.313
  202    HG3  PRO  26           1HG      PRO  26  -7.427 -13.470   9.810
  203    HD2  PRO  26           2HD      PRO  26  -7.007 -11.168   8.469
  204    HD3  PRO  26           1HD      PRO  26  -5.706 -12.000   9.345
  205    H    GLY  27           H        GLY  27  -5.281 -14.978   4.732
  206    HA2  GLY  27           2HA      GLY  27  -6.933 -15.887   3.153
  207    HA3  GLY  27           1HA      GLY  27  -7.877 -14.431   3.424
  208    H    ASP  28           H        ASP  28  -5.675 -12.579   3.304
  209    HA   ASP  28           HA       ASP  28  -4.853 -12.877   0.492
  210    HB2  ASP  28           2HB      ASP  28  -6.659 -10.973   1.505
  211    HB3  ASP  28           1HB      ASP  28  -5.160 -10.100   1.207
  212    H    ASN  29           H        ASN  29  -2.746 -12.922   0.293
  213    HA   ASN  29           HA       ASN  29  -0.990 -11.968   2.389
  214    HB2  ASN  29           2HB      ASN  29  -0.015 -12.950  -0.275
  215    HB3  ASN  29           1HB      ASN  29   0.735 -13.108   1.310
  216   HD21  ASN  29          1HD2      ASN  29  -0.546 -14.456   2.889
  217   HD22  ASN  29          2HD2      ASN  29  -1.265 -15.899   2.272
  218    H    SER  30           H        SER  30  -2.603 -10.058   0.584
  219    HA   SER  30           HA       SER  30  -0.739  -8.631  -1.007
  220    HG   SER  30           HG       SER  30  -4.622  -8.224  -0.652
  221    HB2  SER  30           2HB      SER  30  -2.915  -6.963  -0.080
  222    HB3  SER  30           1HB      SER  30  -2.575  -7.545  -1.708
  223    H    ILE  31           H        ILE  31  -0.694  -6.081  -0.494
  224    HA   ILE  31           HA       ILE  31   0.595  -5.915   2.138
  225    HB   ILE  31           HB       ILE  31   1.032  -4.422  -0.409
  226   HG12  ILE  31          2HG1      ILE  31   3.381  -4.789   0.112
  227   HG13  ILE  31          1HG1      ILE  31   2.957  -5.442   1.686
  228   HG21  ILE  31          1HG2      ILE  31   0.636  -2.588   1.048
  229   HG22  ILE  31          2HG2      ILE  31   2.382  -2.734   0.857
  230   HG23  ILE  31          3HG2      ILE  31   1.606  -3.319   2.327
  231   HD11  ILE  31          3HD1      ILE  31   1.600  -7.159   0.211
  232   HD12  ILE  31          1HD1      ILE  31   3.319  -7.366   0.535
  233   HD13  ILE  31          2HD1      ILE  31   2.790  -6.682  -0.999
  234    H    TYR  32           H        TYR  32  -0.504  -5.010   3.730
  235    HA   TYR  32           HA       TYR  32  -2.614  -3.055   3.082
  236    HD1  TYR  32           2HD      TYR  32  -2.348  -6.585   3.214
  237    HD2  TYR  32           1HD      TYR  32  -5.652  -4.229   4.486
  238    HE1  TYR  32           2HE      TYR  32  -3.869  -8.068   1.977
  239    HE2  TYR  32           1HE      TYR  32  -7.190  -5.696   3.267
  240    HH   TYR  32           HH       TYR  32  -6.220  -7.848   0.937
  241    HB2  TYR  32           2HB      TYR  32  -2.366  -5.019   5.353
  242    HB3  TYR  32           1HB      TYR  32  -3.570  -3.740   5.318
  243    H    VAL  33           H        VAL  33  -2.776  -1.161   4.232
  244    HA   VAL  33           HA       VAL  33  -0.393  -0.228   5.564
  245    HB   VAL  33           HB       VAL  33  -3.015   1.132   4.918
  246   HG11  VAL  33          1HG1      VAL  33  -0.584   2.307   6.268
  247   HG12  VAL  33          2HG1      VAL  33  -2.182   2.093   6.984
  248   HG13  VAL  33          3HG1      VAL  33  -1.955   3.232   5.656
  249   HG21  VAL  33          3HG2      VAL  33  -0.321   1.012   3.677
  250   HG22  VAL  33          1HG2      VAL  33  -1.191   2.544   3.601
  251   HG23  VAL  33          2HG2      VAL  33  -1.914   1.086   2.925
  252    H    THR  34           H        THR  34  -0.064  -0.257   7.706
  253    HA   THR  34           HA       THR  34  -2.285  -1.079   9.424
  254    HB   THR  34           HB       THR  34  -0.298  -2.480   9.451
  255    HG1  THR  34           1HG      THR  34  -0.656  -2.802  11.478
  256   HG21  THR  34          3HG2      THR  34   1.750  -1.675   9.407
  257   HG22  THR  34          1HG2      THR  34   1.502  -0.970  11.005
  258   HG23  THR  34          2HG2      THR  34   1.128  -0.032   9.558
  259    H    LYS  35           H        LYS  35  -0.141   1.677   8.990
  260    HA   LYS  35           HA       LYS  35  -1.712   3.177  10.900
  261    HB2  LYS  35           2HB      LYS  35   1.143   2.439  11.473
  262    HB3  LYS  35           1HB      LYS  35   0.468   3.937  12.088
  263    HG2  LYS  35           2HG      LYS  35  -1.394   1.991  12.774
  264    HG3  LYS  35           1HG      LYS  35   0.180   1.243  13.058
  265    HD2  LYS  35           2HD      LYS  35  -0.188   2.285  15.077
  266    HD3  LYS  35           1HD      LYS  35   0.720   3.529  14.215
  267    HE2  LYS  35           2HE      LYS  35  -1.115   4.876  13.944
  268    HE3  LYS  35           1HE      LYS  35  -2.246   3.525  13.979
  269    HZ1  LYS  35           3HZ      LYS  35  -1.847   3.324  16.369
  270    HZ2  LYS  35           1HZ      LYS  35  -2.451   4.853  15.967
  271    HZ3  LYS  35           2HZ      LYS  35  -0.809   4.658  16.318
  272    H    ILE  36           H        ILE  36  -2.038   5.112  10.011
  273    HA   ILE  36           HA       ILE  36  -0.097   6.130   8.075
  274    HB   ILE  36           HB       ILE  36  -2.901   7.066   8.695
  275   HG12  ILE  36          2HG1      ILE  36  -1.686   5.342   6.553
  276   HG13  ILE  36          1HG1      ILE  36  -3.111   5.036   7.538
  277   HG21  ILE  36          1HG2      ILE  36  -2.678   8.542   6.776
  278   HG22  ILE  36          2HG2      ILE  36  -1.018   8.001   6.529
  279   HG23  ILE  36          3HG2      ILE  36  -1.443   8.913   7.978
  280   HD11  ILE  36          3HD1      ILE  36  -3.907   5.482   5.385
  281   HD12  ILE  36          1HD1      ILE  36  -2.833   6.864   5.182
  282   HD13  ILE  36          2HD1      ILE  36  -4.194   6.964   6.300
  283    H    ILE  37           H        ILE  37   1.387   7.559   8.724
  284    HA   ILE  37           HA       ILE  37   1.216   8.863  11.278
  285    HB   ILE  37           HB       ILE  37   3.281   8.996   9.079
  286   HG12  ILE  37          2HG1      ILE  37   4.451   8.021  11.378
  287   HG13  ILE  37          1HG1      ILE  37   2.845   7.308  11.427
  288   HG21  ILE  37          1HG2      ILE  37   4.683  10.081  10.940
  289   HG22  ILE  37          2HG2      ILE  37   3.131  10.466  11.686
  290   HG23  ILE  37          3HG2      ILE  37   3.516  11.084  10.078
  291   HD11  ILE  37          3HD1      ILE  37   4.134   7.120   8.821
  292   HD12  ILE  37          1HD1      ILE  37   3.315   5.887   9.778
  293   HD13  ILE  37          2HD1      ILE  37   4.999   6.289  10.113
  294    H    GLU  38           H        GLU  38   0.009  10.677  11.537
  295    HA   GLU  38           HA       GLU  38  -1.241  12.299   9.835
  296    HB2  GLU  38           2HB      GLU  38  -0.975  12.481  12.428
  297    HB3  GLU  38           1HB      GLU  38   0.285  13.646  12.045
  298    HG2  GLU  38           2HG      GLU  38  -1.211  15.160  11.141
  299    HG3  GLU  38           1HG      GLU  38  -2.440  13.929  10.855
  300    H    GLY  39           H        GLY  39  -0.878  14.166   8.584
  301    HA2  GLY  39           2HA      GLY  39   0.282  15.654   7.292
  302    HA3  GLY  39           1HA      GLY  39   1.634  15.455   8.391
  303    H    GLY  40           H        GLY  40   0.607  12.478   7.090
  304    HA2  GLY  40           2HA      GLY  40   2.983  12.400   5.394
  305    HA3  GLY  40           1HA      GLY  40   2.036  11.019   5.921
  306    H    ALA  41           H        ALA  41   2.831  11.089   3.366
  307    HA   ALA  41           HA       ALA  41   1.391  12.343   1.410
  308    HB1  ALA  41           3HB      ALA  41   3.283  10.864   0.971
  309    HB2  ALA  41           1HB      ALA  41   1.896  10.447  -0.035
  310    HB3  ALA  41           2HB      ALA  41   2.289   9.465   1.376
  311    H    ALA  42           H        ALA  42   0.487   9.198   2.888
  312    HA   ALA  42           HA       ALA  42  -1.958   8.958   1.498
  313    HB1  ALA  42           3HB      ALA  42  -2.501   7.294   3.330
  314    HB2  ALA  42           1HB      ALA  42  -0.926   7.683   4.020
  315    HB3  ALA  42           2HB      ALA  42  -1.034   6.984   2.404
  316    H    HIS  43           H        HIS  43  -1.249  10.020   4.827
  317    HA   HIS  43           HA       HIS  43  -3.810  10.561   5.704
  318    HD1  HIS  43           1HD      HIS  43  -2.470  14.312   6.934
  319    HD2  HIS  43           2HD      HIS  43  -3.923  10.999   8.979
  320    HE1  HIS  43           1HE      HIS  43  -3.876  15.240   8.798
  321    HE2  HIS  43           2HE      HIS  43  -4.708  13.219  10.055
  322    HB2  HIS  43           2HB      HIS  43  -1.823  10.651   7.148
  323    HB3  HIS  43           1HB      HIS  43  -1.289  12.113   6.328
  324    H    LYS  44           H        LYS  44  -1.597  12.770   3.995
  325    HA   LYS  44           HA       LYS  44  -3.356  14.977   3.923
  326    HB2  LYS  44           2HB      LYS  44  -0.973  14.221   2.235
  327    HB3  LYS  44           1HB      LYS  44  -1.862  15.719   1.992
  328    HG2  LYS  44           2HG      LYS  44  -1.300  16.490   4.183
  329    HG3  LYS  44           1HG      LYS  44  -0.587  14.931   4.601
  330    HD2  LYS  44           2HD      LYS  44   1.250  15.261   3.187
  331    HD3  LYS  44           1HD      LYS  44   0.440  16.546   2.289
  332    HE2  LYS  44           2HE      LYS  44   0.488  17.909   4.400
  333    HE3  LYS  44           1HE      LYS  44   1.520  16.662   5.099
  334    HZ1  LYS  44           3HZ      LYS  44   3.101  17.059   3.272
  335    HZ2  LYS  44           1HZ      LYS  44   2.867  18.430   4.235
  336    HZ3  LYS  44           2HZ      LYS  44   2.130  18.329   2.717
  337    H    ASP  45           H        ASP  45  -2.801  12.297   1.676
  338    HA   ASP  45           HA       ASP  45  -4.378  13.231  -0.453
  339    HB2  ASP  45           2HB      ASP  45  -2.750  11.155  -0.234
  340    HB3  ASP  45           1HB      ASP  45  -4.243  10.303   0.148
  341    H    GLY  46           H        GLY  46  -5.212  11.010   2.219
  342    HA2  GLY  46           2HA      GLY  46  -7.261  10.974   3.371
  343    HA3  GLY  46           1HA      GLY  46  -7.970  11.961   2.105
  344    H    LYS  47           H        LYS  47  -6.695   9.918   0.131
  345    HA   LYS  47           HA       LYS  47  -9.051   8.296  -0.082
  346    HB2  LYS  47           2HB      LYS  47  -7.053   9.183  -1.839
  347    HB3  LYS  47           1HB      LYS  47  -6.893   7.433  -1.802
  348    HG2  LYS  47           2HG      LYS  47  -9.424   7.385  -2.197
  349    HG3  LYS  47           1HG      LYS  47  -9.247   9.084  -2.640
  350    HD2  LYS  47           2HD      LYS  47  -7.529   8.405  -4.308
  351    HD3  LYS  47           1HD      LYS  47  -7.880   6.720  -3.921
  352    HE2  LYS  47           2HE      LYS  47 -10.122   8.529  -4.694
  353    HE3  LYS  47           1HE      LYS  47  -9.048   7.914  -5.949
  354    HZ1  LYS  47           3HZ      LYS  47 -10.594   6.261  -4.024
  355    HZ2  LYS  47           1HZ      LYS  47  -9.552   5.661  -5.215
  356    HZ3  LYS  47           2HZ      LYS  47 -10.963   6.481  -5.659
  357    H    LEU  48           H        LEU  48  -5.725   7.785   0.989
  358    HA   LEU  48           HA       LEU  48  -6.146   4.922   1.247
  359    HG   LEU  48           HG       LEU  48  -4.262   3.654   1.047
  360    HB2  LEU  48           2HB      LEU  48  -3.943   6.214   0.589
  361    HB3  LEU  48           1HB      LEU  48  -3.732   6.311   2.326
  362   HD11  LEU  48          1HD1      LEU  48  -2.287   5.068  -0.004
  363   HD12  LEU  48          2HD1      LEU  48  -2.124   3.343   0.325
  364   HD13  LEU  48          3HD1      LEU  48  -1.451   4.523   1.450
  365   HD21  LEU  48          3HD2      LEU  48  -3.401   2.768   2.977
  366   HD22  LEU  48          1HD2      LEU  48  -4.167   4.232   3.591
  367   HD23  LEU  48          2HD2      LEU  48  -2.422   4.194   3.331
  368    H    GLN  49           H        GLN  49  -6.849   3.957   3.011
  369    HA   GLN  49           HA       GLN  49  -6.558   5.258   5.623
  370    HB2  GLN  49           2HB      GLN  49  -8.827   4.622   6.228
  371    HB3  GLN  49           1HB      GLN  49  -8.848   5.659   4.813
  372    HG2  GLN  49           2HG      GLN  49  -8.910   2.684   4.515
  373    HG3  GLN  49           1HG      GLN  49 -10.377   3.581   4.897
  374   HE21  GLN  49          1HE2      GLN  49  -8.385   2.470   2.447
  375   HE22  GLN  49          2HE2      GLN  49  -9.036   3.398   1.142
  376    H    ILE  50           H        ILE  50  -6.235   3.846   7.357
  377    HA   ILE  50           HA       ILE  50  -4.848   1.517   6.966
  378    HB   ILE  50           HB       ILE  50  -5.514   0.862   9.311
  379   HG12  ILE  50          2HG1      ILE  50  -6.600   3.306  10.197
  380   HG13  ILE  50          1HG1      ILE  50  -7.556   2.842   8.794
  381   HG21  ILE  50          1HG2      ILE  50  -4.515   3.676   8.900
  382   HG22  ILE  50          2HG2      ILE  50  -3.540   2.208   8.832
  383   HG23  ILE  50          3HG2      ILE  50  -4.291   2.701  10.350
  384   HD11  ILE  50          3HD1      ILE  50  -8.733   1.588  10.193
  385   HD12  ILE  50          1HD1      ILE  50  -7.527   1.744  11.471
  386   HD13  ILE  50          2HD1      ILE  50  -7.344   0.501  10.232
  387    H    GLY  51           H        GLY  51  -5.329  -0.440   6.207
  388    HA2  GLY  51           2HA      GLY  51  -6.762  -2.434   6.560
  389    HA3  GLY  51           1HA      GLY  51  -8.136  -1.363   6.372
  390    H    ASP  52           H        ASP  52  -6.567   0.052   4.104
  391    HA   ASP  52           HA       ASP  52  -7.725  -1.431   2.009
  392    HB2  ASP  52           2HB      ASP  52  -6.307   0.139   0.539
  393    HB3  ASP  52           1HB      ASP  52  -7.539   0.856   1.566
  394    H    LYS  53           H        LYS  53  -6.617  -2.401   0.174
  395    HA   LYS  53           HA       LYS  53  -4.120  -3.708   1.018
  396    HB2  LYS  53           2HB      LYS  53  -4.782  -5.507  -0.631
  397    HB3  LYS  53           1HB      LYS  53  -5.781  -5.376   0.806
  398    HG2  LYS  53           2HG      LYS  53  -6.671  -3.861  -1.568
  399    HG3  LYS  53           1HG      LYS  53  -6.784  -5.619  -1.649
  400    HD2  LYS  53           2HD      LYS  53  -7.809  -4.189   0.766
  401    HD3  LYS  53           1HD      LYS  53  -8.776  -4.204  -0.709
  402    HE2  LYS  53           2HE      LYS  53  -9.306  -6.378  -0.488
  403    HE3  LYS  53           1HE      LYS  53  -7.694  -6.817   0.063
  404    HZ1  LYS  53           3HZ      LYS  53 -10.044  -6.346   1.589
  405    HZ2  LYS  53           1HZ      LYS  53  -8.787  -5.344   2.115
  406    HZ3  LYS  53           2HZ      LYS  53  -8.573  -7.020   2.076
  407    H    LEU  54           H        LEU  54  -2.507  -4.022  -0.426
  408    HA   LEU  54           HA       LEU  54  -2.470  -2.127  -2.660
  409    HG   LEU  54           HG       LEU  54  -1.336  -0.571  -1.438
  410    HB2  LEU  54           2HB      LEU  54  -0.493  -2.965  -0.703
  411    HB3  LEU  54           1HB      LEU  54   0.133  -3.007  -2.340
  412   HD11  LEU  54          1HD1      LEU  54   1.478  -1.286  -0.655
  413   HD12  LEU  54          2HD1      LEU  54   0.136  -0.850   0.401
  414   HD13  LEU  54          3HD1      LEU  54   0.853   0.362  -0.660
  415   HD21  LEU  54          3HD2      LEU  54  -0.769  -0.236  -3.598
  416   HD22  LEU  54          1HD2      LEU  54   0.595  -1.351  -3.531
  417   HD23  LEU  54          2HD2      LEU  54   0.754   0.277  -2.872
  418    H    LEU  55           H        LEU  55  -3.121  -3.027  -4.453
  419    HA   LEU  55           HA       LEU  55  -2.666  -5.757  -5.151
  420    HG   LEU  55           HG       LEU  55  -3.022  -6.048  -7.723
  421    HB2  LEU  55           2HB      LEU  55  -4.653  -4.677  -5.955
  422    HB3  LEU  55           1HB      LEU  55  -3.722  -3.401  -6.711
  423   HD11  LEU  55          1HD1      LEU  55  -5.131  -6.247  -9.059
  424   HD12  LEU  55          2HD1      LEU  55  -5.859  -5.072  -7.965
  425   HD13  LEU  55          3HD1      LEU  55  -5.298  -6.625  -7.345
  426   HD21  LEU  55          3HD2      LEU  55  -2.468  -3.735  -8.644
  427   HD22  LEU  55          1HD2      LEU  55  -4.133  -3.695  -9.222
  428   HD23  LEU  55          2HD2      LEU  55  -3.030  -4.946  -9.794
  429    H    ALA  56           H        ALA  56  -1.401  -2.623  -6.347
  430    HA   ALA  56           HA       ALA  56   1.100  -3.972  -7.017
  431    HB1  ALA  56           3HB      ALA  56  -0.072  -4.349  -9.067
  432    HB2  ALA  56           1HB      ALA  56   1.060  -3.027  -9.365
  433    HB3  ALA  56           2HB      ALA  56  -0.651  -2.684  -9.116
  434    H    VAL  57           H        VAL  57   2.870  -2.561  -7.392
  435    HA   VAL  57           HA       VAL  57   2.408   0.298  -6.850
  436    HB   VAL  57           HB       VAL  57   4.513  -1.413  -5.509
  437   HG11  VAL  57          1HG1      VAL  57   4.939   0.781  -4.252
  438   HG12  VAL  57          2HG1      VAL  57   4.106   1.560  -5.597
  439   HG13  VAL  57          3HG1      VAL  57   5.580   0.635  -5.889
  440   HG21  VAL  57          3HG2      VAL  57   2.414  -1.728  -4.432
  441   HG22  VAL  57          1HG2      VAL  57   2.073   0.002  -4.458
  442   HG23  VAL  57          2HG2      VAL  57   3.359  -0.628  -3.428
  443    H    ASN  58           H        ASN  58   3.046   1.269  -8.676
  444    HA   ASN  58           HA       ASN  58   4.319   1.959 -10.420
  445    HB2  ASN  58           2HB      ASN  58   6.379   0.929  -8.513
  446    HB3  ASN  58           1HB      ASN  58   6.881   1.361 -10.143
  447   HD21  ASN  58          1HD2      ASN  58   5.421   2.556  -7.188
  448   HD22  ASN  58          2HD2      ASN  58   5.770   4.225  -7.471
  449    H    ASN  59           H        ASN  59   2.915  -0.264 -10.958
  450    HA   ASN  59           HA       ASN  59   2.712  -1.716 -12.715
  451    HB2  ASN  59           2HB      ASN  59   5.006  -0.423 -13.441
  452    HB3  ASN  59           1HB      ASN  59   5.565  -2.087 -13.315
  453   HD21  ASN  59          1HD2      ASN  59   3.695   0.168 -15.099
  454   HD22  ASN  59          2HD2      ASN  59   3.231  -0.894 -16.380
  455    H    VAL  60           H        VAL  60   4.723  -2.273  -9.988
  456    HA   VAL  60           HA       VAL  60   4.924  -5.141 -10.532
  457    HB   VAL  60           HB       VAL  60   6.375  -5.335  -8.687
  458   HG11  VAL  60          1HG1      VAL  60   6.890  -2.739 -10.114
  459   HG12  VAL  60          2HG1      VAL  60   7.539  -4.335 -10.490
  460   HG13  VAL  60          3HG1      VAL  60   8.056  -3.494  -9.028
  461   HG21  VAL  60          3HG2      VAL  60   5.826  -4.307  -6.793
  462   HG22  VAL  60          1HG2      VAL  60   4.910  -3.065  -7.644
  463   HG23  VAL  60          2HG2      VAL  60   6.651  -2.886  -7.432
  464    H    CYS  61           H        CYS  61   3.955  -6.730  -9.167
  465    HA   CYS  61           HA       CYS  61   1.493  -5.798  -7.944
  466    HG   CYS  61           HG       CYS  61   3.321  -9.346  -9.149
  467    HB2  CYS  61           2HB      CYS  61   0.902  -8.152  -7.740
  468    HB3  CYS  61           1HB      CYS  61   1.425  -7.780  -9.378
  469    H    LEU  62           H        LEU  62   1.115  -5.589  -5.827
  470    HA   LEU  62           HA       LEU  62   3.270  -6.332  -3.988
  471    HG   LEU  62           HG       LEU  62   3.268  -5.005  -1.781
  472    HB2  LEU  62           2HB      LEU  62   2.048  -3.934  -4.324
  473    HB3  LEU  62           1HB      LEU  62   1.102  -4.600  -3.009
  474   HD11  LEU  62          1HD1      LEU  62   4.535  -3.037  -3.628
  475   HD12  LEU  62          2HD1      LEU  62   4.553  -4.752  -4.039
  476   HD13  LEU  62          3HD1      LEU  62   5.283  -4.199  -2.532
  477   HD21  LEU  62          3HD2      LEU  62   3.465  -2.744  -1.010
  478   HD22  LEU  62          1HD2      LEU  62   1.769  -3.072  -1.358
  479   HD23  LEU  62          2HD2      LEU  62   2.734  -2.127  -2.490
  480    H    GLU  63           H        GLU  63   1.382  -8.297  -4.938
  481    HA   GLU  63           HA       GLU  63   0.049  -8.964  -2.399
  482    HB2  GLU  63           2HB      GLU  63  -1.413  -8.354  -4.443
  483    HB3  GLU  63           1HB      GLU  63  -0.958  -9.941  -5.050
  484    HG2  GLU  63           2HG      GLU  63  -1.758 -10.683  -2.636
  485    HG3  GLU  63           1HG      GLU  63  -2.704  -9.203  -2.772
  486    H    GLU  64           H        GLU  64   2.288 -10.025  -4.790
  487    HA   GLU  64           HA       GLU  64   2.242 -12.726  -3.625
  488    HB2  GLU  64           2HB      GLU  64   2.296 -11.831  -6.378
  489    HB3  GLU  64           1HB      GLU  64   3.590 -12.964  -6.028
  490    HG2  GLU  64           2HG      GLU  64   1.745 -14.219  -6.813
  491    HG3  GLU  64           1HG      GLU  64   1.864 -14.502  -5.078
  492    H    VAL  65           H        VAL  65   3.676 -10.592  -2.448
  493    HA   VAL  65           HA       VAL  65   6.411 -11.627  -2.740
  494    HB   VAL  65           HB       VAL  65   7.310  -9.310  -2.437
  495   HG11  VAL  65          1HG1      VAL  65   7.298 -10.466  -4.612
  496   HG12  VAL  65          2HG1      VAL  65   7.145  -8.717  -4.778
  497   HG13  VAL  65          3HG1      VAL  65   5.727  -9.748  -4.966
  498   HG21  VAL  65          3HG2      VAL  65   4.461  -8.540  -3.060
  499   HG22  VAL  65          1HG2      VAL  65   5.833  -7.433  -3.121
  500   HG23  VAL  65          2HG2      VAL  65   5.368  -8.177  -1.590
  501    H    THR  66           H        THR  66   7.814 -11.197  -0.943
  502    HA   THR  66           HA       THR  66   6.537 -11.586   1.574
  503    HB   THR  66           HB       THR  66   9.334 -10.760   1.752
  504    HG1  THR  66           1HG      THR  66  10.088 -11.766   0.095
  505   HG21  THR  66          3HG2      THR  66   9.641 -12.930   2.772
  506   HG22  THR  66          1HG2      THR  66   8.018 -13.413   2.277
  507   HG23  THR  66          2HG2      THR  66   8.232 -12.118   3.455
  508    H    HIS  67           H        HIS  67   7.790 -10.107   3.454
  509    HA   HIS  67           HA       HIS  67   6.464  -7.596   3.167
  510    HD1  HIS  67           1HD      HIS  67   5.027  -6.970   5.995
  511    HD2  HIS  67           2HD      HIS  67   8.850  -5.428   5.521
  512    HE1  HIS  67           1HE      HIS  67   4.879  -4.564   6.689
  513    HE2  HIS  67           2HE      HIS  67   7.155  -3.621   6.232
  514    HB2  HIS  67           2HB      HIS  67   6.708  -8.730   5.375
  515    HB3  HIS  67           1HB      HIS  67   8.407  -8.289   5.378
  516    H    GLU  68           H        GLU  68   9.861  -8.586   3.001
  517    HA   GLU  68           HA       GLU  68  11.123  -6.145   2.949
  518    HB2  GLU  68           2HB      GLU  68  11.717  -8.556   1.213
  519    HB3  GLU  68           1HB      GLU  68  12.806  -7.195   1.440
  520    HG2  GLU  68           2HG      GLU  68  11.906  -8.381   3.946
  521    HG3  GLU  68           1HG      GLU  68  12.790  -9.501   2.912
  522    H    GLU  69           H        GLU  69   9.589  -7.823   0.225
  523    HA   GLU  69           HA       GLU  69  10.096  -5.827  -1.719
  524    HB2  GLU  69           2HB      GLU  69   8.003  -7.997  -1.581
  525    HB3  GLU  69           1HB      GLU  69   8.228  -6.959  -2.982
  526    HG2  GLU  69           2HG      GLU  69   9.587  -8.580  -3.695
  527    HG3  GLU  69           1HG      GLU  69  10.757  -7.859  -2.590
  528    H    ALA  70           H        ALA  70   7.480  -6.315   0.592
  529    HA   ALA  70           HA       ALA  70   5.593  -4.485  -0.401
  530    HB1  ALA  70           3HB      ALA  70   6.201  -5.310   2.439
  531    HB2  ALA  70           1HB      ALA  70   5.028  -6.046   1.349
  532    HB3  ALA  70           2HB      ALA  70   4.778  -4.401   1.941
  533    H    VAL  71           H        VAL  71   8.336  -4.056   1.794
  534    HA   VAL  71           HA       VAL  71   7.855  -1.230   2.147
  535    HB   VAL  71           HB       VAL  71  10.098  -3.044   3.033
  536   HG11  VAL  71          1HG1      VAL  71  10.717  -0.956   4.452
  537   HG12  VAL  71          2HG1      VAL  71   9.894  -0.062   3.174
  538   HG13  VAL  71          3HG1      VAL  71  11.287  -1.072   2.787
  539   HG21  VAL  71          3HG2      VAL  71   9.124  -3.038   5.102
  540   HG22  VAL  71          1HG2      VAL  71   7.687  -2.882   4.094
  541   HG23  VAL  71          2HG2      VAL  71   8.377  -1.458   4.868
  542    H    THR  72           H        THR  72   9.964  -3.277   0.203
  543    HA   THR  72           HA       THR  72  11.717  -1.286  -0.719
  544    HB   THR  72           HB       THR  72  10.871  -3.918  -1.936
  545    HG1  THR  72           1HG      THR  72  12.184  -4.577  -0.451
  546   HG21  THR  72          3HG2      THR  72  12.973  -3.759  -3.267
  547   HG22  THR  72          1HG2      THR  72  13.062  -2.055  -2.822
  548   HG23  THR  72          2HG2      THR  72  11.702  -2.646  -3.776
  549    H    ALA  73           H        ALA  73   8.595  -2.434  -1.960
  550    HA   ALA  73           HA       ALA  73   8.677  -0.864  -4.335
  551    HB1  ALA  73           3HB      ALA  73   7.374  -2.867  -4.342
  552    HB2  ALA  73           1HB      ALA  73   6.269  -1.501  -4.508
  553    HB3  ALA  73           2HB      ALA  73   6.430  -2.322  -2.955
  554    H    LEU  74           H        LEU  74   7.298  -0.452  -1.085
  555    HA   LEU  74           HA       LEU  74   5.828   1.913  -1.695
  556    HG   LEU  74           HG       LEU  74   4.447   0.648   1.469
  557    HB2  LEU  74           2HB      LEU  74   6.699   0.455   0.743
  558    HB3  LEU  74           1HB      LEU  74   6.310   2.151   0.935
  559   HD11  LEU  74          1HD1      LEU  74   2.752   1.911   0.366
  560   HD12  LEU  74          2HD1      LEU  74   3.846   2.327  -0.952
  561   HD13  LEU  74          3HD1      LEU  74   4.118   2.984   0.661
  562   HD21  LEU  74          3HD2      LEU  74   5.036  -0.376  -1.210
  563   HD22  LEU  74          1HD2      LEU  74   3.325  -0.106  -0.884
  564   HD23  LEU  74          2HD2      LEU  74   4.266  -1.164   0.166
  565    H    LYS  75           H        LYS  75   9.076   1.151  -0.674
  566    HA   LYS  75           HA       LYS  75   9.797   3.934  -0.241
  567    HB2  LYS  75           2HB      LYS  75  11.880   3.175   0.522
  568    HB3  LYS  75           1HB      LYS  75  10.737   1.958   1.065
  569    HG2  LYS  75           2HG      LYS  75  11.622   0.348  -0.240
  570    HG3  LYS  75           1HG      LYS  75  12.008   1.461  -1.551
  571    HD2  LYS  75           2HD      LYS  75  14.091   0.779  -0.719
  572    HD3  LYS  75           1HD      LYS  75  13.829   2.372  -0.007
  573    HE2  LYS  75           2HE      LYS  75  12.724   0.279   1.655
  574    HE3  LYS  75           1HE      LYS  75  14.435   0.004   1.335
  575    HZ1  LYS  75           3HZ      LYS  75  13.283   2.526   2.402
  576    HZ2  LYS  75           1HZ      LYS  75  14.926   2.210   2.148
  577    HZ3  LYS  75           2HZ      LYS  75  14.070   1.347   3.324
  578    H    ASN  76           H        ASN  76   9.706   1.830  -2.938
  579    HA   ASN  76           HA       ASN  76  11.853   3.087  -4.395
  580    HB2  ASN  76           2HB      ASN  76  11.143   0.688  -4.710
  581    HB3  ASN  76           1HB      ASN  76   9.681   1.286  -5.489
  582   HD21  ASN  76          1HD2      ASN  76   9.758   1.415  -7.615
  583   HD22  ASN  76          2HD2      ASN  76  11.187   1.570  -8.574
  584    H    THR  77           H        THR  77  10.618   5.221  -3.750
  585    HA   THR  77           HA       THR  77   8.904   5.966  -6.029
  586    HB   THR  77           HB       THR  77   7.920   7.698  -4.499
  587    HG1  THR  77           1HG      THR  77   8.349   7.617  -2.358
  588   HG21  THR  77          3HG2      THR  77   7.558   4.945  -3.362
  589   HG22  THR  77          1HG2      THR  77   6.840   5.464  -4.888
  590   HG23  THR  77          2HG2      THR  77   6.404   6.278  -3.386
  591    H    SER  78           H        SER  78   9.888   7.280  -7.395
  592    HA   SER  78           HA       SER  78  12.171   8.870  -6.514
  593    HG   SER  78           HG       SER  78  12.465   6.620  -8.653
  594    HB2  SER  78           2HB      SER  78  11.075   8.147  -9.230
  595    HB3  SER  78           1HB      SER  78  12.318   9.382  -9.033
  596    H    ASP  79           H        ASP  79   9.865   9.815  -9.033
  597    HA   ASP  79           HA       ASP  79   9.544  12.390  -7.671
  598    HB2  ASP  79           2HB      ASP  79   8.819  13.278  -9.815
  599    HB3  ASP  79           1HB      ASP  79  10.344  12.426 -10.019
  600    H    PHE  80           H        PHE  80   7.673   9.775  -9.159
  601    HA   PHE  80           HA       PHE  80   5.343  10.632  -7.584
  602    HD1  PHE  80           1HD      PHE  80   5.082  12.912  -9.902
  603    HD2  PHE  80           2HD      PHE  80   2.319   9.809  -8.978
  604    HE1  PHE  80           1HE      PHE  80   3.311  14.589  -9.586
  605    HE2  PHE  80           2HE      PHE  80   0.545  11.485  -8.660
  606    HZ   PHE  80           HZ       PHE  80   1.041  13.875  -8.962
  607    HB2  PHE  80           2HB      PHE  80   5.553  10.574 -10.430
  608    HB3  PHE  80           1HB      PHE  80   4.439   9.301  -9.939
  609    H    VAL  81           H        VAL  81   3.662   8.770  -7.458
  610    HA   VAL  81           HA       VAL  81   4.895   6.141  -7.564
  611    HB   VAL  81           HB       VAL  81   5.381   6.790  -5.291
  612   HG11  VAL  81          1HG1      VAL  81   3.819   8.573  -4.947
  613   HG12  VAL  81          2HG1      VAL  81   3.565   7.355  -3.698
  614   HG13  VAL  81          3HG1      VAL  81   2.456   7.463  -5.063
  615   HG21  VAL  81          3HG2      VAL  81   2.977   4.982  -5.170
  616   HG22  VAL  81          1HG2      VAL  81   4.390   4.984  -4.115
  617   HG23  VAL  81          2HG2      VAL  81   4.544   4.471  -5.794
  618    H    TYR  82           H        TYR  82   3.526   4.835  -8.572
  619    HA   TYR  82           HA       TYR  82   0.693   5.577  -8.695
  620    HD1  TYR  82           1HD      TYR  82   0.154   2.026 -10.339
  621    HD2  TYR  82           2HD      TYR  82  -0.070   6.072 -11.635
  622    HE1  TYR  82           1HE      TYR  82  -1.991   1.554 -11.421
  623    HE2  TYR  82           2HE      TYR  82  -2.226   5.609 -12.718
  624    HH   TYR  82           HH       TYR  82  -4.020   2.814 -12.141
  625    HB2  TYR  82           2HB      TYR  82   2.015   5.141 -10.797
  626    HB3  TYR  82           1HB      TYR  82   2.110   3.456 -10.301
  627    H    LEU  83           H        LEU  83  -0.247   4.844  -6.908
  628    HA   LEU  83           HA       LEU  83   0.266   2.179  -5.901
  629    HG   LEU  83           HG       LEU  83  -0.309   1.786  -3.703
  630    HB2  LEU  83           2HB      LEU  83  -0.098   4.308  -4.512
  631    HB3  LEU  83           1HB      LEU  83  -1.803   4.089  -4.856
  632   HD11  LEU  83          1HD1      LEU  83  -0.659   2.625  -1.437
  633   HD12  LEU  83          2HD1      LEU  83  -1.222   4.162  -2.090
  634   HD13  LEU  83          3HD1      LEU  83   0.449   3.657  -2.342
  635   HD21  LEU  83          3HD2      LEU  83  -2.515   1.248  -4.128
  636   HD22  LEU  83          1HD2      LEU  83  -3.099   2.856  -3.699
  637   HD23  LEU  83          2HD2      LEU  83  -2.577   1.740  -2.436
  638    H    LYS  84           H        LYS  84  -0.914   0.434  -6.227
  639    HA   LYS  84           HA       LYS  84  -3.567   0.695  -7.477
  640    HB2  LYS  84           2HB      LYS  84  -1.388  -1.323  -7.926
  641    HB3  LYS  84           1HB      LYS  84  -3.058  -1.673  -8.343
  642    HG2  LYS  84           2HG      LYS  84  -2.161   0.880  -9.396
  643    HG3  LYS  84           1HG      LYS  84  -1.182  -0.474  -9.961
  644    HD2  LYS  84           2HD      LYS  84  -2.914  -0.292 -11.535
  645    HD3  LYS  84           1HD      LYS  84  -3.396  -1.631 -10.491
  646    HE2  LYS  84           2HE      LYS  84  -4.347   0.917  -9.492
  647    HE3  LYS  84           1HE      LYS  84  -4.907   0.610 -11.135
  648    HZ1  LYS  84           3HZ      LYS  84  -6.455  -0.263  -9.515
  649    HZ2  LYS  84           1HZ      LYS  84  -5.245  -1.214  -8.814
  650    HZ3  LYS  84           2HZ      LYS  84  -5.765  -1.532 -10.393
  651    H    VAL  85           H        VAL  85  -5.281  -0.387  -6.519
  652    HA   VAL  85           HA       VAL  85  -4.597  -2.034  -4.179
  653    HB   VAL  85           HB       VAL  85  -6.955  -0.167  -4.501
  654   HG11  VAL  85          1HG1      VAL  85  -7.972  -1.519  -3.040
  655   HG12  VAL  85          2HG1      VAL  85  -6.816  -0.920  -1.850
  656   HG13  VAL  85          3HG1      VAL  85  -6.490  -2.420  -2.715
  657   HG21  VAL  85          3HG2      VAL  85  -4.390   0.005  -2.959
  658   HG22  VAL  85          1HG2      VAL  85  -5.829   0.876  -2.428
  659   HG23  VAL  85          2HG2      VAL  85  -5.137   1.203  -4.017
  660    H    ALA  86           H        ALA  86  -5.656  -3.936  -3.892
  661    HA   ALA  86           HA       ALA  86  -7.203  -4.938  -6.147
  662    HB1  ALA  86           3HB      ALA  86  -5.307  -6.222  -5.082
  663    HB2  ALA  86           1HB      ALA  86  -6.817  -7.110  -5.286
  664    HB3  ALA  86           2HB      ALA  86  -6.371  -6.480  -3.701
  665    H    LYS  87           H        LYS  87  -9.287  -5.783  -6.008
  666    HA   LYS  87           HA       LYS  87 -10.888  -4.694  -3.827
  667    HB2  LYS  87           2HB      LYS  87 -11.424  -4.517  -6.368
  668    HB3  LYS  87           1HB      LYS  87 -12.015  -6.164  -6.190
  669    HG2  LYS  87           2HG      LYS  87 -13.945  -5.008  -5.841
  670    HG3  LYS  87           1HG      LYS  87 -13.353  -5.112  -4.181
  671    HD2  LYS  87           2HD      LYS  87 -12.327  -2.873  -4.456
  672    HD3  LYS  87           1HD      LYS  87 -13.046  -2.775  -6.064
  673    HE2  LYS  87           2HE      LYS  87 -15.283  -3.069  -5.005
  674    HE3  LYS  87           1HE      LYS  87 -14.497  -2.973  -3.429
  675    HZ1  LYS  87           3HZ      LYS  87 -13.761  -0.751  -3.940
  676    HZ2  LYS  87           1HZ      LYS  87 -15.438  -0.843  -4.150
  677    HZ3  LYS  87           2HZ      LYS  87 -14.416  -0.841  -5.498
  678    HA   PRO  88           HA       PRO  88 -10.878  -8.754  -1.914
  679    HB2  PRO  88           2HB      PRO  88 -12.456  -8.083   0.203
  680    HB3  PRO  88           1HB      PRO  88 -10.734  -7.705   0.116
  681    HG2  PRO  88           2HG      PRO  88 -13.090  -5.948  -0.413
  682    HG3  PRO  88           1HG      PRO  88 -11.567  -5.567   0.414
  683    HD2  PRO  88           2HD      PRO  88 -12.087  -4.850  -2.160
  684    HD3  PRO  88           1HD      PRO  88 -10.453  -5.183  -1.555
  685    H    THR  89           H        THR  89 -12.394 -10.439  -1.510
  686    HA   THR  89           HA       THR  89 -15.146  -9.949  -2.413
  687    HB   THR  89           HB       THR  89 -13.545 -12.343  -3.324
  688    HG1  THR  89           1HG      THR  89 -12.596 -10.878  -4.525
  689   HG21  THR  89          3HG2      THR  89 -16.154 -11.186  -4.274
  690   HG22  THR  89          1HG2      THR  89 -15.916 -12.719  -3.435
  691   HG23  THR  89          2HG2      THR  89 -15.277 -12.497  -5.063
  692    H    GLY  90           H        GLY  90 -16.714 -11.306  -1.544
  693    HA2  GLY  90           2HA      GLY  90 -16.761 -13.617  -0.287
  694    HA3  GLY  90           1HA      GLY  90 -15.882 -12.680   0.909
  695    H    SER  91           H        SER  91 -18.741 -13.945   0.496
  696    HA   SER  91           HA       SER  91 -20.477 -11.695   0.960
  697    HG   SER  91           HG       SER  91 -21.321 -15.244   2.035
  698    HB2  SER  91           2HB      SER  91 -22.223 -13.446   1.318
  699    HB3  SER  91           1HB      SER  91 -21.375 -13.610  -0.219
  700    H    HIS  92           H        HIS  92 -18.895 -14.156   2.929
  701    HA   HIS  92           HA       HIS  92 -20.289 -13.719   5.332
  702    HD1  HIS  92           1HD      HIS  92 -20.414 -15.238   7.273
  703    HD2  HIS  92           2HD      HIS  92 -18.540 -17.608   4.421
  704    HE1  HIS  92           1HE      HIS  92 -21.438 -17.522   7.518
  705    HE2  HIS  92           2HE      HIS  92 -20.214 -18.962   5.854
  706    HB2  HIS  92           2HB      HIS  92 -17.770 -15.034   4.529
  707    HB3  HIS  92           1HB      HIS  92 -17.826 -14.487   6.201
  708    HA   ARG 301           HA       ARG 301   1.833 -10.835  10.232
  709    HE   ARG 301           HE       ARG 301  -2.588 -10.617  13.665
  710    H1   ARG 301           1HT      ARG 301   3.355 -12.565  10.967
  711    H2   ARG 301           2HT      ARG 301   1.699 -12.989  11.112
  712    H3   ARG 301           3HT      ARG 301   2.598 -12.543  12.504
  713    HB2  ARG 301           2HB      ARG 301   1.084 -10.886  13.164
  714    HB3  ARG 301           1HB      ARG 301   0.636  -9.602  12.052
  715    HG2  ARG 301           2HG      ARG 301  -0.264 -11.806  10.731
  716    HG3  ARG 301           1HG      ARG 301  -0.510 -12.269  12.415
  717    HD2  ARG 301           2HD      ARG 301  -1.349  -9.559  12.045
  718    HD3  ARG 301           1HD      ARG 301  -2.106 -10.571  10.818
  719   HH11  ARG 301          1HH1      ARG 301  -2.906 -12.377  10.650
  720   HH12  ARG 301          2HH1      ARG 301  -4.190 -13.381  11.232
  721   HH21  ARG 301          1HH2      ARG 301  -4.277 -11.947  14.422
  722   HH22  ARG 301          2HH2      ARG 301  -4.968 -13.138  13.372
  723    H    ARG 302           H        ARG 302   3.178  -9.217   9.805
  724    HA   ARG 302           HA       ARG 302   4.707  -7.953  11.925
  725    HE   ARG 302           HE       ARG 302   8.265 -10.434   9.034
  726    HB2  ARG 302           2HB      ARG 302   6.325  -9.568  11.354
  727    HB3  ARG 302           1HB      ARG 302   5.968  -9.450   9.641
  728    HG2  ARG 302           2HG      ARG 302   6.815  -6.935  10.116
  729    HG3  ARG 302           1HG      ARG 302   7.748  -7.820  11.322
  730    HD2  ARG 302           2HD      ARG 302   7.674  -8.327   8.352
  731    HD3  ARG 302           1HD      ARG 302   9.020  -7.667   9.278
  732   HH11  ARG 302          1HH1      ARG 302   9.996  -8.096  10.986
  733   HH12  ARG 302          2HH1      ARG 302  11.014  -9.285  11.724
  734   HH21  ARG 302          1HH2      ARG 302   9.609 -11.992  10.011
  735   HH22  ARG 302          2HH2      ARG 302  10.795 -11.496  11.171
  736    H    GLU 303           H        GLU 303   4.490  -5.846  11.679
  737    HA   GLU 303           HA       GLU 303   4.059  -4.765   8.971
  738    HB2  GLU 303           2HB      GLU 303   2.967  -3.933  11.649
  739    HB3  GLU 303           1HB      GLU 303   2.976  -2.830  10.280
  740    HG2  GLU 303           2HG      GLU 303   0.941  -3.683   9.911
  741    HG3  GLU 303           1HG      GLU 303   1.844  -4.980   9.136
  742    H    THR 304           H        THR 304   5.076  -2.827   8.390
  743    HA   THR 304           HA       THR 304   7.020  -1.692  10.239
  744    HB   THR 304           HB       THR 304   7.700  -3.398   7.983
  745    HG1  THR 304           1HG      THR 304   8.806  -3.899   9.709
  746   HG21  THR 304          3HG2      THR 304   9.624  -2.141   7.190
  747   HG22  THR 304          1HG2      THR 304   9.094  -0.739   8.120
  748   HG23  THR 304          2HG2      THR 304   8.109  -1.334   6.784
  749    H    GLN 305           H        GLN 305   7.514   0.452   9.867
  750    HA   GLN 305           HA       GLN 305   5.633   1.915   8.287
  751    HB2  GLN 305           2HB      GLN 305   7.790   2.578  10.200
  752    HB3  GLN 305           1HB      GLN 305   7.423   3.805   8.993
  753    HG2  GLN 305           2HG      GLN 305   5.144   3.921   9.705
  754    HG3  GLN 305           1HG      GLN 305   5.364   2.546  10.787
  755   HE21  GLN 305          1HE2      GLN 305   5.173   3.306  12.784
  756   HE22  GLN 305          2HE2      GLN 305   5.994   4.687  13.419
  757    H    VAL 306           H        VAL 306   6.097   3.377   6.588
  758    HA   VAL 306           HA       VAL 306   8.633   3.025   5.176
  759    HB   VAL 306           HB       VAL 306   7.361   2.734   3.009
  760   HG11  VAL 306          1HG1      VAL 306   7.234   0.358   3.218
  761   HG12  VAL 306          2HG1      VAL 306   7.021   0.467   4.966
  762   HG13  VAL 306          3HG1      VAL 306   8.563   0.915   4.236
  763   HG21  VAL 306          3HG2      VAL 306   5.099   1.707   3.225
  764   HG22  VAL 306          1HG2      VAL 306   5.159   3.406   3.695
  765   HG23  VAL 306          2HG2      VAL 306   5.110   2.151   4.933
  Start of MODEL   30
    1    HA   MET   1           HA       MET   1  -8.639   1.466  -6.949
    2    H1   MET   1           1HT      MET   1  -8.738   2.446  -4.175
    3    H2   MET   1           2HT      MET   1  -8.368   0.863  -4.723
    4    H3   MET   1           3HT      MET   1  -9.954   1.487  -4.909
    5    HB2  MET   1           2HB      MET   1  -9.440   3.614  -7.633
    6    HB3  MET   1           1HB      MET   1 -10.570   2.993  -6.437
    7    HG2  MET   1           2HG      MET   1  -9.517   4.398  -4.729
    8    HG3  MET   1           1HG      MET   1  -8.408   5.030  -5.944
    9    HE1  MET   1           3HE      MET   1  -8.778   6.770  -7.471
   10    HE2  MET   1           1HE      MET   1 -10.300   7.548  -7.907
   11    HE3  MET   1           2HE      MET   1  -9.937   5.927  -8.498
   12    H    GLU   2           H        GLU   2  -7.258   3.157  -8.198
   13    HA   GLU   2           HA       GLU   2  -4.672   3.195  -6.948
   14    HB2  GLU   2           2HB      GLU   2  -3.810   3.820  -9.058
   15    HB3  GLU   2           1HB      GLU   2  -5.123   2.705  -9.395
   16    HG2  GLU   2           2HG      GLU   2  -5.729   5.613  -9.377
   17    HG3  GLU   2           1HG      GLU   2  -4.820   4.953 -10.735
   18    H    ILE   3           H        ILE   3  -3.291   5.111  -6.798
   19    HA   ILE   3           HA       ILE   3  -4.697   7.669  -6.599
   20    HB   ILE   3           HB       ILE   3  -2.991   6.438  -4.417
   21   HG12  ILE   3          2HG1      ILE   3  -5.611   7.595  -3.751
   22   HG13  ILE   3          1HG1      ILE   3  -5.694   6.194  -4.812
   23   HG21  ILE   3          1HG2      ILE   3  -2.320   8.686  -4.509
   24   HG22  ILE   3          2HG2      ILE   3  -3.513   8.608  -3.210
   25   HG23  ILE   3          3HG2      ILE   3  -3.968   9.252  -4.790
   26   HD11  ILE   3          3HD1      ILE   3  -4.059   6.109  -2.316
   27   HD12  ILE   3          1HD1      ILE   3  -4.780   4.783  -3.226
   28   HD13  ILE   3          2HD1      ILE   3  -5.803   5.852  -2.265
   29    H    LYS   4           H        LYS   4  -3.394   9.419  -7.186
   30    HA   LYS   4           HA       LYS   4  -0.700   8.701  -8.125
   31    HB2  LYS   4           2HB      LYS   4  -2.581   9.749  -9.630
   32    HB3  LYS   4           1HB      LYS   4  -2.079  11.255  -8.878
   33    HG2  LYS   4           2HG      LYS   4  -1.007  10.827 -11.060
   34    HG3  LYS   4           1HG      LYS   4   0.144  11.012  -9.739
   35    HD2  LYS   4           2HD      LYS   4   0.275   8.533  -9.582
   36    HD3  LYS   4           1HD      LYS   4  -0.766   8.428 -11.002
   37    HE2  LYS   4           2HE      LYS   4   0.910   8.909 -12.405
   38    HE3  LYS   4           1HE      LYS   4   1.530  10.193 -11.368
   39    HZ1  LYS   4           3HZ      LYS   4   2.149   7.309 -11.309
   40    HZ2  LYS   4           1HZ      LYS   4   2.381   8.261  -9.930
   41    HZ3  LYS   4           2HZ      LYS   4   3.211   8.622 -11.360
   42    H    LEU   5           H        LEU   5   0.379   8.891  -6.220
   43    HA   LEU   5           HA       LEU   5   0.359  11.482  -4.847
   44    HG   LEU   5           HG       LEU   5  -1.051   9.824  -3.376
   45    HB2  LEU   5           2HB      LEU   5   1.136   8.722  -4.073
   46    HB3  LEU   5           1HB      LEU   5   1.952  10.050  -3.271
   47   HD11  LEU   5          1HD1      LEU   5   0.757   8.160  -1.949
   48   HD12  LEU   5          2HD1      LEU   5  -1.004   8.193  -1.880
   49   HD13  LEU   5          3HD1      LEU   5  -0.062   9.215  -0.796
   50   HD21  LEU   5          3HD2      LEU   5   0.696  11.863  -2.560
   51   HD22  LEU   5          1HD2      LEU   5   0.062  11.138  -1.083
   52   HD23  LEU   5          2HD2      LEU   5  -1.046  11.765  -2.302
   53    H    ILE   6           H        ILE   6   1.957  12.904  -4.903
   54    HA   ILE   6           HA       ILE   6   4.280  12.333  -6.562
   55    HB   ILE   6           HB       ILE   6   3.041  14.451  -6.883
   56   HG12  ILE   6          2HG1      ILE   6   5.869  14.871  -5.889
   57   HG13  ILE   6          1HG1      ILE   6   5.444  14.244  -7.478
   58   HG21  ILE   6          1HG2      ILE   6   2.589  14.695  -4.369
   59   HG22  ILE   6          2HG2      ILE   6   2.927  16.156  -5.297
   60   HG23  ILE   6          3HG2      ILE   6   4.187  15.437  -4.295
   61   HD11  ILE   6          3HD1      ILE   6   5.710  16.397  -8.065
   62   HD12  ILE   6          1HD1      ILE   6   5.371  16.997  -6.441
   63   HD13  ILE   6          2HD1      ILE   6   4.043  16.530  -7.504
   64    H    LYS   7           H        LYS   7   6.269  11.922  -5.795
   65    HA   LYS   7           HA       LYS   7   6.750  11.373  -3.102
   66    HB2  LYS   7           2HB      LYS   7   8.070  10.409  -4.934
   67    HB3  LYS   7           1HB      LYS   7   8.767  11.989  -5.263
   68    HG2  LYS   7           2HG      LYS   7  10.394  10.833  -4.034
   69    HG3  LYS   7           1HG      LYS   7   9.645  11.942  -2.884
   70    HD2  LYS   7           2HD      LYS   7   8.143  10.015  -2.213
   71    HD3  LYS   7           1HD      LYS   7   9.209   8.976  -3.159
   72    HE2  LYS   7           2HE      LYS   7  11.113   9.942  -1.767
   73    HE3  LYS   7           1HE      LYS   7   9.863  10.588  -0.706
   74    HZ1  LYS   7           3HZ      LYS   7   9.022   8.211  -0.588
   75    HZ2  LYS   7           1HZ      LYS   7  10.470   8.547   0.223
   76    HZ3  LYS   7           2HZ      LYS   7  10.500   7.754  -1.271
   77    H    GLY   8           H        GLY   8   7.067  12.641  -1.412
   78    HA2  GLY   8           2HA      GLY   8   7.884  15.439  -1.872
   79    HA3  GLY   8           1HA      GLY   8   6.969  14.867  -0.484
   80    HA   PRO   9           HA       PRO   9  11.290  15.358   1.028
   81    HB2  PRO   9           2HB      PRO   9   9.896  15.584   3.622
   82    HB3  PRO   9           1HB      PRO   9  11.065  16.673   2.875
   83    HG2  PRO   9           2HG      PRO   9   8.464  17.309   3.059
   84    HG3  PRO   9           1HG      PRO   9   9.452  17.799   1.671
   85    HD2  PRO   9           2HD      PRO   9   7.471  15.565   1.896
   86    HD3  PRO   9           1HD      PRO   9   7.755  16.689   0.549
   87    H    LYS  10           H        LYS  10   9.207  13.939   3.561
   88    HA   LYS  10           HA       LYS  10  10.972  11.833   4.104
   89    HB2  LYS  10           2HB      LYS  10   8.047  12.228   4.731
   90    HB3  LYS  10           1HB      LYS  10   8.941  10.815   5.277
   91    HG2  LYS  10           2HG      LYS  10  10.507  12.295   6.467
   92    HG3  LYS  10           1HG      LYS  10   9.542  13.684   5.965
   93    HD2  LYS  10           2HD      LYS  10   8.047  13.342   7.587
   94    HD3  LYS  10           1HD      LYS  10   7.917  11.624   7.205
   95    HE2  LYS  10           2HE      LYS  10  10.290  12.703   8.687
   96    HE3  LYS  10           1HE      LYS  10   8.791  12.322   9.533
   97    HZ1  LYS  10           3HZ      LYS  10  10.310  10.457   9.589
   98    HZ2  LYS  10           1HZ      LYS  10  10.397  10.429   7.899
   99    HZ3  LYS  10           2HZ      LYS  10   8.942  10.055   8.678
  100    H    GLY  11           H        GLY  11   7.710  11.523   2.657
  101    HA2  GLY  11           2HA      GLY  11   8.178  10.256   0.348
  102    HA3  GLY  11           1HA      GLY  11   8.481   8.968   1.501
  103    H    LEU  12           H        LEU  12   6.809   7.839   2.298
  104    HA   LEU  12           HA       LEU  12   4.192   8.384   1.173
  105    HG   LEU  12           HG       LEU  12   3.642   5.859   0.184
  106    HB2  LEU  12           2HB      LEU  12   5.461   6.058   2.548
  107    HB3  LEU  12           1HB      LEU  12   3.716   6.157   2.483
  108   HD11  LEU  12          1HD1      LEU  12   5.622   6.103  -1.295
  109   HD12  LEU  12          2HD1      LEU  12   6.527   6.719   0.086
  110   HD13  LEU  12          3HD1      LEU  12   5.127   7.606  -0.518
  111   HD21  LEU  12          3HD2      LEU  12   4.517   3.871   1.415
  112   HD22  LEU  12          1HD2      LEU  12   6.138   4.345   0.909
  113   HD23  LEU  12          2HD2      LEU  12   4.928   3.914  -0.299
  114    H    GLY  13           H        GLY  13   5.585   7.996   4.438
  115    HA2  GLY  13           2HA      GLY  13   4.916   9.016   6.407
  116    HA3  GLY  13           1HA      GLY  13   3.649   9.839   5.516
  117    H    PHE  14           H        PHE  14   4.216   6.351   5.764
  118    HA   PHE  14           HA       PHE  14   2.184   5.910   7.705
  119    HD1  PHE  14           2HD      PHE  14   2.127   3.107   4.833
  120    HD2  PHE  14           1HD      PHE  14   0.861   6.997   3.663
  121    HE1  PHE  14           2HE      PHE  14   2.504   2.516   2.478
  122    HE2  PHE  14           1HE      PHE  14   1.232   6.411   1.302
  123    HZ   PHE  14           HZ       PHE  14   2.055   4.167   0.707
  124    HB2  PHE  14           2HB      PHE  14   0.599   4.674   6.270
  125    HB3  PHE  14           1HB      PHE  14   0.675   6.380   5.868
  126    H    SER  15           H        SER  15   1.549   3.271   7.318
  127    HA   SER  15           HA       SER  15   4.135   1.944   6.952
  128    HG   SER  15           HG       SER  15   2.286   2.942   9.707
  129    HB2  SER  15           2HB      SER  15   3.107   0.386   8.864
  130    HB3  SER  15           1HB      SER  15   4.099   1.788   9.243
  131    H    ILE  16           H        ILE  16   3.746  -0.542   6.910
  132    HA   ILE  16           HA       ILE  16   1.200  -1.379   5.817
  133    HB   ILE  16           HB       ILE  16   1.829  -1.946   3.663
  134   HG12  ILE  16          2HG1      ILE  16   4.023  -2.985   4.341
  135   HG13  ILE  16          1HG1      ILE  16   4.006  -2.197   2.768
  136   HG21  ILE  16          1HG2      ILE  16   2.791   0.049   2.591
  137   HG22  ILE  16          2HG2      ILE  16   3.239   0.655   4.186
  138   HG23  ILE  16          3HG2      ILE  16   1.538   0.435   3.771
  139   HD11  ILE  16          3HD1      ILE  16   5.618  -0.815   3.355
  140   HD12  ILE  16          1HD1      ILE  16   5.832  -1.812   4.795
  141   HD13  ILE  16          2HD1      ILE  16   4.800  -0.382   4.856
  142    H    ALA  17           H        ALA  17   1.392  -3.698   5.065
  143    HA   ALA  17           HA       ALA  17   3.457  -5.252   6.428
  144    HB1  ALA  17           3HB      ALA  17   1.221  -6.789   6.841
  145    HB2  ALA  17           1HB      ALA  17   0.624  -5.158   7.157
  146    HB3  ALA  17           2HB      ALA  17   2.003  -5.784   8.060
  147    H    GLY  18           H        GLY  18   3.285  -7.650   5.523
  148    HA2  GLY  18           2HA      GLY  18   1.796  -8.308   3.334
  149    HA3  GLY  18           1HA      GLY  18   3.075  -7.337   2.651
  150    H    GLY  19           H        GLY  19   2.168 -10.415   2.798
  151    HA2  GLY  19           2HA      GLY  19   3.661 -12.055   1.908
  152    HA3  GLY  19           1HA      GLY  19   4.969 -11.306   2.804
  153    H    VAL  20           H        VAL  20   4.456 -14.047   2.792
  154    HA   VAL  20           HA       VAL  20   2.951 -14.918   5.020
  155    HB   VAL  20           HB       VAL  20   3.688 -16.407   3.154
  156   HG11  VAL  20          1HG1      VAL  20   5.879 -17.251   2.991
  157   HG12  VAL  20          2HG1      VAL  20   6.344 -16.571   4.551
  158   HG13  VAL  20          3HG1      VAL  20   6.064 -15.506   3.174
  159   HG21  VAL  20          3HG2      VAL  20   4.493 -17.355   5.903
  160   HG22  VAL  20          1HG2      VAL  20   4.040 -18.372   4.535
  161   HG23  VAL  20          2HG2      VAL  20   2.844 -17.310   5.278
  162    H    GLY  21           H        GLY  21   3.531 -15.349   7.140
  163    HA2  GLY  21           2HA      GLY  21   4.889 -15.425   9.041
  164    HA3  GLY  21           1HA      GLY  21   6.269 -15.002   8.039
  165    H    ASN  22           H        ASN  22   4.591 -12.676   6.976
  166    HA   ASN  22           HA       ASN  22   4.643 -10.908   9.308
  167    HB2  ASN  22           2HB      ASN  22   5.553  -9.176   7.481
  168    HB3  ASN  22           1HB      ASN  22   6.643 -10.130   8.467
  169   HD21  ASN  22          1HD2      ASN  22   4.795 -10.553   5.455
  170   HD22  ASN  22          2HD2      ASN  22   6.104 -11.245   4.566
  171    H    GLN  23           H        GLN  23   2.545 -12.239   7.492
  172    HA   GLN  23           HA       GLN  23   1.325 -10.329   5.878
  173    HB2  GLN  23           2HB      GLN  23  -0.765 -11.758   6.257
  174    HB3  GLN  23           1HB      GLN  23   0.634 -12.534   5.535
  175    HG2  GLN  23           2HG      GLN  23  -0.168 -14.082   7.073
  176    HG3  GLN  23           1HG      GLN  23   1.199 -13.334   7.890
  177   HE21  GLN  23          1HE2      GLN  23  -2.319 -13.127   7.574
  178   HE22  GLN  23          2HE2      GLN  23  -2.609 -12.633   9.204
  179    H    HIS  24           H        HIS  24  -0.462  -9.034   6.118
  180    HA   HIS  24           HA       HIS  24  -0.727  -7.805   8.734
  181    HD1  HIS  24           1HD      HIS  24  -0.329  -4.995   8.826
  182    HD2  HIS  24           2HD      HIS  24  -4.078  -5.522   7.131
  183    HE1  HIS  24           1HE      HIS  24  -1.747  -3.180   9.784
  184    HE2  HIS  24           2HE      HIS  24  -3.989  -3.430   8.662
  185    HB2  HIS  24           2HB      HIS  24  -0.453  -6.486   6.605
  186    HB3  HIS  24           1HB      HIS  24  -2.062  -7.000   6.150
  187    H    ILE  25           H        ILE  25  -2.581  -9.961   6.744
  188    HA   ILE  25           HA       ILE  25  -4.678  -9.986   8.762
  189    HB   ILE  25           HB       ILE  25  -5.438  -9.638   5.863
  190   HG12  ILE  25          2HG1      ILE  25  -5.359  -7.576   8.076
  191   HG13  ILE  25          1HG1      ILE  25  -4.392  -7.574   6.606
  192   HG21  ILE  25          1HG2      ILE  25  -7.664  -9.133   6.874
  193   HG22  ILE  25          2HG2      ILE  25  -7.005  -9.627   8.433
  194   HG23  ILE  25          3HG2      ILE  25  -7.114 -10.792   7.113
  195   HD11  ILE  25          3HD1      ILE  25  -6.590  -7.438   5.347
  196   HD12  ILE  25          1HD1      ILE  25  -6.085  -6.006   6.244
  197   HD13  ILE  25          2HD1      ILE  25  -7.329  -7.067   6.905
  198    HA   PRO  26           HA       PRO  26  -4.205 -14.366   8.126
  199    HB2  PRO  26           2HB      PRO  26  -7.041 -14.395   9.043
  200    HB3  PRO  26           1HB      PRO  26  -5.657 -15.323   9.632
  201    HG2  PRO  26           2HG      PRO  26  -6.599 -13.260  11.024
  202    HG3  PRO  26           1HG      PRO  26  -4.855 -13.564  10.913
  203    HD2  PRO  26           2HD      PRO  26  -6.515 -11.508   9.529
  204    HD3  PRO  26           1HD      PRO  26  -4.854 -11.395  10.142
  205    H    GLY  27           H        GLY  27  -4.334 -15.365   6.223
  206    HA2  GLY  27           2HA      GLY  27  -5.616 -16.487   4.542
  207    HA3  GLY  27           1HA      GLY  27  -6.870 -15.271   4.731
  208    H    ASP  28           H        ASP  28  -5.639 -12.917   4.433
  209    HA   ASP  28           HA       ASP  28  -4.738 -13.017   1.652
  210    HB2  ASP  28           2HB      ASP  28  -6.415 -11.258   3.134
  211    HB3  ASP  28           1HB      ASP  28  -5.012 -10.333   2.612
  212    H    ASN  29           H        ASN  29  -2.600 -13.135   1.353
  213    HA   ASN  29           HA       ASN  29  -0.780 -12.010   3.329
  214    HB2  ASN  29           2HB      ASN  29  -0.345 -13.749   0.906
  215    HB3  ASN  29           1HB      ASN  29   0.985 -13.073   1.846
  216   HD21  ASN  29          1HD2      ASN  29  -1.738 -15.270   1.901
  217   HD22  ASN  29          2HD2      ASN  29  -1.226 -16.169   3.285
  218    H    SER  30           H        SER  30  -2.439 -10.418   1.244
  219    HA   SER  30           HA       SER  30  -0.554  -9.181  -0.493
  220    HG   SER  30           HG       SER  30  -4.298  -9.278  -0.307
  221    HB2  SER  30           2HB      SER  30  -3.039  -7.761   0.391
  222    HB3  SER  30           1HB      SER  30  -2.303  -7.834  -1.207
  223    H    ILE  31           H        ILE  31  -0.581  -6.566  -0.298
  224    HA   ILE  31           HA       ILE  31   0.657  -6.086   2.315
  225    HB   ILE  31           HB       ILE  31   1.013  -4.743  -0.334
  226   HG12  ILE  31          2HG1      ILE  31   3.381  -5.026   0.165
  227   HG13  ILE  31          1HG1      ILE  31   2.995  -5.635   1.767
  228   HG21  ILE  31          1HG2      ILE  31   2.418  -3.027   0.954
  229   HG22  ILE  31          2HG2      ILE  31   1.453  -3.497   2.351
  230   HG23  ILE  31          3HG2      ILE  31   0.668  -2.815   0.928
  231   HD11  ILE  31          3HD1      ILE  31   1.605  -7.335   0.126
  232   HD12  ILE  31          1HD1      ILE  31   3.183  -7.650   0.841
  233   HD13  ILE  31          2HD1      ILE  31   3.067  -7.006  -0.796
  234    H    TYR  32           H        TYR  32  -0.484  -5.131   3.832
  235    HA   TYR  32           HA       TYR  32  -2.623  -3.255   3.049
  236    HD1  TYR  32           2HD      TYR  32  -2.406  -6.771   3.262
  237    HD2  TYR  32           1HD      TYR  32  -5.708  -4.344   4.391
  238    HE1  TYR  32           2HE      TYR  32  -3.907  -8.248   1.999
  239    HE2  TYR  32           1HE      TYR  32  -7.230  -5.805   3.143
  240    HH   TYR  32           HH       TYR  32  -6.213  -8.016   0.883
  241    HB2  TYR  32           2HB      TYR  32  -2.456  -5.179   5.365
  242    HB3  TYR  32           1HB      TYR  32  -3.644  -3.885   5.287
  243    H    VAL  33           H        VAL  33  -2.870  -1.351   4.214
  244    HA   VAL  33           HA       VAL  33  -0.516  -0.267   5.409
  245    HB   VAL  33           HB       VAL  33  -3.317   0.826   5.131
  246   HG11  VAL  33          1HG1      VAL  33  -0.901   2.091   6.409
  247   HG12  VAL  33          2HG1      VAL  33  -2.500   1.848   7.111
  248   HG13  VAL  33          3HG1      VAL  33  -2.277   3.020   5.815
  249   HG21  VAL  33          3HG2      VAL  33  -0.897   0.853   3.516
  250   HG22  VAL  33          1HG2      VAL  33  -1.544   2.468   3.805
  251   HG23  VAL  33          2HG2      VAL  33  -2.561   1.231   3.069
  252    H    THR  34           H        THR  34  -0.075   0.148   7.535
  253    HA   THR  34           HA       THR  34  -1.866  -1.146   9.484
  254    HB   THR  34           HB       THR  34  -0.086  -2.032  10.587
  255    HG1  THR  34           1HG      THR  34   1.392  -0.748  11.286
  256   HG21  THR  34          3HG2      THR  34   0.225  -2.922   8.384
  257   HG22  THR  34          1HG2      THR  34   1.801  -2.608   9.108
  258   HG23  THR  34          2HG2      THR  34   1.152  -1.504   7.899
  259    H    LYS  35           H        LYS  35   0.025   1.781   8.910
  260    HA   LYS  35           HA       LYS  35  -1.586   3.213  10.835
  261    HB2  LYS  35           2HB      LYS  35   1.300   2.587  11.348
  262    HB3  LYS  35           1HB      LYS  35   0.649   4.125  11.885
  263    HG2  LYS  35           2HG      LYS  35  -0.475   1.442  12.652
  264    HG3  LYS  35           1HG      LYS  35   0.668   2.368  13.623
  265    HD2  LYS  35           2HD      LYS  35  -0.937   4.205  13.778
  266    HD3  LYS  35           1HD      LYS  35  -2.078   3.301  12.781
  267    HE2  LYS  35           2HE      LYS  35  -2.238   1.576  14.475
  268    HE3  LYS  35           1HE      LYS  35  -1.019   2.389  15.455
  269    HZ1  LYS  35           3HZ      LYS  35  -2.511   4.254  15.731
  270    HZ2  LYS  35           1HZ      LYS  35  -3.274   2.831  16.236
  271    HZ3  LYS  35           2HZ      LYS  35  -3.673   3.521  14.744
  272    H    ILE  36           H        ILE  36  -2.061   5.094   9.880
  273    HA   ILE  36           HA       ILE  36  -0.237   6.150   7.854
  274    HB   ILE  36           HB       ILE  36  -3.044   7.046   8.525
  275   HG12  ILE  36          2HG1      ILE  36  -1.926   5.090   6.536
  276   HG13  ILE  36          1HG1      ILE  36  -3.314   4.911   7.602
  277   HG21  ILE  36          1HG2      ILE  36  -2.955   8.410   6.587
  278   HG22  ILE  36          2HG2      ILE  36  -1.424   7.703   6.074
  279   HG23  ILE  36          3HG2      ILE  36  -1.481   8.743   7.495
  280   HD11  ILE  36          3HD1      ILE  36  -4.457   6.666   6.194
  281   HD12  ILE  36          1HD1      ILE  36  -4.167   5.107   5.422
  282   HD13  ILE  36          2HD1      ILE  36  -3.123   6.480   5.053
  283    H    ILE  37           H        ILE  37   1.192   7.666   8.417
  284    HA   ILE  37           HA       ILE  37   1.068   9.018  10.935
  285    HB   ILE  37           HB       ILE  37   2.970   9.101   8.610
  286   HG12  ILE  37          2HG1      ILE  37   4.546   8.491  10.564
  287   HG13  ILE  37          1HG1      ILE  37   3.070   8.185  11.473
  288   HG21  ILE  37          1HG2      ILE  37   4.384  10.636  10.055
  289   HG22  ILE  37          2HG2      ILE  37   2.902  10.988  10.943
  290   HG23  ILE  37          3HG2      ILE  37   3.011  11.365   9.224
  291   HD11  ILE  37          3HD1      ILE  37   4.006   6.149  10.509
  292   HD12  ILE  37          1HD1      ILE  37   3.843   6.840   8.896
  293   HD13  ILE  37          2HD1      ILE  37   2.406   6.502   9.861
  294    H    GLU  38           H        GLU  38   0.729  11.204  11.353
  295    HA   GLU  38           HA       GLU  38  -1.204  12.544   9.843
  296    HB2  GLU  38           2HB      GLU  38  -0.477  12.889  12.317
  297    HB3  GLU  38           1HB      GLU  38   0.689  14.023  11.651
  298    HG2  GLU  38           2HG      GLU  38  -0.956  15.486  10.930
  299    HG3  GLU  38           1HG      GLU  38  -2.211  14.248  10.961
  300    H    GLY  39           H        GLY  39  -1.141  14.276   8.421
  301    HA2  GLY  39           2HA      GLY  39  -0.333  15.562   6.709
  302    HA3  GLY  39           1HA      GLY  39   1.116  15.744   7.681
  303    H    GLY  40           H        GLY  40   0.179  12.535   6.726
  304    HA2  GLY  40           2HA      GLY  40   2.585  12.348   5.090
  305    HA3  GLY  40           1HA      GLY  40   1.599  11.007   5.650
  306    H    ALA  41           H        ALA  41   2.475  10.988   3.091
  307    HA   ALA  41           HA       ALA  41   1.057  12.188   1.081
  308    HB1  ALA  41           3HB      ALA  41   1.770   9.272   0.958
  309    HB2  ALA  41           1HB      ALA  41   2.991  10.544   0.904
  310    HB3  ALA  41           2HB      ALA  41   1.752  10.456  -0.348
  311    H    ALA  42           H        ALA  42   0.153   9.099   2.661
  312    HA   ALA  42           HA       ALA  42  -2.322   8.879   1.269
  313    HB1  ALA  42           3HB      ALA  42  -1.355   6.873   2.080
  314    HB2  ALA  42           1HB      ALA  42  -2.824   7.136   3.022
  315    HB3  ALA  42           2HB      ALA  42  -1.249   7.505   3.724
  316    H    HIS  43           H        HIS  43  -1.530   9.800   4.625
  317    HA   HIS  43           HA       HIS  43  -4.038  10.292   5.625
  318    HD1  HIS  43           1HD      HIS  43  -2.884  14.037   6.868
  319    HD2  HIS  43           2HD      HIS  43  -3.860  10.586   8.968
  320    HE1  HIS  43           1HE      HIS  43  -4.190  14.816   8.867
  321    HE2  HIS  43           2HE      HIS  43  -4.718  12.718  10.159
  322    HB2  HIS  43           2HB      HIS  43  -1.948  10.419   6.937
  323    HB3  HIS  43           1HB      HIS  43  -1.553  11.936   6.144
  324    H    LYS  44           H        LYS  44  -1.999  12.555   3.789
  325    HA   LYS  44           HA       LYS  44  -3.877  14.696   3.861
  326    HB2  LYS  44           2HB      LYS  44  -1.450  14.172   2.148
  327    HB3  LYS  44           1HB      LYS  44  -2.417  15.634   2.012
  328    HG2  LYS  44           2HG      LYS  44  -1.907  16.236   4.291
  329    HG3  LYS  44           1HG      LYS  44  -1.041  14.718   4.529
  330    HD2  LYS  44           2HD      LYS  44   0.776  15.930   3.996
  331    HD3  LYS  44           1HD      LYS  44   0.223  15.705   2.336
  332    HE2  LYS  44           2HE      LYS  44  -0.673  18.024   4.027
  333    HE3  LYS  44           1HE      LYS  44   0.801  18.080   3.064
  334    HZ1  LYS  44           3HZ      LYS  44  -1.988  17.800   2.112
  335    HZ2  LYS  44           1HZ      LYS  44  -0.660  17.455   1.121
  336    HZ3  LYS  44           2HZ      LYS  44  -0.873  19.015   1.739
  337    H    ASP  45           H        ASP  45  -3.209  12.094   1.565
  338    HA   ASP  45           HA       ASP  45  -4.762  13.059  -0.575
  339    HB2  ASP  45           2HB      ASP  45  -3.067  11.039  -0.401
  340    HB3  ASP  45           1HB      ASP  45  -4.531  10.118  -0.076
  341    H    GLY  46           H        GLY  46  -5.586  10.666   1.952
  342    HA2  GLY  46           2HA      GLY  46  -7.669  10.559   3.065
  343    HA3  GLY  46           1HA      GLY  46  -8.379  11.528   1.785
  344    H    LYS  47           H        LYS  47  -7.089   9.710  -0.269
  345    HA   LYS  47           HA       LYS  47  -9.292   7.956  -0.602
  346    HB2  LYS  47           2HB      LYS  47  -6.680   8.331  -2.026
  347    HB3  LYS  47           1HB      LYS  47  -7.695   6.949  -2.408
  348    HG2  LYS  47           2HG      LYS  47  -9.456   8.323  -3.168
  349    HG3  LYS  47           1HG      LYS  47  -8.717   9.772  -2.484
  350    HD2  LYS  47           2HD      LYS  47  -7.179   9.953  -4.177
  351    HD3  LYS  47           1HD      LYS  47  -7.177   8.220  -4.506
  352    HE2  LYS  47           2HE      LYS  47  -9.361   8.396  -5.557
  353    HE3  LYS  47           1HE      LYS  47  -9.426  10.117  -5.175
  354    HZ1  LYS  47           3HZ      LYS  47  -8.760   9.674  -7.481
  355    HZ2  LYS  47           1HZ      LYS  47  -7.387   8.853  -6.929
  356    HZ3  LYS  47           2HZ      LYS  47  -7.564  10.507  -6.623
  357    H    LEU  48           H        LEU  48  -5.987   7.490   0.588
  358    HA   LEU  48           HA       LEU  48  -6.423   4.632   0.906
  359    HG   LEU  48           HG       LEU  48  -4.506   3.337   0.808
  360    HB2  LEU  48           2HB      LEU  48  -4.218   5.845   0.198
  361    HB3  LEU  48           1HB      LEU  48  -4.009   6.081   1.923
  362   HD11  LEU  48          1HD1      LEU  48  -2.593   4.377  -0.401
  363   HD12  LEU  48          2HD1      LEU  48  -2.154   2.971   0.571
  364   HD13  LEU  48          3HD1      LEU  48  -1.791   4.595   1.155
  365   HD21  LEU  48          3HD2      LEU  48  -4.370   4.266   3.361
  366   HD22  LEU  48          1HD2      LEU  48  -2.705   3.763   3.078
  367   HD23  LEU  48          2HD2      LEU  48  -4.024   2.610   2.867
  368    H    GLN  49           H        GLN  49  -7.162   3.722   2.683
  369    HA   GLN  49           HA       GLN  49  -6.854   5.083   5.264
  370    HB2  GLN  49           2HB      GLN  49  -9.101   4.548   5.897
  371    HB3  GLN  49           1HB      GLN  49  -9.168   5.390   4.361
  372    HG2  GLN  49           2HG      GLN  49  -9.226   2.395   4.538
  373    HG3  GLN  49           1HG      GLN  49 -10.684   3.373   4.674
  374   HE21  GLN  49          1HE2      GLN  49  -8.699   1.734   2.580
  375   HE22  GLN  49          2HE2      GLN  49  -9.222   2.444   1.094
  376    H    ILE  50           H        ILE  50  -6.484   3.731   7.025
  377    HA   ILE  50           HA       ILE  50  -5.081   1.403   6.688
  378    HB   ILE  50           HB       ILE  50  -5.687   0.826   9.063
  379   HG12  ILE  50          2HG1      ILE  50  -6.823   3.308   9.839
  380   HG13  ILE  50          1HG1      ILE  50  -7.810   2.685   8.520
  381   HG21  ILE  50          1HG2      ILE  50  -4.788   3.664   8.592
  382   HG22  ILE  50          2HG2      ILE  50  -3.764   2.234   8.461
  383   HG23  ILE  50          3HG2      ILE  50  -4.461   2.679  10.019
  384   HD11  ILE  50          3HD1      ILE  50  -7.169   1.318  11.119
  385   HD12  ILE  50          1HD1      ILE  50  -8.000   0.543   9.771
  386   HD13  ILE  50          2HD1      ILE  50  -8.733   1.928  10.579
  387    H    GLY  51           H        GLY  51  -5.551  -0.611   6.048
  388    HA2  GLY  51           2HA      GLY  51  -6.989  -2.582   6.510
  389    HA3  GLY  51           1HA      GLY  51  -8.357  -1.519   6.250
  390    H    ASP  52           H        ASP  52  -6.747  -0.231   3.939
  391    HA   ASP  52           HA       ASP  52  -7.853  -1.868   1.915
  392    HB2  ASP  52           2HB      ASP  52  -6.542  -0.275   0.379
  393    HB3  ASP  52           1HB      ASP  52  -7.811   0.408   1.382
  394    H    LYS  53           H        LYS  53  -6.639  -2.812   0.100
  395    HA   LYS  53           HA       LYS  53  -4.087  -3.941   1.040
  396    HB2  LYS  53           2HB      LYS  53  -4.569  -5.829  -0.533
  397    HB3  LYS  53           1HB      LYS  53  -5.681  -5.696   0.816
  398    HG2  LYS  53           2HG      LYS  53  -6.596  -4.240  -1.524
  399    HG3  LYS  53           1HG      LYS  53  -6.361  -5.962  -1.830
  400    HD2  LYS  53           2HD      LYS  53  -7.620  -5.900   0.632
  401    HD3  LYS  53           1HD      LYS  53  -8.410  -4.607  -0.272
  402    HE2  LYS  53           2HE      LYS  53  -9.685  -6.493  -0.772
  403    HE3  LYS  53           1HE      LYS  53  -8.619  -6.327  -2.167
  404    HZ1  LYS  53           3HZ      LYS  53  -8.249  -8.196   0.113
  405    HZ2  LYS  53           1HZ      LYS  53  -7.162  -8.008  -1.170
  406    HZ3  LYS  53           2HZ      LYS  53  -8.715  -8.612  -1.458
  407    H    LEU  54           H        LEU  54  -2.414  -4.148  -0.347
  408    HA   LEU  54           HA       LEU  54  -2.436  -2.248  -2.563
  409    HG   LEU  54           HG       LEU  54  -1.099  -0.702  -1.426
  410    HB2  LEU  54           2HB      LEU  54  -0.470  -3.070  -0.648
  411    HB3  LEU  54           1HB      LEU  54   0.163  -3.300  -2.268
  412   HD11  LEU  54          1HD1      LEU  54   0.583  -0.369  -0.010
  413   HD12  LEU  54          2HD1      LEU  54   1.630  -0.286  -1.428
  414   HD13  LEU  54          3HD1      LEU  54   1.437  -1.809  -0.561
  415   HD21  LEU  54          3HD2      LEU  54   0.700  -0.021  -3.232
  416   HD22  LEU  54          1HD2      LEU  54  -0.896  -0.608  -3.697
  417   HD23  LEU  54          2HD2      LEU  54   0.489  -1.698  -3.733
  418    H    LEU  55           H        LEU  55  -3.209  -3.094  -4.345
  419    HA   LEU  55           HA       LEU  55  -2.858  -5.785  -5.170
  420    HG   LEU  55           HG       LEU  55  -2.976  -5.237  -8.203
  421    HB2  LEU  55           2HB      LEU  55  -4.772  -4.473  -5.903
  422    HB3  LEU  55           1HB      LEU  55  -3.714  -3.329  -6.705
  423   HD11  LEU  55          1HD1      LEU  55  -3.588  -7.185  -7.108
  424   HD12  LEU  55          2HD1      LEU  55  -4.826  -7.029  -8.355
  425   HD13  LEU  55          3HD1      LEU  55  -5.187  -6.569  -6.691
  426   HD21  LEU  55          3HD2      LEU  55  -4.386  -3.645  -9.173
  427   HD22  LEU  55          1HD2      LEU  55  -5.767  -4.134  -8.190
  428   HD23  LEU  55          2HD2      LEU  55  -5.191  -5.183  -9.486
  429    H    ALA  56           H        ALA  56  -1.440  -2.686  -6.290
  430    HA   ALA  56           HA       ALA  56   1.011  -4.126  -6.966
  431    HB1  ALA  56           3HB      ALA  56   0.971  -2.994  -9.296
  432    HB2  ALA  56           1HB      ALA  56  -0.765  -2.841  -9.029
  433    HB3  ALA  56           2HB      ALA  56  -0.017  -4.437  -9.055
  434    H    VAL  57           H        VAL  57   2.835  -2.765  -7.315
  435    HA   VAL  57           HA       VAL  57   2.455   0.075  -6.616
  436    HB   VAL  57           HB       VAL  57   4.649  -1.717  -5.553
  437   HG11  VAL  57          1HG1      VAL  57   5.047   0.398  -4.118
  438   HG12  VAL  57          2HG1      VAL  57   4.175   1.237  -5.399
  439   HG13  VAL  57          3HG1      VAL  57   5.661   0.363  -5.771
  440   HG21  VAL  57          3HG2      VAL  57   2.312  -0.414  -4.160
  441   HG22  VAL  57          1HG2      VAL  57   3.628  -1.271  -3.358
  442   HG23  VAL  57          2HG2      VAL  57   2.538  -2.141  -4.438
  443    H    ASN  58           H        ASN  58   2.935   1.107  -8.459
  444    HA   ASN  58           HA       ASN  58   4.074   1.882 -10.257
  445    HB2  ASN  58           2HB      ASN  58   6.400   0.738  -8.705
  446    HB3  ASN  58           1HB      ASN  58   6.589   1.690 -10.173
  447   HD21  ASN  58          1HD2      ASN  58   6.434   3.869 -10.076
  448   HD22  ASN  58          2HD2      ASN  58   6.145   4.756  -8.623
  449    H    ASN  59           H        ASN  59   2.745  -0.372 -10.811
  450    HA   ASN  59           HA       ASN  59   2.542  -1.751 -12.636
  451    HB2  ASN  59           2HB      ASN  59   4.654  -0.395 -13.473
  452    HB3  ASN  59           1HB      ASN  59   5.474  -1.919 -13.144
  453   HD21  ASN  59          1HD2      ASN  59   5.473  -3.384 -14.704
  454   HD22  ASN  59          2HD2      ASN  59   4.412  -3.406 -16.067
  455    H    VAL  60           H        VAL  60   4.647  -2.368  -9.971
  456    HA   VAL  60           HA       VAL  60   4.818  -5.223 -10.574
  457    HB   VAL  60           HB       VAL  60   6.317  -5.458  -8.787
  458   HG11  VAL  60          1HG1      VAL  60   7.165  -2.694  -9.370
  459   HG12  VAL  60          2HG1      VAL  60   6.902  -3.739 -10.766
  460   HG13  VAL  60          3HG1      VAL  60   8.053  -4.211  -9.515
  461   HG21  VAL  60          3HG2      VAL  60   5.694  -4.562  -6.838
  462   HG22  VAL  60          1HG2      VAL  60   4.842  -3.232  -7.617
  463   HG23  VAL  60          2HG2      VAL  60   6.582  -3.133  -7.360
  464    H    CYS  61           H        CYS  61   3.910  -6.846  -9.172
  465    HA   CYS  61           HA       CYS  61   1.443  -5.939  -7.922
  466    HG   CYS  61           HG       CYS  61   3.529  -9.212  -7.736
  467    HB2  CYS  61           2HB      CYS  61   0.884  -8.324  -7.735
  468    HB3  CYS  61           1HB      CYS  61   1.294  -7.869  -9.382
  469    H    LEU  62           H        LEU  62   1.114  -5.741  -5.800
  470    HA   LEU  62           HA       LEU  62   3.260  -6.602  -3.996
  471    HG   LEU  62           HG       LEU  62   3.250  -5.275  -1.696
  472    HB2  LEU  62           2HB      LEU  62   2.152  -4.144  -4.274
  473    HB3  LEU  62           1HB      LEU  62   1.173  -4.794  -2.974
  474   HD11  LEU  62          1HD1      LEU  62   4.896  -5.530  -3.361
  475   HD12  LEU  62          2HD1      LEU  62   5.316  -4.049  -2.503
  476   HD13  LEU  62          3HD1      LEU  62   4.528  -3.962  -4.077
  477   HD21  LEU  62          3HD2      LEU  62   3.831  -2.555  -1.898
  478   HD22  LEU  62          1HD2      LEU  62   2.713  -3.330  -0.778
  479   HD23  LEU  62          2HD2      LEU  62   2.124  -2.701  -2.315
  480    H    GLU  63           H        GLU  63   1.219  -8.409  -5.012
  481    HA   GLU  63           HA       GLU  63  -0.261  -9.019  -2.542
  482    HB2  GLU  63           2HB      GLU  63  -1.219  -8.690  -5.112
  483    HB3  GLU  63           1HB      GLU  63  -1.120 -10.438  -4.947
  484    HG2  GLU  63           2HG      GLU  63  -3.047 -10.405  -3.874
  485    HG3  GLU  63           1HG      GLU  63  -2.273  -9.505  -2.573
  486    H    GLU  64           H        GLU  64   2.185 -10.192  -4.689
  487    HA   GLU  64           HA       GLU  64   2.142 -12.778  -3.284
  488    HB2  GLU  64           2HB      GLU  64   2.028 -12.236  -6.094
  489    HB3  GLU  64           1HB      GLU  64   3.489 -13.137  -5.730
  490    HG2  GLU  64           2HG      GLU  64   2.004 -14.830  -6.122
  491    HG3  GLU  64           1HG      GLU  64   1.870 -14.662  -4.373
  492    H    VAL  65           H        VAL  65   3.541 -10.675  -2.207
  493    HA   VAL  65           HA       VAL  65   6.309 -11.593  -2.566
  494    HB   VAL  65           HB       VAL  65   7.135  -9.253  -2.303
  495   HG11  VAL  65          1HG1      VAL  65   7.054 -10.402  -4.486
  496   HG12  VAL  65          2HG1      VAL  65   6.860  -8.656  -4.631
  497   HG13  VAL  65          3HG1      VAL  65   5.456  -9.713  -4.768
  498   HG21  VAL  65          3HG2      VAL  65   5.519  -7.442  -2.985
  499   HG22  VAL  65          1HG2      VAL  65   5.266  -8.123  -1.378
  500   HG23  VAL  65          2HG2      VAL  65   4.221  -8.605  -2.716
  501    H    THR  66           H        THR  66   7.734 -11.121  -0.810
  502    HA   THR  66           HA       THR  66   6.530 -11.518   1.747
  503    HB   THR  66           HB       THR  66   9.264 -10.651   1.987
  504    HG1  THR  66           1HG      THR  66   9.943 -11.227   0.083
  505   HG21  THR  66          3HG2      THR  66   9.679 -12.826   2.836
  506   HG22  THR  66          1HG2      THR  66   8.215 -13.463   2.086
  507   HG23  THR  66          2HG2      THR  66   8.095 -12.315   3.420
  508    H    HIS  67           H        HIS  67   7.934  -9.941   3.529
  509    HA   HIS  67           HA       HIS  67   6.526  -7.458   3.201
  510    HD1  HIS  67           1HD      HIS  67   5.122  -6.853   6.167
  511    HD2  HIS  67           2HD      HIS  67   8.851  -5.201   5.401
  512    HE1  HIS  67           1HE      HIS  67   4.935  -4.435   6.809
  513    HE2  HIS  67           2HE      HIS  67   7.150  -3.431   6.198
  514    HB2  HIS  67           2HB      HIS  67   6.777  -8.561   5.424
  515    HB3  HIS  67           1HB      HIS  67   8.472  -8.105   5.427
  516    H    GLU  68           H        GLU  68   9.903  -8.489   3.032
  517    HA   GLU  68           HA       GLU  68  11.173  -6.046   2.898
  518    HB2  GLU  68           2HB      GLU  68  12.782  -7.244   1.273
  519    HB3  GLU  68           1HB      GLU  68  12.604  -7.895   2.894
  520    HG2  GLU  68           2HG      GLU  68  10.717  -9.081   1.045
  521    HG3  GLU  68           1HG      GLU  68  12.384  -9.280   0.512
  522    H    GLU  69           H        GLU  69   9.549  -7.812   0.283
  523    HA   GLU  69           HA       GLU  69  10.109  -5.881  -1.736
  524    HB2  GLU  69           2HB      GLU  69   9.022  -8.435  -1.702
  525    HB3  GLU  69           1HB      GLU  69   7.671  -7.419  -2.186
  526    HG2  GLU  69           2HG      GLU  69  10.371  -7.458  -3.519
  527    HG3  GLU  69           1HG      GLU  69   8.934  -8.303  -4.097
  528    H    ALA  70           H        ALA  70   7.490  -6.342   0.576
  529    HA   ALA  70           HA       ALA  70   5.587  -4.546  -0.436
  530    HB1  ALA  70           3HB      ALA  70   5.119  -6.095   1.389
  531    HB2  ALA  70           1HB      ALA  70   4.755  -4.437   1.872
  532    HB3  ALA  70           2HB      ALA  70   6.228  -5.218   2.439
  533    H    VAL  71           H        VAL  71   8.338  -4.044   1.736
  534    HA   VAL  71           HA       VAL  71   7.852  -1.203   1.978
  535    HB   VAL  71           HB       VAL  71  10.078  -2.980   2.977
  536   HG11  VAL  71          1HG1      VAL  71  11.303  -1.056   2.745
  537   HG12  VAL  71          2HG1      VAL  71  10.601  -0.793   4.341
  538   HG13  VAL  71          3HG1      VAL  71   9.897  -0.006   2.929
  539   HG21  VAL  71          3HG2      VAL  71   9.063  -2.910   5.019
  540   HG22  VAL  71          1HG2      VAL  71   7.643  -2.778   3.982
  541   HG23  VAL  71          2HG2      VAL  71   8.328  -1.333   4.725
  542    H    THR  72           H        THR  72   9.980  -3.321   0.135
  543    HA   THR  72           HA       THR  72  11.767  -1.373  -0.813
  544    HB   THR  72           HB       THR  72  10.909  -4.054  -1.886
  545    HG1  THR  72           1HG      THR  72  13.282  -3.072  -0.683
  546   HG21  THR  72          3HG2      THR  72  12.911  -3.930  -3.379
  547   HG22  THR  72          1HG2      THR  72  12.952  -2.193  -3.074
  548   HG23  THR  72          2HG2      THR  72  11.554  -2.917  -3.872
  549    H    ALA  73           H        ALA  73   8.619  -2.463  -2.018
  550    HA   ALA  73           HA       ALA  73   8.752  -0.915  -4.418
  551    HB1  ALA  73           3HB      ALA  73   7.422  -3.059  -4.043
  552    HB2  ALA  73           1HB      ALA  73   6.613  -1.748  -4.902
  553    HB3  ALA  73           2HB      ALA  73   6.249  -2.046  -3.202
  554    H    LEU  74           H        LEU  74   7.386  -0.488  -1.170
  555    HA   LEU  74           HA       LEU  74   5.920   1.879  -1.828
  556    HG   LEU  74           HG       LEU  74   4.662  -0.081   1.092
  557    HB2  LEU  74           2HB      LEU  74   6.796   0.578   0.736
  558    HB3  LEU  74           1HB      LEU  74   6.038   2.155   0.742
  559   HD11  LEU  74          1HD1      LEU  74   3.784   2.198   1.212
  560   HD12  LEU  74          2HD1      LEU  74   2.668   1.109   0.388
  561   HD13  LEU  74          3HD1      LEU  74   3.652   2.237  -0.545
  562   HD21  LEU  74          3HD2      LEU  74   3.636  -0.921  -0.874
  563   HD22  LEU  74          1HD2      LEU  74   5.377  -0.951  -1.147
  564   HD23  LEU  74          2HD2      LEU  74   4.393   0.317  -1.877
  565    H    LYS  75           H        LYS  75   9.177   1.117  -0.823
  566    HA   LYS  75           HA       LYS  75   9.821   3.921  -0.324
  567    HB2  LYS  75           2HB      LYS  75  11.842   3.199   0.597
  568    HB3  LYS  75           1HB      LYS  75  10.699   1.944   1.052
  569    HG2  LYS  75           2HG      LYS  75  11.542   0.748  -1.087
  570    HG3  LYS  75           1HG      LYS  75  12.915   1.847  -0.951
  571    HD2  LYS  75           2HD      LYS  75  11.957   0.011   1.243
  572    HD3  LYS  75           1HD      LYS  75  13.293  -0.344   0.148
  573    HE2  LYS  75           2HE      LYS  75  14.115   2.033   1.006
  574    HE3  LYS  75           1HE      LYS  75  13.133   1.585   2.400
  575    HZ1  LYS  75           3HZ      LYS  75  15.445   0.902   2.654
  576    HZ2  LYS  75           1HZ      LYS  75  15.337  -0.049   1.259
  577    HZ3  LYS  75           2HZ      LYS  75  14.416  -0.439   2.624
  578    H    ASN  76           H        ASN  76   9.969   1.695  -2.942
  579    HA   ASN  76           HA       ASN  76  12.194   2.569  -4.371
  580    HB2  ASN  76           2HB      ASN  76  10.831   0.580  -4.950
  581    HB3  ASN  76           1HB      ASN  76   9.546   1.645  -5.510
  582   HD21  ASN  76          1HD2      ASN  76   9.592   2.332  -7.556
  583   HD22  ASN  76          2HD2      ASN  76  10.910   2.104  -8.650
  584    H    THR  77           H        THR  77   9.098   4.098  -3.922
  585    HA   THR  77           HA       THR  77   8.585   5.729  -5.944
  586    HB   THR  77           HB       THR  77   7.943   7.505  -4.323
  587    HG1  THR  77           1HG      THR  77   9.095   5.784  -2.383
  588   HG21  THR  77          3HG2      THR  77   7.183   4.905  -3.073
  589   HG22  THR  77          1HG2      THR  77   6.608   5.329  -4.686
  590   HG23  THR  77          2HG2      THR  77   6.218   6.362  -3.311
  591    H    SER  78           H        SER  78   9.614   7.055  -7.229
  592    HA   SER  78           HA       SER  78  12.131   8.298  -6.330
  593    HG   SER  78           HG       SER  78  12.306   5.900  -8.227
  594    HB2  SER  78           2HB      SER  78  11.135   7.515  -9.070
  595    HB3  SER  78           1HB      SER  78  12.487   8.629  -8.858
  596    H    ASP  79           H        ASP  79  10.174   9.342  -9.083
  597    HA   ASP  79           HA       ASP  79  10.076  12.033  -7.963
  598    HB2  ASP  79           2HB      ASP  79  10.745  11.631 -10.355
  599    HB3  ASP  79           1HB      ASP  79   9.102  11.077 -10.666
  600    H    PHE  80           H        PHE  80   7.876   9.576  -9.259
  601    HA   PHE  80           HA       PHE  80   5.713  10.675  -7.595
  602    HD1  PHE  80           1HD      PHE  80   5.443  12.953  -9.997
  603    HD2  PHE  80           2HD      PHE  80   2.603  10.037  -8.754
  604    HE1  PHE  80           1HE      PHE  80   3.793  14.735  -9.598
  605    HE2  PHE  80           2HE      PHE  80   0.952  11.814  -8.349
  606    HZ   PHE  80           HZ       PHE  80   1.547  14.164  -8.769
  607    HB2  PHE  80           2HB      PHE  80   5.781  10.597 -10.441
  608    HB3  PHE  80           1HB      PHE  80   4.608   9.396  -9.909
  609    H    VAL  81           H        VAL  81   3.850   8.913  -7.453
  610    HA   VAL  81           HA       VAL  81   4.955   6.225  -7.517
  611    HB   VAL  81           HB       VAL  81   5.464   6.851  -5.259
  612   HG11  VAL  81          1HG1      VAL  81   4.225   8.700  -4.689
  613   HG12  VAL  81          2HG1      VAL  81   3.434   7.444  -3.740
  614   HG13  VAL  81          3HG1      VAL  81   2.710   7.996  -5.249
  615   HG21  VAL  81          3HG2      VAL  81   4.494   4.597  -5.670
  616   HG22  VAL  81          1HG2      VAL  81   2.925   5.231  -5.175
  617   HG23  VAL  81          2HG2      VAL  81   4.260   5.187  -4.025
  618    H    TYR  82           H        TYR  82   3.552   4.987  -8.529
  619    HA   TYR  82           HA       TYR  82   0.724   5.784  -8.553
  620    HD1  TYR  82           1HD      TYR  82   0.071   2.357 -10.364
  621    HD2  TYR  82           2HD      TYR  82  -0.137   6.470 -11.433
  622    HE1  TYR  82           1HE      TYR  82  -2.128   1.978 -11.374
  623    HE2  TYR  82           2HE      TYR  82  -2.346   6.100 -12.443
  624    HH   TYR  82           HH       TYR  82  -4.181   3.355 -11.912
  625    HB2  TYR  82           2HB      TYR  82   1.964   5.469 -10.732
  626    HB3  TYR  82           1HB      TYR  82   2.055   3.755 -10.344
  627    H    LEU  83           H        LEU  83  -0.131   4.952  -6.773
  628    HA   LEU  83           HA       LEU  83   0.446   2.261  -5.901
  629    HG   LEU  83           HG       LEU  83  -0.941   1.626  -3.851
  630    HB2  LEU  83           2HB      LEU  83  -0.023   4.394  -4.484
  631    HB3  LEU  83           1HB      LEU  83  -1.708   3.989  -4.751
  632   HD11  LEU  83          1HD1      LEU  83   1.019   3.497  -2.527
  633   HD12  LEU  83          2HD1      LEU  83   1.438   2.264  -3.716
  634   HD13  LEU  83          3HD1      LEU  83   0.773   1.791  -2.152
  635   HD21  LEU  83          3HD2      LEU  83  -1.267   2.795  -1.467
  636   HD22  LEU  83          1HD2      LEU  83  -2.594   2.525  -2.597
  637   HD23  LEU  83          2HD2      LEU  83  -1.818   4.106  -2.511
  638    H    LYS  84           H        LYS  84  -0.708   0.494  -6.261
  639    HA   LYS  84           HA       LYS  84  -3.339   0.757  -7.553
  640    HB2  LYS  84           2HB      LYS  84  -1.185  -1.313  -7.890
  641    HB3  LYS  84           1HB      LYS  84  -2.846  -1.624  -8.364
  642    HG2  LYS  84           2HG      LYS  84  -1.681   0.869  -9.401
  643    HG3  LYS  84           1HG      LYS  84  -0.960  -0.623 -10.004
  644    HD2  LYS  84           2HD      LYS  84  -2.673  -0.199 -11.524
  645    HD3  LYS  84           1HD      LYS  84  -3.391  -1.374 -10.422
  646    HE2  LYS  84           2HE      LYS  84  -4.645   0.289  -9.308
  647    HE3  LYS  84           1HE      LYS  84  -3.715   1.590 -10.050
  648    HZ1  LYS  84           3HZ      LYS  84  -5.844   1.415 -11.111
  649    HZ2  LYS  84           1HZ      LYS  84  -5.612  -0.231 -11.430
  650    HZ3  LYS  84           2HZ      LYS  84  -4.654   0.926 -12.208
  651    H    VAL  85           H        VAL  85  -4.889   0.423  -6.097
  652    HA   VAL  85           HA       VAL  85  -4.407  -1.577  -3.994
  653    HB   VAL  85           HB       VAL  85  -6.464   0.646  -4.006
  654   HG11  VAL  85          1HG1      VAL  85  -7.121   0.001  -1.922
  655   HG12  VAL  85          2HG1      VAL  85  -5.548  -0.686  -1.515
  656   HG13  VAL  85          3HG1      VAL  85  -6.656  -1.575  -2.560
  657   HG21  VAL  85          3HG2      VAL  85  -4.926   1.625  -2.236
  658   HG22  VAL  85          1HG2      VAL  85  -4.377   1.729  -3.909
  659   HG23  VAL  85          2HG2      VAL  85  -3.701   0.506  -2.835
  660    H    ALA  86           H        ALA  86  -5.677  -3.334  -3.813
  661    HA   ALA  86           HA       ALA  86  -7.667  -3.795  -5.890
  662    HB1  ALA  86           3HB      ALA  86  -7.490  -6.046  -4.209
  663    HB2  ALA  86           1HB      ALA  86  -5.848  -5.435  -4.405
  664    HB3  ALA  86           2HB      ALA  86  -6.812  -5.843  -5.824
  665    H    LYS  87           H        LYS  87  -9.812  -4.408  -5.479
  666    HA   LYS  87           HA       LYS  87 -10.841  -3.490  -2.886
  667    HB2  LYS  87           2HB      LYS  87 -11.622  -2.547  -5.188
  668    HB3  LYS  87           1HB      LYS  87 -12.563  -4.029  -5.284
  669    HG2  LYS  87           2HG      LYS  87 -12.898  -2.719  -2.727
  670    HG3  LYS  87           1HG      LYS  87 -13.312  -1.654  -4.071
  671    HD2  LYS  87           2HD      LYS  87 -14.376  -4.282  -4.538
  672    HD3  LYS  87           1HD      LYS  87 -14.878  -3.703  -2.948
  673    HE2  LYS  87           2HE      LYS  87 -16.541  -2.782  -4.199
  674    HE3  LYS  87           1HE      LYS  87 -15.355  -1.485  -4.325
  675    HZ1  LYS  87           3HZ      LYS  87 -16.240  -1.980  -6.484
  676    HZ2  LYS  87           1HZ      LYS  87 -15.854  -3.620  -6.329
  677    HZ3  LYS  87           2HZ      LYS  87 -14.621  -2.467  -6.443
  678    HA   PRO  88           HA       PRO  88 -11.550  -7.768  -1.827
  679    HB2  PRO  88           2HB      PRO  88 -13.251  -7.271   0.281
  680    HB3  PRO  88           1HB      PRO  88 -11.489  -7.234   0.388
  681    HG2  PRO  88           2HG      PRO  88 -13.421  -4.975   0.103
  682    HG3  PRO  88           1HG      PRO  88 -11.939  -5.072   1.072
  683    HD2  PRO  88           2HD      PRO  88 -12.036  -3.751  -1.276
  684    HD3  PRO  88           1HD      PRO  88 -10.577  -4.607  -0.733
  685    H    THR  89           H        THR  89 -13.105  -9.296  -2.240
  686    HA   THR  89           HA       THR  89 -15.885  -8.722  -2.419
  687    HB   THR  89           HB       THR  89 -15.178  -9.636  -5.084
  688    HG1  THR  89           1HG      THR  89 -13.481  -8.352  -5.234
  689   HG21  THR  89          3HG2      THR  89 -16.646  -7.873  -5.816
  690   HG22  THR  89          1HG2      THR  89 -16.648  -7.168  -4.200
  691   HG23  THR  89          2HG2      THR  89 -17.375  -8.752  -4.472
  692    H    GLY  90           H        GLY  90 -16.331 -10.534  -1.251
  693    HA2  GLY  90           2HA      GLY  90 -15.037 -12.999  -1.430
  694    HA3  GLY  90           1HA      GLY  90 -16.655 -12.755  -0.795
  695    H    SER  91           H        SER  91 -15.105 -14.654  -2.794
  696    HA   SER  91           HA       SER  91 -16.925 -14.534  -5.069
  697    HG   SER  91           HG       SER  91 -15.076 -14.976  -6.961
  698    HB2  SER  91           2HB      SER  91 -14.387 -15.999  -4.464
  699    HB3  SER  91           1HB      SER  91 -15.472 -16.651  -5.691
  700    H    HIS  92           H        HIS  92 -16.268 -16.517  -2.244
  701    HA   HIS  92           HA       HIS  92 -17.701 -18.814  -2.847
  702    HD1  HIS  92           1HD      HIS  92 -15.205 -16.683   0.050
  703    HD2  HIS  92           2HD      HIS  92 -19.278 -16.771   0.866
  704    HE1  HIS  92           1HE      HIS  92 -15.612 -14.784   1.647
  705    HE2  HIS  92           2HE      HIS  92 -18.100 -14.794   2.044
  706    HB2  HIS  92           2HB      HIS  92 -17.997 -19.041  -0.363
  707    HB3  HIS  92           1HB      HIS  92 -16.339 -18.738  -0.870
  708    HA   ARG 301           HA       ARG 301   1.842 -10.452  11.482
  709    HE   ARG 301           HE       ARG 301  -1.788  -6.657  12.917
  710    H1   ARG 301           1HT      ARG 301   3.541 -10.715  13.272
  711    H2   ARG 301           2HT      ARG 301   1.894 -10.905  13.711
  712    H3   ARG 301           3HT      ARG 301   2.722  -9.454  14.096
  713    HB2  ARG 301           2HB      ARG 301   1.149  -8.285  13.367
  714    HB3  ARG 301           1HB      ARG 301   1.197  -7.818  11.672
  715    HG2  ARG 301           2HG      ARG 301  -0.241 -10.064  11.460
  716    HG3  ARG 301           1HG      ARG 301  -0.678  -9.592  13.103
  717    HD2  ARG 301           2HD      ARG 301  -0.717  -7.454  11.061
  718    HD3  ARG 301           1HD      ARG 301  -1.952  -8.702  10.911
  719   HH11  ARG 301          1HH1      ARG 301  -3.024  -9.860  12.214
  720   HH12  ARG 301          2HH1      ARG 301  -4.286  -9.764  13.394
  721   HH21  ARG 301          1HH2      ARG 301  -3.453  -6.539  14.468
  722   HH22  ARG 301          2HH2      ARG 301  -4.532  -7.879  14.673
  723    H    ARG 302           H        ARG 302   4.162  -8.354  13.128
  724    HA   ARG 302           HA       ARG 302   5.987  -7.216  12.411
  725    HE   ARG 302           HE       ARG 302   8.325 -10.274  12.024
  726    HB2  ARG 302           2HB      ARG 302   6.384  -9.568  11.422
  727    HB3  ARG 302           1HB      ARG 302   5.945  -8.843   9.882
  728    HG2  ARG 302           2HG      ARG 302   7.789  -7.354   9.957
  729    HG3  ARG 302           1HG      ARG 302   8.135  -7.766  11.638
  730    HD2  ARG 302           2HD      ARG 302   8.270  -9.742   9.368
  731    HD3  ARG 302           1HD      ARG 302   9.656  -8.817   9.939
  732   HH11  ARG 302          1HH1      ARG 302  10.724 -10.502   9.482
  733   HH12  ARG 302          2HH1      ARG 302  11.572 -11.811  10.233
  734   HH21  ARG 302          1HH2      ARG 302   9.446 -11.997  13.008
  735   HH22  ARG 302          2HH2      ARG 302  10.848 -12.660  12.235
  736    H    GLU 303           H        GLU 303   4.873  -5.259  12.179
  737    HA   GLU 303           HA       GLU 303   4.194  -4.509   9.410
  738    HB2  GLU 303           2HB      GLU 303   3.146  -3.460  12.042
  739    HB3  GLU 303           1HB      GLU 303   2.821  -2.693  10.494
  740    HG2  GLU 303           2HG      GLU 303   1.234  -4.169   9.975
  741    HG3  GLU 303           1HG      GLU 303   2.217  -5.538  10.488
  742    H    THR 304           H        THR 304   5.521  -3.111   8.446
  743    HA   THR 304           HA       THR 304   7.234  -1.421  10.142
  744    HB   THR 304           HB       THR 304   7.840  -3.177   7.888
  745    HG1  THR 304           1HG      THR 304   9.093  -3.611   9.519
  746   HG21  THR 304          3HG2      THR 304   9.111  -0.454   7.902
  747   HG22  THR 304          1HG2      THR 304   8.082  -1.123   6.635
  748   HG23  THR 304          2HG2      THR 304   9.656  -1.847   6.967
  749    H    GLN 305           H        GLN 305   7.734   0.693   9.437
  750    HA   GLN 305           HA       GLN 305   5.588   1.946   7.950
  751    HB2  GLN 305           2HB      GLN 305   7.715   2.847   9.787
  752    HB3  GLN 305           1HB      GLN 305   7.287   3.983   8.515
  753    HG2  GLN 305           2HG      GLN 305   4.960   3.925   9.221
  754    HG3  GLN 305           1HG      GLN 305   5.360   2.750  10.473
  755   HE21  GLN 305          1HE2      GLN 305   5.197   3.735  12.367
  756   HE22  GLN 305          2HE2      GLN 305   5.856   5.283  12.763
  757    H    VAL 306           H        VAL 306   5.958   3.451   6.208
  758    HA   VAL 306           HA       VAL 306   8.462   3.159   4.734
  759    HB   VAL 306           HB       VAL 306   7.199   2.685   2.614
  760   HG11  VAL 306          1HG1      VAL 306   8.457   0.973   3.919
  761   HG12  VAL 306          2HG1      VAL 306   7.128   0.317   2.965
  762   HG13  VAL 306          3HG1      VAL 306   6.943   0.529   4.707
  763   HG21  VAL 306          3HG2      VAL 306   4.962   2.124   4.560
  764   HG22  VAL 306          1HG2      VAL 306   4.972   1.606   2.873
  765   HG23  VAL 306          2HG2      VAL 306   4.973   3.325   3.268