*HEADER    PEPTIDE BINDING PROTEIN                 30-NOV-17   6F55              
*TITLE     COMPLEX STRUCTURE OF PACSIN SH3 DOMAIN AND TRPV4 PROLINE RICH REGION  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PACSIN 3;                                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: PROTEIN KINASE C AND CASEIN KINASE SUBSTRATE IN NEURONS 3;  
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MOL_ID: 2;                                                           
*COMPND   7 MOLECULE: PRR;                                                       
*COMPND   8 CHAIN: B;                                                            
*COMPND   9 SYNONYM: TRANSIENT RECEPTOR POTENTIAL CATION CHANNEL SUBFAMILY V     
*COMPND  10 MEMBER 4;                                                            
*COMPND  11 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: GALLUS GALLUS;                                  
*SOURCE   3 ORGANISM_COMMON: CHICKEN;                                            
*SOURCE   4 ORGANISM_TAXID: 9031;                                                
*SOURCE   5 GENE: PACSIN3;                                                       
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 MOL_ID: 2;                                                           
*SOURCE   9 SYNTHETIC: YES;                                                      
*SOURCE  10 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE  11 ORGANISM_COMMON: HUMAN;                                              
*SOURCE  12 ORGANISM_TAXID: 9606                                                 
*KEYWDS    PROTEIN, PEPTIDE BINDING PROTEIN                                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    N.A.GLOGOWSKI,B.GORETZKI,E.DIEHL,E.DUCHARDT-FERNER,C.HACKER,          
*AUTHOR   2 U.A.HELLMICH                                                         
*REVDAT   1   03-OCT-18 6F55    0                                                
# Restraints file 1: hsP1_intraNOE.upl
# hsP1 13C K2P10
110 PRO  HB3    111 ILE  H      4.00     # medium
110 PRO  HB2    111 ILE  H      4.00     # medium
110 PRO  QG     111 ILE  H      5.50     # weak
110 PRO  HB2    111 ILE  QD1    5.50     # weak
102 LYS  HA     103 GLY  H      4.00     # medium

# hsP1 13C P9K13
113 LYS QE      115 TRP  H      5.50     # weak (nicht im spektrum ohne abs)
#113 LYS HA      115 TRP  H      5.50     # weak (gebunden + ungebunden)

# hsP1 13C P6
106 PRO  HB3    107 ASN  H      4.00     # medium
106 PRO  HB2    107 ASN  H      4.00     # medium
106 PRO  QG     107 ASN  H      5.50     # weak
106 PRO  QG     105 ALA  QB     5.50     # weak
106 PRO  QG     105 ALA  QB     5.50     # weak

# hsP1 13C P8
108 PRO  QD     107 ASN  QB      4.00     # medium

# hsP1 13C P4A5
#kein NOESY vom freien Peptid vorhanden
# Restraints file 2: ggPacSH3_hsP1_interNOE.upl
# 13C NOESY SH3 + hsP1 13C P6
106 PRO  HB3    14 TYR  QD      4.50     # medium
106 PRO  QG     14 TYR  QD      3.50     # strong
106 PRO  HB2    14 TYR  QD      3.50     # strong
106 PRO  HB3    58 TYR  QD      6.00     # weak
106 PRO  HB3    41 TRP  HZ2     0.00     
106 PRO  QG     58 TYR  QD      4.50     # medium
106 PRO  QG     41 TRP  HZ2     0.00     
106 PRO  QG     57 ASN  HD21    6.00     # no other match, weak
106 PRO  HB2    57 ASN  HD21    6.00     # no other match, very weak

# 13C NOESY SH3 + hsP1 13C P6
110 PRO  HB2    58 TYR  QD      6.00     # weak

# 15N NOESY SH3 + hsP1 13C P4 15N P5
#105 ALA  H      46 LEU  QD1     6.00     # possibly noise, none of the listed residues makes sense with current structure
#105 ALA  H      11 LEU  HG      6.00     # possibly noise, none of the listed residues makes sense with current structure
#105 ALA  H      50 HIS  HA      6.00    #definitly Pro4 of hsP1 but other might be overlaped, none of the listed residues makes sense with current structure
#105 ALA  H      22 LEU  HA      0.00
105 ALA  H      41 TRP  HD1     4.50      #definite, medium, TRP41 makes sense with current structure
#105 ALA  H      24 PHE  QE      0.00
#105 ALA  H      62 VAL  HA      6.00 # shift 3.964, Gly40 makes sense with current structure
#105 ALA  H       5 GLY  HA2     0.00
#105 ALA  H      40 GLY  HA2     0.00
#105 ALA  H      19 ALA  HA      6.00 # shift 4.119, also 11ILEHa of hsP1 possible!, Gly40 makes sense with current structure
#105 ALA  H      40 GLY  HA3     0.00
#105 ALA  H      52 GLY  HA3     6.00 # shift 4.295, might be noise!, none of the listed residues makes sense with current structure
#105 ALA  H      64 LEU  HA      0.00
#105 ALA  H      34 SER  HB3     0.00

# 15N NOESY 15N 13C SH3 + hsP1

41 TRP  HE1   105 ALA  H       4.50       #medium
57 ASN  HD21  106 PRO  HD3     6.00       #weak, fits more to Pro6 than to Pro8 not only from structure!
57 ASN  HD22  108 PRO  HD3     6.00       #weak, fits Pro8 better from shift
57 ASN  HD22  106 PRO  HD3     0.00       
57 ASN  HD22  108 PRO  HD2     6.00       #weak, fits Pro8 better from shift
57 ASN  HD22  106 PRO  HD2     0.00       
39 GLN  HE22  108 PRO  HD2     6.00       #weak, fits Pro8 better from shift
39 GLN  HE22  109 PRO  HD2     0.00       #In allen Rechnungen verstossen, NOE ist da, allerdings nicht klar welches HD
39 GLN  HE21  108 PRO  HD2     0.00       
39 GLN  HE21  109 PRO  HD2     0.00       

# 13C NOESY aroC 15N 13C SH3 + hsP1

12 TYR  QD    112 LEU  QD2     3.50      #strong, good match
12 TYR  QD    111 ILE  HG12    3.50      #strong, good match
12 TYR  QD    104 PRO  QG      4.50      # strong - medium, ausprobieren
12 TYR  QD    108 PRO  QG      0.00     
12 TYR  QD    109 PRO  QG      0.00     
12 TYR  QD    110 PRO  QG      0.00     
41 TRP  HD1   105 ALA  H       4.50      #medium, good match
# 41 TRP  HD1   105 ALA  HA      6.00     #no perfekt match
# 41 TRP  HD1   101 THR  QG2     6.00      # peak maximun not definite could also be 5ALA HB, but not likely
41 TRP  HZ2   105 ALA  H       4.50      #medium, good match
41 TRP  HZ2   108 PRO  HD3     6.00    # weak, ausprobieren peak maximum not definite!!
41 TRP  HZ2   106 PRO  HD3     0.00     
41 TRP  HZ2   110 PRO  HD3     0.00     
# 54 TYR  QD    103 GLY  HA2     6.00      # peak maximum not definite!!
58 TYR  QD    106 PRO  QG      4.50      # medium, ausprobieren
58 TYR  QD    104 PRO  QG      0.00     
58 TYR  QD    108 PRO  QG      0.00     
58 TYR  QD    109 PRO  QG      0.00     
58 TYR  QE    106 PRO  QG      4.50      # strong - medium, ausprobieren
58 TYR  QE    104 PRO  QG      0.00     
58 TYR  QE    108 PRO  QG      0.00     
58 TYR  QE    109 PRO  QG      0.00     


# 13C NOESY aliC 15N 13C SH3 + hsP1

#no unambigous

# 2D HH filter NOESY 15N 13C SH3 + hsP1

101 THR  QG2    39 GLN  HG3      3.50     
101 THR  QG2    39 GLN  HG2      3.50    
101 THR  QG2    53 LEU  QD1      4.50    
103 GLY  HA2    39 GLN  HG3      6.00    # unf?rmiger Peak, nicht auf einer Line, eine klasse h?her gesetzt
103 GLY  HA2    39 GLN  HG2      0.00    # unf?rmiger Peak, nicht auf einer Line 
103 GLY  HA3    39 GLN  HG3      6.00    # unf?rmiger Peak, nicht auf einer Line
103 GLY  HA3    39 GLN  HG2      0.00    # unf?rmiger Peak, nicht auf einer Line
104 PRO  HA     39 GLN  HG3      3.50    
104 PRO  HA     39 GLN  HB3      4.50    
104 PRO  HA     39 GLN  HG2      3.50    
105 ALA  H      39 GLN  HG2      3.50    
105 ALA  H      39 GLN  HB2      0.00    
105 ALA  H      39 GLN  HB3      3.50    
105 ALA  H      39 GLN  HG3      3.50    
105 ALA  H      41 TRP  HZ2      4.50    
105 ALA  H      41 TRP  HD1      6.00    
106 PRO  HB3    41 TRP  HZ2      4.50     # ausprobieren no sure could also be PRO4/9HB3
106 PRO  HB3    58 TYR  QD       0.00
104 PRO  HB3    41 TRP  HZ2      0.00     
104 PRO  HB3    58 TYR  QD       0.00  
109 PRO  HB3    41 TRP  HZ2      0.00     
109 PRO  HB3    58 TYR  QD       0.00      
106 PRO  HB3    58 TYR  QE       4.50     # ausprobieren no sure could also be PRO4/9HB3
106 PRO  HB3    14 TYR  QD       0.00
104 PRO  HB3    58 TYR  QE       0.00 
104 PRO  HB3    14 TYR  QD       0.00
109 PRO  HB3    58 TYR  QE       0.00 
109 PRO  HB3    14 TYR  QD       0.00    
107 ASN  HA     57 ASN  HB2      6.00    
107 ASN  HA     57 ASN  HB3      6.00    
107 ASN  HA     41 TRP  HZ2      6.00    #eine klasse h?her gesetzt
107 ASN  HA     58 TYR  QD       0.00    
107 ASN  HA     58 TYR  QE       6.00    #eine klasse h?her gesetzt
107 ASN  HA     14 TYR  QE       0.00    
108 PRO  HD2    57 ASN  HB2      4.50     
106 PRO  HD2    57 ASN  HB2      0.00    
110 PRO  HD2    57 ASN  HB2      0.00    
108 PRO  HD2    57 ASN  HB3      4.50     
106 PRO  HD2    57 ASN  HB2      0.00    
110 PRO  HD2    57 ASN  HB2      0.00      
108 PRO  HD3    57 ASN  HB2      4.50     
106 PRO  HD3    57 ASN  HB2      0.00    
110 PRO  HD3    57 ASN  HB2      0.00      
108 PRO  HD3    57 ASN  HB3      4.50     
106 PRO  HD3    57 ASN  HB2      0.00    
110 PRO  HD3    57 ASN  HB2      0.00      
111 ILE  QD1    12 TYR  QE       3.50    
111 ILE  QD1    12 TYR  QD       4.50    
#111 ILE  QD1     8 Val  QG1       6.00   #weak, possibly noise
#111 ILE  H      54 TYR  QE       6.00     # medium, SD to ILL11 0.019, no good match 
#111 ILE  HA     12 TYR  QE       6.00   #weak, possibly noise
#111 ILE  HG1    12 TYR  QE       6.00      #weak, possibly noise
112 LEU  HA     12 TYR  QE       6.00    
112 LEU  HG     12 TYR  QE       4.50    
112 LEU  HB3    12 TYR  QE       0.00    
#114 VAL  HB     57 ASN  HB2      6.00 #no good match
#114 VAL  HB     57 ASN  HB3      6.00 #no good match
108 PRO  QD     12 TYR  QE       6.00     #ausprobieren
106 PRO  QD     12 TYR  QE       0.00     
110 PRO  QD     12 TYR  QE       0.00     
108 PRO  HD2    39 GLN  QG       6.00     
106 PRO  HD2    39 GLN  QG       0.00     
104 PRO  HD2    39 GLN  QG       0.00     
110 PRO  HD2    39 GLN  QG       0.00     
108 PRO  HD2    39 GLN  HB3      6.00     
106 PRO  HD2    39 GLN  HB3      0.00     
104 PRO  HD2    39 GLN  HB3      0.00     
110 PRO  HD2    39 GLN  HB3      0.00     
#108 PRO  HD2     4 PRO  HG2      6.00 # does not fit structure
#106 PRO  HD2     4 PRO  HG2      0.00
#108 PRO  HD3     7 ARG  HB2      6.00 # does not fit structure
#106 PRO  HD3     7 ARG  HB2      0.00
# Restraints file 3: ggPacSH3_intraNOE.upl
 34 SER  HB2    43 LYS+ QB      5.50            #peak 8 #SUP 0.92 #QF 0.85
 41 TRP  HA     55 PRO  HA      5.50            #peak 38 #SUP 0.93 #QF 0.93
 15 THR  HA     23 SER  HA      5.50            #peak 45 #SUP 0.77 #QF 0.77
 14 TYR  HA     14 TYR  QD      5.50            #peak 55 #SUP 1.00 #QF 0.94
 38 GLU- HA     40 GLY  HN      5.50            #peak 65 #SUP 0.89 #QF 0.89
 10 ALA  QB     59 VAL  HA      5.50            #peak 68 #SUP 1.00 #QF 0.78
  8 VAL  HA     61 LYS+ HA      5.50            #peak 78 #SUP 0.99 #QF 0.99
 24 PHE  HA     24 PHE  QD      5.50            #peak 117 #SUP 1.00
 24 PHE  QD     54 TYR  HA      5.50            #peak 126 #SUP 0.99 #QF 0.99
 21 GLU- HA     43 LYS+ QG      5.50            #peak 138 #SUP 0.27 #QF 0.27
 32 LYS+ HE2    35 GLU- HA      5.50            #peak 145 #SUP 0.91 #QF 0.91
 41 TRP  HB3    53 LEU  HA      5.50            #peak 157 #SUP 0.98 #QF 0.91
 52 GLY  HN     53 LEU  HA      5.50            #peak 160 #SUP 0.99 #QF 0.97
 43 LYS+ HA     53 LEU  HA      5.50            #peak 163 #SUP 0.99 #QF 0.99
 43 LYS+ QG     53 LEU  HA      5.50            #peak 164 #SUP 0.96 #QF 0.96
 13 ASP- HA     25 LYS+ HA      5.50            #peak 191 #SUP 0.92 #QF 0.92
  9 ARG+ HA     29 GLU- HA      5.50            #peak 194 #SUP 0.86 #QF 0.86
 10 ALA  HA     59 VAL  HA      5.50            #peak 206 #SUP 1.00
  7 ARG+ HA     31 MET  HA      5.50            #peak 211 #SUP 1.00 #QF 0.81
 54 TYR  QD     55 PRO  HD3     5.50            #peak 222 #SUP 1.00 #QF 0.92
 40 GLY  HA1    56 ALA  QB      5.50            #peak 240 #SUP 0.67 #QF 0.67
 40 GLY  HA2    56 ALA  QB      5.50            #peak 246 #SUP 0.96 #QF 0.96
 22 LEU  HB2    24 PHE  QD      5.50            #peak 262 #SUP 0.37 #QF 0.37
  5 GLY  HA1    33 ILE  HA      5.50            #peak 285 #SUP 0.90 #QF 0.90
 41 TRP  HZ3    53 LEU  HB2     5.50            #peak 295 #SUP 0.99 #QF 0.99
 33 ILE  QG2    44 GLY  HA1     5.50            #peak 305 #SUP 0.99 #QF 0.99
 33 ILE  QG2    44 GLY  HA2     5.50            #peak 317 #SUP 1.00 #QF 0.68
 33 ILE  HA     44 GLY  HA2     5.50            #peak 318 #SUP 0.79 #QF 0.79
 32 LYS+ HA     44 GLY  HA1     5.50            #peak 319 #SUP 0.98 #QF 0.66
 45 ARG+ QD     49 GLY  HA1     5.50            #peak 320 #SUP 0.82 #QF 0.82
  7 ARG+ HA      7 ARG+ QD      5.50            #peak 322 #SUP 0.67 #QF 0.67
 45 ARG+ HA     45 ARG+ QD      5.50            #peak 324 #SUP 1.00
  7 ARG+ QD     61 LYS+ QB      5.50            #peak 325 #SUP 0.51 #QF 0.51
  9 ARG+ HA      9 ARG+ QD      5.50            #peak 335 #SUP 1.00
  9 ARG+ QD     27 GLY  HA2     5.50            #peak 337 #SUP 0.90 #QF 0.90
 46 LEU  QB     47 LEU  HN      5.50            #peak 343 #SUP 0.97 #QF 0.97
 46 LEU  QB     51 VAL  HA      5.50            #peak 344 #SUP 0.97 #QF 0.87
  6 VAL  QQG    61 LYS+ QE      5.50            #peak 383 #SUP 0.65 #QF 0.65
 24 PHE  QD     54 TYR  HB2     5.50            #peak 408 #SUP 1.00 #QF 0.84
 33 ILE  HB     45 ARG+ HN      5.50            #peak 438 #SUP 0.73 #QF 0.73
 29 GLU- HN     29 GLU- HG2     5.50            #peak 454 #SUP 1.00
 25 LYS+ HN     28 GLU- HG2     5.50            #peak 465 #SUP 1.00 #QF 0.51
 21 GLU- HN     21 GLU- QG      5.50            #peak 474 #SUP 1.00
 36 GLU- HG3    56 ALA  QB      5.50            #peak 497 #SUP 0.87 #QF 0.87
  8 VAL  QG2    59 VAL  HB      5.50            #peak 501 #SUP 0.96 #QF 0.96
 60 GLU- HN     60 GLU- HG2     5.50            #peak 506 #SUP 1.00
  6 VAL  HB     32 LYS+ HN      5.50            #peak 507 #SUP 0.91 #QF 0.91
 39 GLN  HN     39 GLN  HG3     5.50            #peak 515 #SUP 0.98 #QF 0.98
 33 ILE  QG2    45 ARG+ HB3     5.50            #peak 543 #SUP 0.96 #QF 0.42
 17 GLN  HN     17 GLN  HG3     5.50            #peak 549 #SUP 0.99 #QF 0.99
 34 SER  HB3    43 LYS+ QB      5.50            #peak 564 #SUP 0.83 #QF 0.83
 33 ILE  QG2    43 LYS+ QB      5.50            #peak 567 #SUP 0.62 #QF 0.62
 11 LEU  QD2    60 GLU- HB2     5.50            #peak 588 #SUP 0.91 #QF 0.91
  6 VAL  QQG    61 LYS+ QB      5.50            #peak 594 #SUP 0.65 #QF 0.65
  8 VAL  QG1    61 LYS+ QB      5.50            #peak 597 #SUP 0.92 #QF 0.35
 61 LYS+ HA     62 VAL  HB      5.50            #peak 605 #SUP 0.95 #QF 0.95
  8 VAL  QG1    62 VAL  HB      5.50            #peak 607 #SUP 0.96 #QF 0.96
 31 MET  HN     31 MET  HG3     5.50            #peak 615 #SUP 0.96 #QF 0.96
 31 MET  HG3    33 ILE  QG2     5.50            #peak 618 #SUP 0.69 #QF 0.48
 31 MET  HG2    33 ILE  QG2     5.50            #peak 620 #SUP 0.62 #QF 0.41
 46 LEU  QB     50 HIS  HB2     5.50            #peak 632 #SUP 0.74 #QF 0.74
 10 ALA  QB     28 GLU- HB3     5.50            #peak 645 #SUP 0.83 #QF 0.83
 42 CYS  HB2    43 LYS+ HN      5.50            #peak 658 #SUP 0.74 #QF 0.74
 46 LEU  QB     50 HIS  HB3     5.50            #peak 667 #SUP 0.81 #QF 0.81
 41 TRP  HB3    41 TRP  HZ3     5.50            #peak 669 #SUP 0.99 #QF 0.99
  7 ARG+ HB3     8 VAL  QG1     5.50            #peak 673 #SUP 0.98 #QF 0.98
  7 ARG+ HB2     8 VAL  QG1     5.50            #peak 678 #SUP 0.93 #QF 0.93
 41 TRP  HB3    43 LYS+ QG      5.50            #peak 684 #SUP 0.58 #QF 0.58
 41 TRP  HB3    53 LEU  QD2     5.50            #peak 686 #SUP 0.98 #QF 0.98
  6 VAL  HA     61 LYS+ QD      5.50            #peak 717 #SUP 0.74 #QF 0.74
 25 LYS+ HA     25 LYS+ HD3     5.50            #peak 729 #SUP 0.99 #QF 0.99
  7 ARG+ HN      7 ARG+ HG3     5.50            #peak 732 #SUP 0.96 #QF 0.96
 43 LYS+ QG     53 LEU  HG      5.50            #peak 745 #SUP 0.97 #QF 0.97
 47 LEU  HN     47 LEU  HG      5.50            #peak 756 #SUP 0.91 #QF 0.91
 11 LEU  HG     59 VAL  HA      5.50            #peak 767 #SUP 0.96 #QF 0.96
 30 LEU  HA     30 LEU  QD2     5.50            #peak 791 #SUP 0.91 #QF 0.91
 46 LEU  QD2    48 THR  HN      5.50            #peak 792 #SUP 0.92 #QF 0.92
 30 LEU  HA     46 LEU  QD2     5.50            #peak 793 #SUP 0.94 #QF 0.78
 30 LEU  HA     30 LEU  QD1     5.50            #peak 810 #SUP 0.79 #QF 0.79
  8 VAL  QG2    30 LEU  QD1     5.50            #peak 812 #SUP 0.99 #QF 0.99
 22 LEU  QD2    51 VAL  HA      5.50            #peak 854 #SUP 1.00 #QF 0.98
  8 VAL  QG1    62 VAL  HN      5.50            #peak 859 #SUP 0.99 #QF 0.99
  8 VAL  QG1    61 LYS+ HA      5.50            #peak 860 #SUP 0.99 #QF 0.99
 51 VAL  QG2    52 GLY  HN      5.50            #peak 871 #SUP 0.98 #QF 0.89
 15 THR  QG2    17 GLN  HA      5.50            #peak 872 #SUP 0.39 #QF 0.39
 62 VAL  HN     62 VAL  QG2     5.50            #peak 876 #SUP 0.93 #QF 0.93
  9 ARG+ HA     10 ALA  QB      5.50            #peak 907 #SUP 1.00 #QF 0.35
 56 ALA  QB     57 ASN  HA      5.50            #peak 907 #SUP 1.00 #QF 0.35
 10 ALA  QB     13 ASP- HA      5.50            #peak 910 #SUP 0.24 #QF 0.24
 10 ALA  QB     24 PHE  QE      5.50            #peak 912 #SUP 0.81 #QF 0.81
 10 ALA  QB     24 PHE  QD      5.50            #peak 913 #SUP 1.00
 10 ALA  QB     26 ALA  HA      5.50            #peak 915 #SUP 0.99 #QF 0.97
  7 ARG+ HA      8 VAL  QG2     5.50            #peak 934 #SUP 0.99 #QF 0.96
  8 VAL  QG2    59 VAL  QG2     5.50            #peak 936 #SUP 0.86 #QF 0.70
  8 VAL  QG2    59 VAL  QG1     5.50            #peak 937 #SUP 0.93 #QF 0.93
  8 VAL  QG2    30 LEU  QD2     5.50            #peak 938 #SUP 0.99 #QF 0.86
 26 ALA  QB     27 GLY  HN      5.50            #peak 941 #SUP 1.00
 12 TYR  HA     26 ALA  QB      5.50            #peak 944 #SUP 0.68 #QF 0.68
  5 GLY  HA2    33 ILE  QG2     5.50            #peak 948 #SUP 0.98 #QF 0.98
  5 GLY  HA1    33 ILE  QG2     5.50            #peak 949 #SUP 0.84 #QF 0.84
  6 VAL  HN     31 MET  QE      5.50            #peak 953 #SUP 0.99 #QF 0.99
 31 MET  HA     31 MET  QE      5.50            #peak 954 #SUP 0.97 #QF 0.97
  7 ARG+ HA     31 MET  QE      5.50            #peak 955 #SUP 0.96 #QF 0.96
  5 GLY  HA1    31 MET  QE      5.50            #peak 956 #SUP 0.99 #QF 0.99
  7 ARG+ QD     31 MET  QE      5.50            #peak 957 #SUP 0.84 #QF 0.84
 31 MET  QE     32 LYS+ HN      5.50            #peak 960 #SUP 0.80 #QF 0.80
  8 VAL  HN     31 MET  QE      5.50            #peak 961 #SUP 0.62 #QF 0.62
  7 ARG+ HN     31 MET  QE      5.50            #peak 962 #SUP 0.99 #QF 0.99
  6 VAL  HA     31 MET  QE      5.50            #peak 963 #SUP 0.89 #QF 0.89
 33 ILE  HN     33 ILE  QD1     5.50            #peak 964 #SUP 0.82 #QF 0.82
 33 ILE  QD1    43 LYS+ HE2     5.50            #peak 966 #SUP 0.55 #QF 0.55
  4 PRO  HG2     6 VAL  QQG     5.50            #peak 978 #SUP 0.93 #QF 0.93
  4 PRO  HG3     6 VAL  QQG     5.50            #peak 980 #SUP 0.81 #QF 0.81
  5 GLY  HA1    32 LYS+ HG2     5.50            #peak 982 #SUP 0.85 #QF 0.68
  4 PRO  HG2     5 GLY  HA1     5.50            #peak 983 #SUP 0.84 #QF 0.74
  5 GLY  HA2    33 ILE  HA      5.50            #peak 984 #SUP 0.98 #QF 0.98
  5 GLY  HA1     6 VAL  QQG     5.50            #peak 993 #SUP 0.96 #QF 0.96
  7 ARG+ HA      8 VAL  HA      5.50            #peak 1002 #SUP 0.79 #QF 0.79
  8 VAL  HB     60 GLU- HN      5.50            #peak 1006 #SUP 0.97 #QF 0.97
  8 VAL  QG2    32 LYS+ HB2     5.50            #peak 1013 #SUP 0.89 #QF 0.65
  9 ARG+ HA     29 GLU- QB      5.50            #peak 1017 #SUP 0.63 #QF 0.63
  9 ARG+ QD     29 GLU- QB      5.50            #peak 1024 #SUP 0.90 #QF 0.90
 10 ALA  HA     24 PHE  QD      5.50            #peak 1033 #SUP 0.98 #QF 0.69
 10 ALA  HA     24 PHE  HZ      5.50            #peak 1033 #SUP 0.98 #QF 0.69
 10 ALA  QB     24 PHE  HB2     5.50            #peak 1035 #SUP 0.99 #QF 0.72
 55 PRO  HA     56 ALA  QB      5.50            #peak 1036 #SUP 0.92 #QF 0.92
 36 GLU- HG2    56 ALA  QB      5.50            #peak 1039 #SUP 0.94 #QF 0.94
 11 LEU  QD1    60 GLU- HB3     5.50            #peak 1053 #SUP 0.99 #QF 0.99
 11 LEU  QD1    60 GLU- HB2     5.50            #peak 1054 #SUP 1.00
 11 LEU  HA     11 LEU  QD1     5.50            #peak 1057 #SUP 0.86 #QF 0.86
 11 LEU  HA     11 LEU  QD2     5.50            #peak 1064 #SUP 0.97 #QF 0.97
 14 TYR  QD     16 GLY  HA1     5.50            #peak 1078 #SUP 0.46 #QF 0.46
 18 GLU- HA     19 ALA  QB      5.50            #peak 1092 #SUP 0.61 #QF 0.61
 22 LEU  HB3    24 PHE  QD      5.50            #peak 1107 #SUP 0.77 #QF 0.77
 22 LEU  QD1    46 LEU  HG      5.50            #peak 1112 #SUP 0.92 #QF 0.79
 22 LEU  QD1    46 LEU  QB      5.50            #peak 1115 #SUP 1.00
 22 LEU  QD1    45 ARG+ HA      5.50            #peak 1119 #SUP 1.00 #QF 0.97
 22 LEU  QD1    51 VAL  HA      5.50            #peak 1119 #SUP 1.00 #QF 0.97
 22 LEU  QD1    24 PHE  QD      5.50            #peak 1123 #SUP 0.98 #QF 0.82
 22 LEU  QD1    52 GLY  HN      5.50            #peak 1125 #SUP 0.95 #QF 0.95
 22 LEU  QD2    46 LEU  HG      5.50            #peak 1129 #SUP 1.00 #QF 0.91
 22 LEU  QD2    24 PHE  QD      5.50            #peak 1133 #SUP 0.98 #QF 0.45
 24 PHE  HA     30 LEU  HB3     5.50            #peak 1138 #SUP 0.40 #QF 0.40
 25 LYS+ HA     26 ALA  QB      5.50            #peak 1142 #SUP 0.89 #QF 0.89
 25 LYS+ HA     25 LYS+ HD2     5.50            #peak 1144 #SUP 0.99 #QF 0.99
 12 TYR  HN     26 ALA  HA      5.50            #peak 1148 #SUP 0.72 #QF 0.72
 12 TYR  HA     26 ALA  HA      5.50            #peak 1151 #SUP 0.39 #QF 0.39
 11 LEU  HA     26 ALA  HA      5.50            #peak 1152 #SUP 0.94 #QF 0.94
  9 ARG+ QD     27 GLY  HA1     5.50            #peak 1160 #SUP 0.45 #QF 0.45
 25 LYS+ HN     28 GLU- HA      5.50            #peak 1162 #SUP 0.52 #QF 0.52
 10 ALA  QB     28 GLU- HB2     5.50            #peak 1163 #SUP 0.99 #QF 0.99
 25 LYS+ HN     28 GLU- HG3     5.50            #peak 1169 #SUP 0.94 #QF 0.94
  9 ARG+ QG     29 GLU- HA      5.50            #peak 1171 #SUP 1.00
 29 GLU- HA     30 LEU  HG      5.50            #peak 1172 #SUP 0.72 #QF 0.72
  8 VAL  QG2    29 GLU- HA      5.50            #peak 1173 #SUP 0.85 #QF 0.85
 29 GLU- HG2    30 LEU  HN      5.50            #peak 1175 #SUP 0.96 #QF 0.96
 30 LEU  HB3    46 LEU  HA      5.50            #peak 1179 #SUP 0.69 #QF 0.69
 30 LEU  HB2    32 LYS+ HB2     5.50            #peak 1184 #SUP 0.49 #QF 0.49
  8 VAL  QG2    31 MET  HA      5.50            #peak 1200 #SUP 0.97 #QF 0.97
  8 VAL  QG1    31 MET  HA      5.50            #peak 1201 #SUP 0.82 #QF 0.82
  6 VAL  QQG    31 MET  HA      5.50            #peak 1202 #SUP 0.84 #QF 0.84
  6 VAL  HB     31 MET  HA      5.50            #peak 1203 #SUP 0.70 #QF 0.70
  5 GLY  HN     31 MET  QE      5.50            #peak 1207 #SUP 0.95 #QF 0.95
  5 GLY  HA2    31 MET  QE      5.50            #peak 1208 #SUP 0.96 #QF 0.96
  8 VAL  QG1    31 MET  QE      5.50            #peak 1210 #SUP 0.79 #QF 0.44
  8 VAL  QG2    31 MET  QE      5.50            #peak 1211 #SUP 0.83 #QF 0.83
 32 LYS+ HA     32 LYS+ QD      5.50            #peak 1219 #SUP 1.00 #QF 0.99
 32 LYS+ HB3    32 LYS+ HE2     5.50            #peak 1221 #SUP 0.79 #QF 0.79
 32 LYS+ HB3    32 LYS+ HE3     5.50            #peak 1222 #SUP 0.97 #QF 0.97
 32 LYS+ HE3    35 GLU- HA      5.50            #peak 1224 #SUP 0.94 #QF 0.94
 32 LYS+ HE3    33 ILE  HA      5.50            #peak 1225 #SUP 0.32 #QF 0.32
 32 LYS+ HE2    33 ILE  HA      5.50            #peak 1229 #SUP 0.38 #QF 0.38
 32 LYS+ HG2    33 ILE  HB      5.50            #peak 1232 #SUP 0.66 #QF 0.66
 33 ILE  HB     44 GLY  HA1     5.50            #peak 1233 #SUP 0.58 #QF 0.58
 33 ILE  QD1    43 LYS+ QG      5.50            #peak 1236 #SUP 0.99 #QF 0.98
 33 ILE  QD1    51 VAL  HB      5.50            #peak 1238 #SUP 0.60 #QF 0.60
 33 ILE  QD1    45 ARG+ HA      5.50            #peak 1239 #SUP 0.92 #QF 0.72
 33 ILE  QD1    51 VAL  HA      5.50            #peak 1239 #SUP 0.92 #QF 0.72
 33 ILE  QD1    44 GLY  HA1     5.50            #peak 1240 #SUP 0.56 #QF 0.56
 33 ILE  QG2    45 ARG+ HB2     5.50            #peak 1241 #SUP 0.99 #QF 0.99
 33 ILE  QG2    45 ARG+ QD      5.50            #peak 1243 #SUP 0.96 #QF 0.96
 36 GLU- HG3    37 ASP- HN      5.50            #peak 1256 #SUP 0.88 #QF 0.88
 32 LYS+ HG3    42 CYS  HB3     5.50            #peak 1273 #SUP 0.98 #QF 0.94
 42 CYS  HB3    56 ALA  QB      5.50            #peak 1273 #SUP 0.98 #QF 0.94
 32 LYS+ HB3    42 CYS  HB3     5.50            #peak 1274 #SUP 0.88 #QF 0.21
 32 LYS+ HG2    42 CYS  HB3     5.50            #peak 1274 #SUP 0.88 #QF 0.21
 33 ILE  QD1    43 LYS+ HE3     5.50            #peak 1278 #SUP 0.89 #QF 0.89
 44 GLY  HA1    54 TYR  QD      5.50            #peak 1283 #SUP 0.88 #QF 0.88
 45 ARG+ HA     52 GLY  HN      5.50            #peak 1284 #SUP 0.95 #QF 0.95
 45 ARG+ HA     46 LEU  QB      5.50            #peak 1285 #SUP 0.96 #QF 0.96
 22 LEU  HG     45 ARG+ HA      5.50            #peak 1287 #SUP 0.76 #QF 0.76
 22 LEU  QD2    45 ARG+ HA      5.50            #peak 1288 #SUP 0.96 #QF 0.76
 22 LEU  QD2    46 LEU  QB      5.50            #peak 1297 #SUP 0.93 #QF 0.82
 47 LEU  HN     48 THR  HA      5.50            #peak 1331 #SUP 0.51 #QF 0.51
 45 ARG+ QD     49 GLY  HA2     5.50            #peak 1334 #SUP 0.86 #QF 0.86
 51 VAL  HA     52 GLY  HA1     5.50            #peak 1337 #SUP 0.90 #QF 0.90
 51 VAL  HA     52 GLY  HA2     5.50            #peak 1338 #SUP 0.65 #QF 0.65
 51 VAL  HN     51 VAL  QG1     5.50            #peak 1345 #SUP 0.99 #QF 0.99
 21 GLU- HA     53 LEU  HB2     5.50            #peak 1355 #SUP 0.55 #QF 0.55
 43 LYS+ QG     53 LEU  QD2     5.50            #peak 1357 #SUP 1.00
 41 TRP  HB2    53 LEU  QD2     5.50            #peak 1362 #SUP 0.97 #QF 0.97
 53 LEU  HA     53 LEU  QD2     5.50            #peak 1365 #SUP 0.67 #QF 0.67
 53 LEU  HN     53 LEU  QD2     5.50            #peak 1367 #SUP 0.94 #QF 0.94
 43 LYS+ QG     53 LEU  QD1     5.50            #peak 1372 #SUP 0.93 #QF 0.84
 41 TRP  HB3    53 LEU  QD1     5.50            #peak 1373 #SUP 1.00 #QF 0.99
 41 TRP  HB2    53 LEU  QD1     5.50            #peak 1374 #SUP 0.94 #QF 0.94
 53 LEU  HA     53 LEU  QD1     5.50            #peak 1376 #SUP 1.00
 22 LEU  HG     54 TYR  HA      5.50            #peak 1381 #SUP 0.84 #QF 0.84
 55 PRO  HA     58 TYR  QD      5.50            #peak 1387 #SUP 0.88 #QF 0.88
 41 TRP  HZ3    55 PRO  HA      5.50            #peak 1388 #SUP 0.96 #QF 0.96
 41 TRP  HH2    55 PRO  HA      5.50            #peak 1389 #SUP 0.74 #QF 0.65
 54 TYR  QE     55 PRO  HA      5.50            #peak 1389 #SUP 0.74 #QF 0.65
 55 PRO  HB3    58 TYR  QD      5.50            #peak 1390 #SUP 0.81 #QF 0.42
 41 TRP  HH2    55 PRO  HD2     5.50            #peak 1391 #SUP 0.78 #QF 0.78
 53 LEU  HB3    55 PRO  HD3     5.50            #peak 1393 #SUP 0.54 #QF 0.54
 41 TRP  HZ2    55 PRO  HD3     5.50            #peak 1396 #SUP 1.00 #QF 0.98
 55 PRO  HD3    58 TYR  QD      5.50            #peak 1396 #SUP 1.00 #QF 0.98
 55 PRO  HG2    58 TYR  QB      5.50            #peak 1397 #SUP 0.96 #QF 0.96
 55 PRO  HG3    58 TYR  QB      5.50            #peak 1400 #SUP 0.96 #QF 0.96
 55 PRO  HG3    58 TYR  QD      5.50            #peak 1401 #SUP 0.99 #QF 0.99
 54 TYR  QD     56 ALA  HA      5.50            #peak 1403 #SUP 0.58 #QF 0.58
 42 CYS  HB2    56 ALA  HA      5.50            #peak 1407 #SUP 0.72 #QF 0.72
 55 PRO  HA     56 ALA  HA      5.50            #peak 1408 #SUP 0.93 #QF 0.93
 55 PRO  HD2    58 TYR  QB      5.50            #peak 1417 #SUP 0.99 #QF 0.98
 55 PRO  HB2    58 TYR  QB      5.50            #peak 1418 #SUP 0.75 #QF 0.75
 10 ALA  QB     59 VAL  HB      5.50            #peak 1424 #SUP 0.99 #QF 0.99
 11 LEU  QD2    60 GLU- HB3     5.50            #peak 1431 #SUP 0.62 #QF 0.62
 60 GLU- HB3    61 LYS+ HN      5.50            #peak 1434 #SUP 0.62 #QF 0.62
  8 VAL  QG2    61 LYS+ HA      5.50            #peak 1442 #SUP 0.98 #QF 0.98
  9 ARG+ HB3    62 VAL  HA      5.50            #peak 1448 #SUP 0.96 #QF 0.96
  9 ARG+ HB2    62 VAL  HA      5.50            #peak 1449 #SUP 0.47 #QF 0.22
 61 LYS+ HA     62 VAL  HA      5.50            #peak 1450 #SUP 0.88 #QF 0.88
 61 LYS+ HN     62 VAL  HB      5.50            #peak 1454 #SUP 0.43 #QF 0.43
 64 LEU  QB     65 ALA  HA      5.50            #peak 1485 #SUP 0.92 #QF 0.92
 65 ALA  QB     66 ALA  HN      5.50            #peak 1495 #SUP 0.92 #QF 0.92
 66 ALA  QB     67 ALA  HN      5.50            #peak 1519 #SUP 0.98 #QF 0.68
 64 LEU  QB     67 ALA  QB      5.50            #peak 1521 #SUP 0.79 #QF 0.73
 30 LEU  HA     46 LEU  QD1     5.50            #peak 1540 #SUP 0.88 #QF 0.52
 30 LEU  HA     47 LEU  HG      5.50            #peak 1541 #SUP 0.90 #QF 0.90
 46 LEU  HG     48 THR  QG2     5.50            #peak 1555 #SUP 0.49 #QF 0.49
 12 TYR  QD     58 TYR  QB      4.02            #peak 1 #SUP 0.49 #QF 0.49
 54 TYR  HN     54 TYR  QD      3.81            #peak 2 #SUP 0.91 #QF 0.91
 24 PHE  QE     54 TYR  QD      3.47            #peak 4 #SUP 0.70 #QF 0.70
 54 TYR  QD     55 PRO  HD2     3.55            #peak 6 #SUP 0.58 #QF 0.58
 11 LEU  HN     12 TYR  QD      4.30            #peak 10 #SUP 0.87 #QF 0.87
 12 TYR  HN     12 TYR  QD      3.32            #peak 12 #SUP 0.77 #QF 0.77
 44 GLY  HN     54 TYR  QD      3.82            #peak 18 #SUP 0.83 #QF 0.83
 54 TYR  QD     56 ALA  QB      4.54            #peak 21 #SUP 0.59 #QF 0.59
 14 TYR  HN     24 PHE  QD      4.01            #peak 30 #SUP 0.86 #QF 0.86
 24 PHE  QD     54 TYR  HB3     3.38            #peak 31 #SUP 0.61 #QF 0.61
 24 PHE  HN     24 PHE  QD      3.42            #peak 34 #SUP 0.64 #QF 0.64
 57 ASN  HN     58 TYR  QD      4.97            #peak 37 #SUP 0.83 #QF 0.83
 58 TYR  HN     58 TYR  QD      3.44            #peak 39 #SUP 0.85 #QF 0.85
 14 TYR  HB2    58 TYR  QD      3.96            #peak 42 #SUP 0.90 #QF 0.90
 55 PRO  HB2    58 TYR  QD      3.57            #peak 44 #SUP 0.93 #QF 0.93
 14 TYR  HB3    58 TYR  QD      3.96            #peak 45 #SUP 0.58 #QF 0.58
 24 PHE  QE     54 TYR  HB3     3.76            #peak 48 #SUP 0.75 #QF 0.75
 24 PHE  QE     55 PRO  HD2     3.51            #peak 49 #SUP 0.79 #QF 0.79
 24 PHE  HN     24 PHE  QE      4.63            #peak 52 #SUP 0.89 #QF 0.89
 14 TYR  HN     24 PHE  QE      4.50            #peak 53 #SUP 0.87 #QF 0.87
 24 PHE  QE     58 TYR  QB      3.86            #peak 56 #SUP 0.92 #QF 0.92
 24 PHE  QE     54 TYR  HB2     3.60            #peak 57 #SUP 0.91 #QF 0.91
 24 PHE  QE     30 LEU  QD1     4.68            #peak 60 #SUP 0.99 #QF 0.98
 24 PHE  QE     30 LEU  QD2     4.68            #peak 60 #SUP 0.99 #QF 0.98
 41 TRP  HB2    41 TRP  HD1     3.70            #peak 62 #SUP 0.94 #QF 0.94
 41 TRP  HB3    41 TRP  HD1     3.66            #peak 63 #SUP 0.72 #QF 0.72
 39 GLN  HB3    41 TRP  HD1     3.62            #peak 64 #SUP 0.90 #QF 0.90
 39 GLN  HB2    41 TRP  HD1     3.62            #peak 65 #SUP 0.87 #QF 0.87
 41 TRP  HN     41 TRP  HD1     3.96            #peak 67 #SUP 0.90 #QF 0.90
 24 PHE  HZ     58 TYR  HN      4.46            #peak 71 #SUP 0.95 #QF 0.95
 24 PHE  HZ     58 TYR  QB      3.85            #peak 73 #SUP 0.89 #QF 0.89
 24 PHE  HZ     54 TYR  HB2     4.51            #peak 75 #SUP 0.92 #QF 0.92
 24 PHE  HZ     55 PRO  HD2     3.69            #peak 76 #SUP 0.78 #QF 0.78
 41 TRP  HZ3    54 TYR  HN      4.28            #peak 84 #SUP 0.98 #QF 0.98
 41 TRP  HZ3    55 PRO  HD3     4.45            #peak 86 #SUP 0.79 #QF 0.79
 41 TRP  HZ3    53 LEU  QD2     5.21            #peak 87 #SUP 0.94 #QF 0.32
 41 TRP  HZ3    55 PRO  HG3     5.50            #peak 87 #SUP 0.94 #QF 0.32
 41 TRP  HZ3    42 CYS  HN      4.35            #peak 88 #SUP 0.81 #QF 0.81
 41 TRP  HZ3    54 TYR  HB2     4.70            #peak 91 #SUP 0.54 #QF 0.54
 41 TRP  HZ3    55 PRO  HD2     5.17            #peak 92 #SUP 1.00 #QF 0.48
 41 TRP  HZ3    53 LEU  HB3     3.75            #peak 93 #SUP 0.89 #QF 0.89
 41 TRP  HH2    55 PRO  HD3     4.08            #peak 95 #SUP 0.94 #QF 0.94
 21 GLU- HB2    41 TRP  HH2     4.41            #peak 96 #SUP 0.96 #QF 0.96
 41 TRP  HH2    54 TYR  HN      5.50            #peak 97 #SUP 0.63 #QF 0.63
 41 TRP  HH2    53 LEU  HB3     4.14            #peak 99 #SUP 0.98 #QF 0.98
 41 TRP  HH2    55 PRO  HG3     5.14            #peak 100 #SUP 1.00
 12 TYR  HB3    14 TYR  QE      4.56            #peak 105 #SUP 0.47 #QF 0.47
 12 TYR  HB2    14 TYR  QE      4.56            #peak 107 #SUP 0.84 #QF 0.79
 55 PRO  HB2    58 TYR  QE      4.12            #peak 108 #SUP 0.87 #QF 0.87
 12 TYR  QE     58 TYR  QB      4.58            #peak 111 #SUP 0.77 #QF 0.77
 33 ILE  HN     54 TYR  QE      4.12            #peak 117 #SUP 0.56 #QF 0.56
 43 LYS+ HN     54 TYR  QE      4.72            #peak 118 #SUP 0.90 #QF 0.90
 24 PHE  QE     54 TYR  QE      4.90            #peak 119 #SUP 0.91 #QF 0.91
 54 TYR  QE     56 ALA  HA      4.35            #peak 121 #SUP 0.86 #QF 0.86
 42 CYS  HB3    54 TYR  QE      4.00            #peak 123 #SUP 0.77 #QF 0.77
  8 VAL  QG2    54 TYR  QE      4.02            #peak 125 #SUP 0.68 #QF 0.68
 32 LYS+ HN     54 TYR  QE      5.07            #peak 127 #SUP 0.99 #QF 0.48
 54 TYR  HN     54 TYR  QE      5.43            #peak 127 #SUP 0.99 #QF 0.48
 44 GLY  HN     54 TYR  QE      4.40            #peak 129 #SUP 0.92 #QF 0.92
 32 LYS+ HG3    54 TYR  QE      3.79            #peak 130 #SUP 0.54 #QF 0.54
 12 TYR  QD     13 ASP- HN      4.33            #peak 136 #SUP 0.71 #QF 0.71
 12 TYR  HA     12 TYR  QD      4.93            #peak 137 #SUP 0.85 #QF 0.65
 12 TYR  QD     58 TYR  HA      5.09            #peak 137 #SUP 0.85 #QF 0.65
 11 LEU  HN     12 TYR  QE      4.93            #peak 145 #SUP 0.91 #QF 0.91
 14 TYR  HN     14 TYR  QD      3.88            #peak 148 #SUP 0.54 #QF 0.54
 55 PRO  HG2    58 TYR  QE      4.67            #peak 150 #SUP 0.99 #QF 0.99
 58 TYR  HA     58 TYR  QE      4.76            #peak 157 #SUP 0.81 #QF 0.81
 58 TYR  HN     58 TYR  QE      5.05            #peak 158 #SUP 0.95 #QF 0.95
 24 PHE  QE     59 VAL  HA      5.50            #peak 161 #SUP 0.93 #QF 0.93
 24 PHE  HZ     55 PRO  HB2     4.86            #peak 164 #SUP 0.98 #QF 0.98
 10 ALA  QB     24 PHE  HZ      4.03            #peak 165 #SUP 0.42 #QF 0.42
 11 LEU  HN     24 PHE  HZ      5.50            #peak 167 #SUP 0.71 #QF 0.71
 39 GLN  HN     41 TRP  HD1     4.92            #peak 170 #SUP 0.70 #QF 0.70
 39 GLN  HA     41 TRP  HD1     5.50            #peak 175 #SUP 0.61 #QF 0.61
 41 TRP  HD1    53 LEU  QD1     5.50            #peak 180 #SUP 0.77 #QF 0.77
 41 TRP  HD1    53 LEU  QD2     5.50            #peak 181 #SUP 0.95 #QF 0.95
 41 TRP  HA     41 TRP  HE3     4.52            #peak 182 #SUP 0.85 #QF 0.85
 41 TRP  HE3    55 PRO  HD3     4.50            #peak 184 #SUP 0.87 #QF 0.87
 41 TRP  HE3    55 PRO  HD2     5.41            #peak 185 #SUP 1.00
 41 TRP  HE3    55 PRO  HB3     5.01            #peak 187 #SUP 0.73 #QF 0.73
 21 GLU- QG     41 TRP  HH2     4.61            #peak 191 #SUP 0.80 #QF 0.80
 21 GLU- HB3    41 TRP  HH2     4.41            #peak 192 #SUP 0.95 #QF 0.95
 41 TRP  HZ2    53 LEU  HB3     4.86            #peak 201 #SUP 0.56 #QF 0.56
 41 TRP  HZ3    53 LEU  QD1     5.21            #peak 204 #SUP 0.73 #QF 0.73
 42 CYS  HN     54 TYR  QD      5.10            #peak 205 #SUP 0.91 #QF 0.83
 52 GLY  HN     54 TYR  QD      5.50            #peak 205 #SUP 0.91 #QF 0.83
 44 GLY  HA2    54 TYR  QD      3.77            #peak 207 #SUP 0.96 #QF 0.96
 42 CYS  HB2    54 TYR  QD      4.55            #peak 211 #SUP 0.93 #QF 0.93
 44 GLY  HA1    54 TYR  QE      5.50            #peak 212 #SUP 0.76 #QF 0.76
 44 GLY  HA2    54 TYR  QE      4.67            #peak 214 #SUP 0.79 #QF 0.79
 32 LYS+ HG2    54 TYR  QE      4.86            #peak 215 #SUP 0.98 #QF 0.98
 30 LEU  HB2    54 TYR  QE      4.83            #peak 216 #SUP 0.96 #QF 0.66
 54 TYR  QE     59 VAL  HB      5.09            #peak 216 #SUP 0.96 #QF 0.66
 42 CYS  HB2    54 TYR  QE      3.98            #peak 217 #SUP 0.55 #QF 0.55
 46 LEU  QB     50 HIS  HD2     4.71            #peak 226 #SUP 0.96 #QF 0.96
 39 GLN  HB2    41 TRP  HE1     5.50            #peak 2 #SUP 0.84 #QF 0.84
 39 GLN  HB3    41 TRP  HE1     5.50            #peak 3 #SUP 0.98 #QF 0.98
  7 ARG+ HN      8 VAL  HN      5.50            #peak 4 #SUP 0.96 #QF 0.96
  7 ARG+ HN      7 ARG+ QD      5.50            #peak 7 #SUP 0.98 #QF 0.98
  6 VAL  HB      7 ARG+ HN      5.50            #peak 8 #SUP 1.00
  7 ARG+ HN      7 ARG+ HG2     5.50            #peak 11 #SUP 0.96 #QF 0.96
  6 VAL  QQG     7 ARG+ HN      5.50            #peak 12 #SUP 0.64 #QF 0.64
 41 TRP  HA     56 ALA  HN      5.50            #peak 14 #SUP 0.88 #QF 0.88
 10 ALA  HN     29 GLU- HN      5.50            #peak 20 #SUP 0.96 #QF 0.96
 10 ALA  HN     26 ALA  HA      5.50            #peak 21 #SUP 0.66 #QF 0.66
 32 LYS+ HN     33 ILE  HN      5.50            #peak 22 #SUP 1.00 #QF 0.86
  5 GLY  HA1    32 LYS+ HN      5.50            #peak 25 #SUP 0.83 #QF 0.83
  8 VAL  QG1    32 LYS+ HN      5.50            #peak 28 #SUP 0.99 #QF 0.96
 32 LYS+ HN     33 ILE  QG2     5.50            #peak 28 #SUP 0.99 #QF 0.96
  8 VAL  QG2    32 LYS+ HN      5.50            #peak 29 #SUP 0.99 #QF 0.99
  6 VAL  QQG    32 LYS+ HN      5.50            #peak 31 #SUP 0.71 #QF 0.71
 10 ALA  HN     28 GLU- HN      5.50            #peak 33 #SUP 0.96 #QF 0.96
 10 ALA  HN     29 GLU- HA      5.50            #peak 34 #SUP 0.96 #QF 0.96
 10 ALA  HN     28 GLU- HB3     5.50            #peak 37 #SUP 0.71 #QF 0.60
 10 ALA  HN     29 GLU- HG3     5.50            #peak 37 #SUP 0.71 #QF 0.60
 10 ALA  HN     59 VAL  QG1     5.50            #peak 40 #SUP 1.00
 11 LEU  HN     59 VAL  HA      5.50            #peak 45 #SUP 0.99 #QF 0.99
 10 ALA  QB     11 LEU  HN      5.50            #peak 48 #SUP 1.00 #QF 0.93
 11 LEU  HN     11 LEU  HG      5.50            #peak 48 #SUP 1.00 #QF 0.93
 36 GLU- HG2    37 ASP- HN      5.50            #peak 56 #SUP 0.99 #QF 0.99
 14 TYR  HB3    15 THR  HN      5.50            #peak 59 #SUP 0.99 #QF 0.99
 14 TYR  HN     15 THR  HN      5.50            #peak 60 #SUP 0.97 #QF 0.97
 14 TYR  QD     15 THR  HN      5.50            #peak 61 #SUP 0.94 #QF 0.94
 14 TYR  HB2    15 THR  HN      5.50            #peak 65 #SUP 0.95 #QF 0.95
 15 THR  HN     15 THR  QG2     5.50            #peak 66 #SUP 1.00
 50 HIS  HN     51 VAL  HN      5.50            #peak 72 #SUP 0.96 #QF 0.96
 50 HIS  HB3    51 VAL  HN      5.50            #peak 75 #SUP 1.00
 50 HIS  HB2    51 VAL  HN      5.50            #peak 76 #SUP 1.00
 17 GLN  HN     17 GLN  HG2     5.50            #peak 84 #SUP 1.00
 41 TRP  HN     42 CYS  HN      5.50            #peak 86 #SUP 1.00
 39 GLN  HN     41 TRP  HN      5.50            #peak 87 #SUP 0.95 #QF 0.95
 36 GLU- HN     56 ALA  QB      5.50            #peak 95 #SUP 0.84 #QF 0.37
 41 TRP  HN     56 ALA  QB      5.50            #peak 95 #SUP 0.84 #QF 0.37
 35 GLU- HB2    36 GLU- HN      5.50            #peak 99 #SUP 0.98 #QF 0.98
 35 GLU- HB3    36 GLU- HN      5.50            #peak 100 #SUP 1.00
  3 VAL  HN      3 VAL  QG1     5.50            #peak 103 #SUP 1.00
  3 VAL  HN      3 VAL  QG2     5.50            #peak 103 #SUP 1.00
  8 VAL  QG1    61 LYS+ HN      5.50            #peak 104 #SUP 0.77 #QF 0.77
 60 GLU- HB2    61 LYS+ HN      5.50            #peak 107 #SUP 0.91 #QF 0.91
  8 VAL  HB     61 LYS+ HN      5.50            #peak 108 #SUP 0.92 #QF 0.92
 61 LYS+ HN     61 LYS+ HG2     5.50            #peak 109 #SUP 0.98 #QF 0.98
 18 GLU- QG     19 ALA  HN      5.50            #peak 113 #SUP 0.74 #QF 0.74
  9 ARG+ HA     28 GLU- HN      5.50            #peak 117 #SUP 0.60 #QF 0.60
 26 ALA  HA     28 GLU- HN      5.50            #peak 119 #SUP 0.99 #QF 0.99
 10 ALA  QB     28 GLU- HN      5.50            #peak 121 #SUP 1.00
 30 LEU  HA     47 LEU  HN      5.50            #peak 124 #SUP 0.96 #QF 0.96
 46 LEU  QD1    47 LEU  HN      5.50            #peak 128 #SUP 1.00 #QF 0.99
 47 LEU  HN     47 LEU  QD2     5.50            #peak 129 #SUP 1.00
 47 LEU  HN     47 LEU  QD1     5.50            #peak 130 #SUP 1.00
 46 LEU  QD2    47 LEU  HN      5.50            #peak 131 #SUP 0.63 #QF 0.63
 24 PHE  QD     26 ALA  HN      5.50            #peak 133 #SUP 0.49 #QF 0.49
 13 ASP- HA     26 ALA  HN      5.50            #peak 135 #SUP 0.79 #QF 0.79
 13 ASP- HB3    26 ALA  HN      5.50            #peak 137 #SUP 1.00
 25 LYS+ HB3    26 ALA  HN      5.50            #peak 138 #SUP 1.00
 25 LYS+ HB2    26 ALA  HN      5.50            #peak 139 #SUP 0.99 #QF 0.94
 25 LYS+ QG     26 ALA  HN      5.50            #peak 140 #SUP 0.96 #QF 0.96
  8 VAL  HA     62 VAL  HN      5.50            #peak 142 #SUP 0.92 #QF 0.92
 62 VAL  HN     62 VAL  QG1     5.50            #peak 146 #SUP 0.60 #QF 0.60
 61 LYS+ HN     62 VAL  HN      5.50            #peak 148 #SUP 1.00
 32 LYS+ HG2    33 ILE  HN      5.50            #peak 149 #SUP 0.93 #QF 0.82
 33 ILE  HN     44 GLY  HA1     5.50            #peak 152 #SUP 0.98 #QF 0.98
 33 ILE  HN     44 GLY  HA2     5.50            #peak 154 #SUP 0.94 #QF 0.94
 22 LEU  HN     53 LEU  HN      5.50            #peak 156 #SUP 0.96 #QF 0.96
 22 LEU  HN     52 GLY  HA1     5.50            #peak 159 #SUP 0.81 #QF 0.81
 22 LEU  HN     52 GLY  HA2     5.50            #peak 160 #SUP 0.97 #QF 0.97
 29 GLU- HN     29 GLU- HG3     5.50            #peak 166 #SUP 1.00
  9 ARG+ HA     29 GLU- HN      5.50            #peak 168 #SUP 0.93 #QF 0.93
 42 CYS  HB3    43 LYS+ HN      5.50            #peak 175 #SUP 0.99 #QF 0.99
 43 LYS+ HN     53 LEU  HG      5.50            #peak 176 #SUP 0.70 #QF 0.56
 43 LYS+ HN     43 LYS+ QG      5.50            #peak 177 #SUP 0.99 #QF 0.99
 25 LYS+ HN     28 GLU- HN      5.50            #peak 179 #SUP 0.99 #QF 0.99
 24 PHE  QD     25 LYS+ HN      5.50            #peak 180 #SUP 0.82 #QF 0.82
 24 PHE  HB3    25 LYS+ HN      5.50            #peak 183 #SUP 0.94 #QF 0.94
 24 PHE  HB2    25 LYS+ HN      5.50            #peak 184 #SUP 1.00
 25 LYS+ HN     25 LYS+ QG      5.50            #peak 186 #SUP 0.97 #QF 0.97
  8 VAL  HN     31 MET  HA      5.50            #peak 188 #SUP 0.97 #QF 0.97
  8 VAL  HN      8 VAL  QG1     5.50            #peak 191 #SUP 0.91 #QF 0.91
  8 VAL  HN      8 VAL  QG2     5.50            #peak 192 #SUP 0.98 #QF 0.98
 21 GLU- HA     53 LEU  HN      5.50            #peak 193 #SUP 0.99 #QF 0.91
 53 LEU  HN     53 LEU  HG      5.50            #peak 195 #SUP 1.00 #QF 0.59
 53 LEU  HN     53 LEU  QD1     5.50            #peak 196 #SUP 1.00
 43 LYS+ QG     53 LEU  HN      5.50            #peak 199 #SUP 0.96 #QF 0.96
  6 VAL  HN     32 LYS+ HN      5.50            #peak 200 #SUP 0.98 #QF 0.98
  6 VAL  HN      7 ARG+ HN      5.50            #peak 201 #SUP 1.00
  6 VAL  HN     31 MET  HA      5.50            #peak 202 #SUP 0.96 #QF 0.96
  6 VAL  HN      6 VAL  QQG     5.50            #peak 207 #SUP 0.94 #QF 0.22
  6 VAL  HN      8 VAL  QG1     5.50            #peak 208 #SUP 0.92 #QF 0.41
  6 VAL  HN     33 ILE  QG2     5.50            #peak 208 #SUP 0.92 #QF 0.41
 46 LEU  HN     50 HIS  HN      5.50            #peak 209 #SUP 1.00
 46 LEU  QB     50 HIS  HN      5.50            #peak 215 #SUP 1.00
 46 LEU  QD2    50 HIS  HN      5.50            #peak 216 #SUP 0.76 #QF 0.76
 45 ARG+ HA     50 HIS  HN      5.50            #peak 220 #SUP 0.99 #QF 0.91
 50 HIS  HN     51 VAL  HA      5.50            #peak 220 #SUP 0.99 #QF 0.91
 31 MET  HB3    45 ARG+ HN      5.50            #peak 221 #SUP 0.98 #QF 0.98
 31 MET  HB2    45 ARG+ HN      5.50            #peak 228 #SUP 1.00 #QF 0.75
 33 ILE  QG2    45 ARG+ HN      5.50            #peak 230 #SUP 0.98 #QF 0.94
 45 ARG+ HN     46 LEU  HN      5.50            #peak 231 #SUP 1.00
 32 LYS+ HA     45 ARG+ HN      5.50            #peak 232 #SUP 0.74 #QF 0.28
 14 TYR  HN     26 ALA  HN      5.50            #peak 233 #SUP 0.99 #QF 0.99
 14 TYR  HN     25 LYS+ HA      5.50            #peak 236 #SUP 0.96 #QF 0.96
 13 ASP- HB3    14 TYR  HN      5.50            #peak 239 #SUP 1.00
 13 ASP- HB2    14 TYR  HN      5.50            #peak 240 #SUP 1.00 #QF 0.96
 10 ALA  QB     14 TYR  HN      5.50            #peak 242 #SUP 0.38 #QF 0.38
  9 ARG+ HN     59 VAL  HA      5.50            #peak 245 #SUP 0.89 #QF 0.89
  9 ARG+ HN     61 LYS+ HA      5.50            #peak 246 #SUP 0.99 #QF 0.99
 54 TYR  QD     58 TYR  HN      5.50            #peak 249 #SUP 1.00 #QF 0.84
 55 PRO  HB2    58 TYR  HN      5.50            #peak 254 #SUP 0.97 #QF 0.97
 56 ALA  QB     58 TYR  HN      5.50            #peak 255 #SUP 0.90 #QF 0.90
 58 TYR  HN     59 VAL  QG2     5.50            #peak 256 #SUP 0.99 #QF 0.99
 58 TYR  HN     59 VAL  QG1     5.50            #peak 257 #SUP 0.69 #QF 0.69
  9 ARG+ HN      9 ARG+ QD      5.50            #peak 259 #SUP 0.80 #QF 0.80
  8 VAL  HB      9 ARG+ HN      5.50            #peak 260 #SUP 0.99 #QF 0.99
  8 VAL  QG2     9 ARG+ HN      5.50            #peak 262 #SUP 0.98 #QF 0.98
  9 ARG+ HN     62 VAL  HN      5.50            #peak 264 #SUP 0.95 #QF 0.95
  8 VAL  QG1     9 ARG+ HN      5.50            #peak 266 #SUP 0.96 #QF 0.96
 13 ASP- HN     26 ALA  HN      5.50            #peak 268 #SUP 0.98 #QF 0.98
 12 TYR  HB2    13 ASP- HN      5.50            #peak 270 #SUP 0.95 #QF 0.95
 12 TYR  HB3    13 ASP- HN      5.50            #peak 272 #SUP 0.90 #QF 0.90
 13 ASP- HN     26 ALA  QB      5.50            #peak 273 #SUP 0.97 #QF 0.97
 19 ALA  HA     21 GLU- HN      5.50            #peak 276 #SUP 0.79 #QF 0.79
 16 GLY  HA2    21 GLU- HN      5.50            #peak 277 #SUP 0.75 #QF 0.75
 19 ALA  QB     21 GLU- HN      5.50            #peak 282 #SUP 0.93 #QF 0.93
 42 CYS  HN     55 PRO  HA      5.50            #peak 286 #SUP 0.89 #QF 0.89
 42 CYS  HN     56 ALA  QB      5.50            #peak 288 #SUP 0.93 #QF 0.93
 42 CYS  HN     53 LEU  HA      5.50            #peak 289 #SUP 0.91 #QF 0.91
 41 TRP  HB2    42 CYS  HN      5.50            #peak 291 #SUP 0.98 #QF 0.98
  8 VAL  HN     30 LEU  HN      5.50            #peak 294 #SUP 0.99 #QF 0.99
 30 LEU  HN     30 LEU  HG      5.50            #peak 296 #SUP 0.70 #QF 0.70
 11 LEU  HN     60 GLU- HN      5.50            #peak 298 #SUP 0.92 #QF 0.92
  9 ARG+ HN     60 GLU- HN      5.50            #peak 299 #SUP 0.99 #QF 0.99
 10 ALA  HA     60 GLU- HN      5.50            #peak 302 #SUP 0.67 #QF 0.67
 59 VAL  HB     60 GLU- HN      5.50            #peak 303 #SUP 0.88 #QF 0.88
 10 ALA  QB     60 GLU- HN      5.50            #peak 304 #SUP 0.99 #QF 0.65
 11 LEU  HG     60 GLU- HN      5.50            #peak 304 #SUP 0.99 #QF 0.65
 59 VAL  QG2    60 GLU- HN      5.50            #peak 305 #SUP 0.94 #QF 0.92
 59 VAL  QG1    60 GLU- HN      5.50            #peak 306 #SUP 0.99 #QF 0.99
  9 ARG+ HA     30 LEU  HN      5.50            #peak 307 #SUP 0.94 #QF 0.94
 29 GLU- HG3    30 LEU  HN      5.50            #peak 309 #SUP 1.00
 29 GLU- QB     30 LEU  HN      5.50            #peak 310 #SUP 0.91 #QF 0.91
  8 VAL  QG2    30 LEU  HN      5.50            #peak 312 #SUP 1.00
  7 ARG+ HA     30 LEU  HN      5.50            #peak 313 #SUP 0.63 #QF 0.63
 42 CYS  HN     54 TYR  HN      5.50            #peak 317 #SUP 0.99 #QF 0.96
 43 LYS+ HA     54 TYR  HN      5.50            #peak 321 #SUP 0.91 #QF 0.91
 41 TRP  HB3    54 TYR  HN      5.50            #peak 322 #SUP 0.82 #QF 0.82
 53 LEU  QD1    54 TYR  HN      5.50            #peak 323 #SUP 0.99 #QF 0.99
 53 LEU  QD2    54 TYR  HN      5.50            #peak 324 #SUP 0.98 #QF 0.98
 44 GLY  HN     54 TYR  HN      5.50            #peak 325 #SUP 0.87 #QF 0.87
 54 TYR  HN     55 PRO  HD2     5.50            #peak 328 #SUP 0.95 #QF 0.95
 53 LEU  HG     54 TYR  HN      5.50            #peak 329 #SUP 0.87 #QF 0.23
 43 LYS+ QG     54 TYR  HN      5.50            #peak 330 #SUP 0.93 #QF 0.82
 53 LEU  HB2    54 TYR  HN      5.50            #peak 330 #SUP 0.93 #QF 0.82
 38 GLU- HN     39 GLN  HN      5.50            #peak 337 #SUP 1.00
 38 GLU- HN     40 GLY  HN      5.50            #peak 338 #SUP 0.94 #QF 0.94
 37 ASP- HB3    38 GLU- HN      5.50            #peak 341 #SUP 1.00
 37 ASP- HB2    38 GLU- HN      5.50            #peak 342 #SUP 0.96 #QF 0.96
 38 GLU- HN     38 GLU- QG      5.50            #peak 343 #SUP 0.99 #QF 0.99
 33 ILE  HN     34 SER  HN      5.50            #peak 345 #SUP 0.99 #QF 0.99
 34 SER  HN     44 GLY  HA1     5.50            #peak 346 #SUP 0.91 #QF 0.91
 34 SER  HN     42 CYS  HB3     5.50            #peak 350 #SUP 0.78 #QF 0.78
 33 ILE  HB     34 SER  HN      5.50            #peak 351 #SUP 1.00
 32 LYS+ HG2    34 SER  HN      5.50            #peak 352 #SUP 0.99 #QF 0.99
 34 SER  HN     43 LYS+ QB      5.50            #peak 353 #SUP 0.64 #QF 0.64
 32 LYS+ HG3    34 SER  HN      5.50            #peak 354 #SUP 0.98 #QF 0.98
 33 ILE  QG2    34 SER  HN      5.50            #peak 355 #SUP 1.00
 14 TYR  HN     24 PHE  HN      5.50            #peak 356 #SUP 1.00
 15 THR  HA     24 PHE  HN      5.50            #peak 359 #SUP 0.71 #QF 0.71
 34 SER  HN     43 LYS+ HN      5.50            #peak 360 #SUP 1.00
 32 LYS+ HE2    34 SER  HN      5.50            #peak 361 #SUP 0.96 #QF 0.85
 32 LYS+ HE3    34 SER  HN      5.50            #peak 361 #SUP 0.96 #QF 0.85
 23 SER  HB3    24 PHE  HN      5.50            #peak 364 #SUP 0.95 #QF 0.95
 23 SER  HB2    24 PHE  HN      5.50            #peak 365 #SUP 0.98 #QF 0.83
 14 TYR  HB3    24 PHE  HN      5.50            #peak 367 #SUP 0.88 #QF 0.88
 34 SER  HB2    35 GLU- HN      5.50            #peak 370 #SUP 0.97 #QF 0.97
 34 SER  HB3    35 GLU- HN      5.50            #peak 371 #SUP 0.99 #QF 0.99
 35 GLU- HN     35 GLU- HG2     5.50            #peak 372 #SUP 1.00
 14 TYR  QD     16 GLY  HN      5.50            #peak 374 #SUP 0.68 #QF 0.68
 15 THR  HB     16 GLY  HN      5.50            #peak 377 #SUP 0.95 #QF 0.91
 15 THR  QG2    16 GLY  HN      5.50            #peak 379 #SUP 1.00
 30 LEU  HB2    31 MET  HN      5.50            #peak 382 #SUP 0.99 #QF 0.94
 30 LEU  HB3    31 MET  HN      5.50            #peak 383 #SUP 1.00
 31 MET  HN     45 ARG+ HN      5.50            #peak 384 #SUP 1.00
 31 MET  HN     31 MET  HG2     5.50            #peak 386 #SUP 1.00
 31 MET  HN     46 LEU  HG      5.50            #peak 388 #SUP 0.94 #QF 0.25
 17 GLN  HN     18 GLU- HN      5.50            #peak 389 #SUP 1.00
 18 GLU- HN     21 GLU- HN      5.50            #peak 390 #SUP 1.00
 16 GLY  HA1    18 GLU- HN      5.50            #peak 393 #SUP 0.69 #QF 0.69
 16 GLY  HA2    18 GLU- HN      5.50            #peak 394 #SUP 0.93 #QF 0.93
 18 GLU- HN     21 GLU- HB2     5.50            #peak 395 #SUP 0.97 #QF 0.97
 18 GLU- HN     18 GLU- QG      5.50            #peak 396 #SUP 0.99 #QF 0.79
 18 GLU- HB3    20 ASP- HN      5.50            #peak 398 #SUP 0.99 #QF 0.99
 20 ASP- HN     21 GLU- HN      5.50            #peak 399 #SUP 1.00
 18 GLU- HB2    20 ASP- HN      5.50            #peak 404 #SUP 0.99 #QF 0.98
 19 ALA  QB     20 ASP- HN      5.50            #peak 405 #SUP 1.00
 12 TYR  HN     59 VAL  HA      5.50            #peak 406 #SUP 0.98 #QF 0.98
 62 VAL  HB     63 GLY  HN      5.50            #peak 408 #SUP 0.98 #QF 0.98
 11 LEU  HN     12 TYR  HN      5.50            #peak 409 #SUP 0.89 #QF 0.89
 10 ALA  HA     12 TYR  HN      5.50            #peak 411 #SUP 0.98 #QF 0.98
 10 ALA  QB     12 TYR  HN      5.50            #peak 415 #SUP 0.99 #QF 0.97
 11 LEU  HB2    12 TYR  HN      5.50            #peak 416 #SUP 0.73 #QF 0.73
 11 LEU  HB3    12 TYR  HN      5.50            #peak 418 #SUP 0.99 #QF 0.99
 44 GLY  HN     53 LEU  HA      5.50            #peak 424 #SUP 0.96 #QF 0.96
 43 LYS+ QB     44 GLY  HN      5.50            #peak 427 #SUP 0.74 #QF 0.64
 43 LYS+ QG     44 GLY  HN      5.50            #peak 428 #SUP 0.98 #QF 0.98
 27 GLY  HN     28 GLU- HN      5.50            #peak 433 #SUP 0.97 #QF 0.97
  9 ARG+ QD     27 GLY  HN      5.50            #peak 435 #SUP 0.69 #QF 0.69
 10 ALA  QB     27 GLY  HN      5.50            #peak 436 #SUP 0.76 #QF 0.76
 26 ALA  HN     27 GLY  HN      5.50            #peak 437 #SUP 0.99 #QF 0.99
 44 GLY  HN     52 GLY  HN      5.50            #peak 438 #SUP 0.99 #QF 0.99
 46 LEU  HN     52 GLY  HN      5.50            #peak 439 #SUP 0.73 #QF 0.73
 51 VAL  HN     52 GLY  HN      5.50            #peak 440 #SUP 1.00
 43 LYS+ HA     52 GLY  HN      5.50            #peak 442 #SUP 0.67 #QF 0.67
 51 VAL  HB     52 GLY  HN      5.50            #peak 445 #SUP 0.98 #QF 0.98
 51 VAL  QG1    52 GLY  HN      5.50            #peak 448 #SUP 0.97 #QF 0.97
 22 LEU  QD2    52 GLY  HN      5.50            #peak 449 #SUP 0.83 #QF 0.73
 57 ASN  HN     58 TYR  HN      5.50            #peak 451 #SUP 1.00
 56 ALA  QB     57 ASN  HN      5.50            #peak 456 #SUP 0.99 #QF 0.99
 46 LEU  HN     49 GLY  HN      5.50            #peak 457 #SUP 0.91 #QF 0.91
 49 GLY  HN     50 HIS  HN      5.50            #peak 458 #SUP 0.61 #QF 0.61
 46 LEU  QB     49 GLY  HN      5.50            #peak 461 #SUP 1.00
 48 THR  QG2    49 GLY  HN      5.50            #peak 462 #SUP 0.97 #QF 0.97
 23 SER  HN     24 PHE  HN      5.50            #peak 463 #SUP 0.97 #QF 0.97
 22 LEU  HB2    23 SER  HN      5.50            #peak 468 #SUP 1.00
 22 LEU  HB3    23 SER  HN      5.50            #peak 469 #SUP 0.99 #QF 0.99
 23 SER  HN     46 LEU  QD2     5.50            #peak 470 #SUP 0.97 #QF 0.97
 58 TYR  HN     59 VAL  HN      5.50            #peak 472 #SUP 1.00
 57 ASN  HA     59 VAL  HN      5.50            #peak 474 #SUP 0.61 #QF 0.61
 58 TYR  QB     59 VAL  HN      5.50            #peak 476 #SUP 0.99 #QF 0.99
 56 ALA  QB     59 VAL  HN      5.50            #peak 478 #SUP 0.97 #QF 0.59
 59 VAL  HN     59 VAL  QG2     5.50            #peak 479 #SUP 0.99 #QF 0.99
 59 VAL  HN     59 VAL  QG1     5.50            #peak 480 #SUP 1.00
 40 GLY  HN     41 TRP  HN      5.50            #peak 481 #SUP 0.93 #QF 0.93
 39 GLN  HN     40 GLY  HN      5.50            #peak 482 #SUP 1.00
 40 GLY  HN     41 TRP  HD1     5.50            #peak 483 #SUP 0.68 #QF 0.68
  5 GLY  HN     33 ILE  QG2     5.50            #peak 489 #SUP 0.99 #QF 0.99
  5 GLY  HN      6 VAL  HN      5.50            #peak 491 #SUP 0.91 #QF 0.91
  5 GLY  HN      6 VAL  QQG     5.50            #peak 497 #SUP 0.76 #QF 0.30
 47 LEU  HN     48 THR  HN      5.50            #peak 498 #SUP 0.99 #QF 0.99
 48 THR  HN     49 GLY  HN      5.50            #peak 499 #SUP 1.00
 46 LEU  HA     48 THR  HN      5.50            #peak 500 #SUP 0.96 #QF 0.96
 46 LEU  QB     48 THR  HN      5.50            #peak 503 #SUP 0.98 #QF 0.98
 48 THR  HN     48 THR  QG2     5.50            #peak 505 #SUP 1.00
 46 LEU  QD1    48 THR  HN      5.50            #peak 506 #SUP 1.00 #QF 0.96
  5 GLY  HN     31 MET  HB2     5.50            #peak 507 #SUP 0.68 #QF 0.68
  5 GLY  HN     31 MET  HB3     5.50            #peak 508 #SUP 0.92 #QF 0.86
  6 VAL  HN     32 LYS+ QD      5.50            #peak 510 #SUP 0.89 #QF 0.89
  6 VAL  HN     32 LYS+ HG3     5.50            #peak 511 #SUP 0.85 #QF 0.85
  8 VAL  HN     32 LYS+ HN      5.50            #peak 513 #SUP 0.92 #QF 0.92
  7 ARG+ QD      8 VAL  HN      5.50            #peak 515 #SUP 0.54 #QF 0.54
 10 ALA  HN     28 GLU- HB2     5.50            #peak 517 #SUP 0.77 #QF 0.60
 10 ALA  HN     29 GLU- HG2     5.50            #peak 517 #SUP 0.77 #QF 0.60
 10 ALA  HN     59 VAL  HB      5.50            #peak 518 #SUP 0.81 #QF 0.81
 10 ALA  HN     59 VAL  QG2     5.50            #peak 519 #SUP 0.74 #QF 0.67
 11 LEU  HN     59 VAL  HB      5.50            #peak 523 #SUP 0.98 #QF 0.98
 11 LEU  HN     12 TYR  HA      5.50            #peak 525 #SUP 0.91 #QF 0.91
 10 ALA  HN     11 LEU  HN      5.50            #peak 526 #SUP 0.90 #QF 0.90
 12 TYR  HN     58 TYR  QB      5.50            #peak 529 #SUP 0.91 #QF 0.91
 12 TYR  HN     27 GLY  HN      5.50            #peak 530 #SUP 0.79 #QF 0.79
 12 TYR  HN     13 ASP- HN      5.50            #peak 531 #SUP 0.98 #QF 0.98
 16 GLY  HN     17 GLN  HN      5.50            #peak 538 #SUP 0.99 #QF 0.99
 18 GLU- HN     19 ALA  QB      5.50            #peak 543 #SUP 0.83 #QF 0.83
 18 GLU- HN     21 GLU- QG      5.50            #peak 545 #SUP 0.99 #QF 0.98
 18 GLU- HN     21 GLU- HB3     5.50            #peak 547 #SUP 0.63 #QF 0.63
 18 GLU- HN     21 GLU- HA      5.50            #peak 549 #SUP 0.92 #QF 0.92
 18 GLU- HN     20 ASP- HN      5.50            #peak 550 #SUP 0.90 #QF 0.90
 18 GLU- QG     20 ASP- HN      5.50            #peak 553 #SUP 0.85 #QF 0.85
 19 ALA  HN     20 ASP- HN      5.50            #peak 555 #SUP 1.00
 21 GLU- HN     53 LEU  HN      5.50            #peak 556 #SUP 0.92 #QF 0.92
 20 ASP- HB2    21 GLU- HN      5.50            #peak 559 #SUP 1.00
 20 ASP- HB3    21 GLU- HN      5.50            #peak 560 #SUP 1.00
 18 GLU- HB2    21 GLU- HN      5.50            #peak 561 #SUP 0.55 #QF 0.55
 18 GLU- HB3    21 GLU- HN      5.50            #peak 563 #SUP 0.96 #QF 0.96
 22 LEU  HN     52 GLY  HN      5.50            #peak 564 #SUP 0.81 #QF 0.81
 21 GLU- HN     22 LEU  HN      5.50            #peak 566 #SUP 0.98 #QF 0.98
 22 LEU  HN     22 LEU  HG      5.50            #peak 568 #SUP 1.00
 23 SER  HN     46 LEU  HG      5.50            #peak 570 #SUP 0.98 #QF 0.91
 23 SER  HN     46 LEU  QD1     5.50            #peak 570 #SUP 0.98 #QF 0.91
 23 SER  HN     46 LEU  QB      5.50            #peak 571 #SUP 0.88 #QF 0.88
 23 SER  HN     24 PHE  HB3     5.50            #peak 572 #SUP 0.52 #QF 0.52
 23 SER  HN     24 PHE  QD      5.50            #peak 573 #SUP 0.83 #QF 0.83
 22 LEU  HN     23 SER  HN      5.50            #peak 574 #SUP 0.99 #QF 0.99
 14 TYR  HB2    24 PHE  HN      5.50            #peak 576 #SUP 0.93 #QF 0.87
 24 PHE  HN     55 PRO  HD2     5.50            #peak 576 #SUP 0.93 #QF 0.87
 15 THR  HN     24 PHE  HN      5.50            #peak 578 #SUP 0.87 #QF 0.87
 10 ALA  QB     25 LYS+ HN      5.50            #peak 579 #SUP 0.80 #QF 0.80
 25 LYS+ HN     28 GLU- HB3     5.50            #peak 580 #SUP 1.00
 25 LYS+ HN     28 GLU- HB2     5.50            #peak 581 #SUP 0.99 #QF 0.99
 25 LYS+ HN     26 ALA  HN      5.50            #peak 582 #SUP 0.97 #QF 0.97
 13 ASP- HB2    26 ALA  HN      5.50            #peak 583 #SUP 0.76 #QF 0.76
 10 ALA  HA     27 GLY  HN      5.50            #peak 585 #SUP 0.80 #QF 0.80
 11 LEU  HA     27 GLY  HN      5.50            #peak 586 #SUP 0.89 #QF 0.89
 24 PHE  HB2    28 GLU- HN      5.50            #peak 587 #SUP 0.71 #QF 0.71
  9 ARG+ QG     29 GLU- HN      5.50            #peak 592 #SUP 0.86 #QF 0.86
 29 GLU- HN     30 LEU  HN      5.50            #peak 593 #SUP 0.60 #QF 0.60
 30 LEU  HN     31 MET  HN      5.50            #peak 596 #SUP 0.99 #QF 0.99
  9 ARG+ QG     30 LEU  HN      5.50            #peak 598 #SUP 0.73 #QF 0.53
 31 MET  HN     31 MET  QE      5.50            #peak 600 #SUP 1.00
 31 MET  HN     32 LYS+ HN      5.50            #peak 602 #SUP 0.99 #QF 0.99
 32 LYS+ HN     32 LYS+ HG3     5.50            #peak 603 #SUP 1.00
 32 LYS+ HN     32 LYS+ QD      5.50            #peak 604 #SUP 0.90 #QF 0.90
 33 ILE  HN     33 ILE  QG1     5.50            #peak 607 #SUP 0.82 #QF 0.82
 33 ILE  HN     33 ILE  QG2     5.50            #peak 608 #SUP 0.93 #QF 0.93
 34 SER  HN     35 GLU- HN      5.50            #peak 611 #SUP 0.86 #QF 0.86
 32 LYS+ QD     34 SER  HN      5.50            #peak 612 #SUP 0.75 #QF 0.75
  6 VAL  QQG    34 SER  HN      5.50            #peak 613 #SUP 0.30 #QF 0.30
 35 GLU- HN     35 GLU- HG3     5.50            #peak 615 #SUP 0.73 #QF 0.73
 35 GLU- HN     36 GLU- HN      5.50            #peak 616 #SUP 1.00
 37 ASP- HN     40 GLY  HN      5.50            #peak 619 #SUP 0.96 #QF 0.96
 37 ASP- HN     40 GLY  HA1     5.50            #peak 620 #SUP 0.97 #QF 0.97
 37 ASP- HN     40 GLY  HA2     5.50            #peak 621 #SUP 0.92 #QF 0.92
 39 GLN  HN     41 TRP  HB3     5.50            #peak 622 #SUP 0.56 #QF 0.56
 39 GLN  HN     39 GLN  HG2     5.50            #peak 624 #SUP 1.00 #QF 0.38
 40 GLY  HN     56 ALA  QB      5.50            #peak 625 #SUP 0.67 #QF 0.67
 36 GLU- HG3    40 GLY  HN      5.50            #peak 627 #SUP 0.73 #QF 0.73
 36 GLU- HG2    40 GLY  HN      5.50            #peak 628 #SUP 1.00
 40 GLY  HN     41 TRP  HB2     5.50            #peak 629 #SUP 0.61 #QF 0.61
 36 GLU- HA     40 GLY  HN      5.50            #peak 630 #SUP 0.94 #QF 0.94
 41 TRP  HE1    53 LEU  HB3     5.50            #peak 636 #SUP 0.40 #QF 0.40
 41 TRP  HB3    42 CYS  HN      5.50            #peak 638 #SUP 0.95 #QF 0.67
 42 CYS  HN     56 ALA  HA      5.50            #peak 640 #SUP 0.70 #QF 0.70
 42 CYS  HN     43 LYS+ HN      5.50            #peak 642 #SUP 0.96 #QF 0.96
 45 ARG+ HN     54 TYR  QD      5.50            #peak 644 #SUP 0.93 #QF 0.93
 45 ARG+ HN     54 TYR  QE      5.50            #peak 645 #SUP 0.96 #QF 0.96
 30 LEU  HA     45 ARG+ HN      5.50            #peak 646 #SUP 0.91 #QF 0.91
 46 LEU  HN     50 HIS  HB3     5.50            #peak 649 #SUP 0.99 #QF 0.99
 46 LEU  HN     50 HIS  HB2     5.50            #peak 650 #SUP 0.91 #QF 0.91
 46 LEU  HN     46 LEU  QD2     5.50            #peak 652 #SUP 0.67 #QF 0.67
 46 LEU  HN     46 LEU  HG      5.50            #peak 653 #SUP 1.00 #QF 0.98
 46 LEU  HN     46 LEU  QD1     5.50            #peak 653 #SUP 1.00 #QF 0.98
 47 LEU  QD2    48 THR  HN      5.50            #peak 658 #SUP 0.91 #QF 0.91
 47 LEU  QD1    48 THR  HN      5.50            #peak 659 #SUP 0.95 #QF 0.95
 46 LEU  HN     48 THR  HN      5.50            #peak 662 #SUP 0.93 #QF 0.93
 47 LEU  HN     49 GLY  HN      5.50            #peak 663 #SUP 0.98 #QF 0.98
 45 ARG+ QD     49 GLY  HN      5.50            #peak 666 #SUP 0.59 #QF 0.59
 47 LEU  QD2    49 GLY  HN      5.50            #peak 669 #SUP 0.33 #QF 0.33
 47 LEU  QD1    49 GLY  HN      5.50            #peak 670 #SUP 0.97 #QF 0.97
 46 LEU  HG     50 HIS  HN      5.50            #peak 671 #SUP 0.88 #QF 0.71
 46 LEU  QD1    50 HIS  HN      5.50            #peak 671 #SUP 0.88 #QF 0.71
 50 HIS  HD2    51 VAL  HN      5.50            #peak 674 #SUP 0.89 #QF 0.89
 51 VAL  HN     51 VAL  QG2     5.50            #peak 675 #SUP 0.89 #QF 0.89
 52 GLY  HN     53 LEU  HN      5.50            #peak 676 #SUP 0.98 #QF 0.98
 42 CYS  HN     56 ALA  HN      5.50            #peak 679 #SUP 0.64 #QF 0.64
 56 ALA  HN     57 ASN  HN      5.50            #peak 680 #SUP 0.92 #QF 0.92
 57 ASN  HN     58 TYR  QB      5.50            #peak 681 #SUP 0.73 #QF 0.73
 57 ASN  HN     57 ASN  HD21    5.50            #peak 684 #SUP 0.98 #QF 0.98
 54 TYR  QD     57 ASN  HN      5.50            #peak 685 #SUP 0.76 #QF 0.76
 56 ALA  HA     58 TYR  HN      5.50            #peak 686 #SUP 0.62 #QF 0.62
 55 PRO  HD2    58 TYR  HN      5.50            #peak 687 #SUP 0.64 #QF 0.64
 57 ASN  HB2    59 VAL  HN      5.50            #peak 689 #SUP 0.67 #QF 0.41
 57 ASN  HB3    59 VAL  HN      5.50            #peak 689 #SUP 0.67 #QF 0.41
 24 PHE  HZ     59 VAL  HN      5.50            #peak 690 #SUP 1.00 #QF 0.99
 54 TYR  QD     59 VAL  HN      5.50            #peak 690 #SUP 1.00 #QF 0.99
 59 VAL  HN     60 GLU- HN      5.50            #peak 691 #SUP 0.94 #QF 0.94
 60 GLU- HN     60 GLU- HG3     5.50            #peak 692 #SUP 0.66 #QF 0.66
  8 VAL  QG2    60 GLU- HN      5.50            #peak 694 #SUP 0.94 #QF 0.94
 61 LYS+ HN     61 LYS+ HG3     5.50            #peak 696 #SUP 0.97 #QF 0.97
 57 ASN  HN     57 ASN  HD22    5.50            #peak 708 #SUP 0.98 #QF 0.98
 57 ASN  HA     57 ASN  HD22    5.50            #peak 710 #SUP 1.00
 57 ASN  HA     57 ASN  HD21    5.50            #peak 717 #SUP 0.92 #QF 0.92
 17 GLN  HA     17 GLN  HE22    5.50            #peak 730 #SUP 0.91 #QF 0.91
 17 GLN  HA     17 GLN  HE21    5.50            #peak 740 #SUP 0.79 #QF 0.79
 64 LEU  HN     64 LEU  QB      2.40            #peak 735 #SUP 0.45 #QF 0.45
 65 ALA  HN     65 ALA  QB      2.40            #peak 738 #SUP 0.48 #QF 0.48
 64 LEU  QB     65 ALA  HN      2.55            #peak 739 #SUP 0.71 #QF 0.71
 64 LEU  HA     65 ALA  HN      2.55            #peak 740 #SUP 0.48 #QF 0.48
 65 ALA  HA     66 ALA  HN      2.70            #peak 741 #SUP 0.42 #QF 0.42
 66 ALA  HN     66 ALA  QB      2.85            #peak 742 #SUP 0.92 #QF 0.92
  3 VAL  QQG     4 PRO  QD      4.85            #peak 220
  3 VAL  QQG     5 GLY  HN      5.44            #peak 497
  3 VAL  QQG    32 LYS+ QD      5.44            #peak 1216
  3 VAL  QQG    32 LYS+ QE      4.85            #peak 1227
  4 PRO  QB      5 GLY  HA1     5.34            #peak 982
  4 PRO  QB      5 GLY  HA2     5.34            #peak 281
  4 PRO  QD      5 GLY  HN      4.96            #peak 490
  4 PRO  QD      6 VAL  QQG     5.35            #peak 992
  5 GLY  HA1    31 MET  QB      5.34            #peak 983
  6 VAL  HN     31 MET  QB      5.34            #peak 509
  6 VAL  HA      7 ARG+ QB      5.34            #peak 986
  6 VAL  HB     32 LYS+ QE      5.34            #peak 989
  6 VAL  QQG     7 ARG+ QG      5.34            #peak 1000
  6 VAL  QQG    32 LYS+ QE      5.34            #peak 995
  6 VAL  QQG    61 LYS+ QG      5.34            #peak 994
  7 ARG+ QG      8 VAL  QG1     5.34            #peak 1001
  7 ARG+ QG     61 LYS+ HA      5.34            #peak 1441
  7 ARG+ QG     62 VAL  HN      5.34            #peak 147
  7 ARG+ QG     62 VAL  HB      5.34            #peak 999
  7 ARG+ QG     62 VAL  QQG     5.28            #peak 734
  7 ARG+ QD     62 VAL  QQG     5.44            #peak 889
  8 VAL  HN     30 LEU  QQD     5.44            #peak 514
  8 VAL  HN     31 MET  QB      5.34            #peak 677
  8 VAL  HA     59 VAL  QQG     5.44            #peak 1427
  8 VAL  HA     62 VAL  QQG     5.44            #peak 865
  8 VAL  HB     59 VAL  QQG     5.44            #peak 1007
  8 VAL  HB     61 LYS+ QG      5.34            #peak 1005
  9 ARG+ HN     59 VAL  QQG     5.44            #peak 243
  9 ARG+ HN     61 LYS+ QG      5.34            #peak 261
  9 ARG+ HN     62 VAL  QQG     5.44            #peak 877
  9 ARG+ HA     29 GLU- QG      5.34            #peak 444
  9 ARG+ HA     30 LEU  QQD     5.44            #peak 1199
  9 ARG+ QB     29 GLU- QB      5.34            #peak 1019
  9 ARG+ QB     29 GLU- QG      5.18            #peak 575
  9 ARG+ QB     62 VAL  QQG     4.53            #peak 577
  9 ARG+ QG     29 GLU- QG      5.34            #peak 448
  9 ARG+ QD     62 VAL  QQG     5.44            #peak 866
 10 ALA  HN     30 LEU  QQD     5.44            #peak 41
 10 ALA  HN     62 VAL  QQG     5.44            #peak 519
 10 ALA  HA     11 LEU  QB      5.34            #peak 1049
 10 ALA  HA     59 VAL  QQG     5.44            #peak 901
 10 ALA  QB     25 LYS+ QB      5.34            #peak 1040
 10 ALA  QB     27 GLY  QA      5.34            #peak 274
 10 ALA  QB     28 GLU- QG      5.34            #peak 1411
 10 ALA  QB     30 LEU  QQD     5.44            #peak 917
 10 ALA  QB     59 VAL  QQG     5.44            #peak 916
 11 LEU  HN     11 LEU  QQD     5.44            #peak 49
 11 LEU  HN     59 VAL  QQG     5.44            #peak 51
 11 LEU  HN     60 GLU- QB      5.34            #peak 524
 11 LEU  QB     12 TYR  QD      3.98            #peak 17
 11 LEU  QB     12 TYR  QE      3.61            #peak 115
 11 LEU  QB     59 VAL  HA      5.34            #peak 1048
 11 LEU  QQD    12 TYR  HN      5.44            #peak 417
 11 LEU  QQD    12 TYR  QD      4.50            #peak 16
 11 LEU  QQD    12 TYR  QE      3.76            #peak 114
 11 LEU  QQD    59 VAL  HN      5.44            #peak 688
 11 LEU  QQD    59 VAL  HA      5.44            #peak 1422
 11 LEU  QQD    59 VAL  QQG     5.37            #peak 1056
 11 LEU  QQD    60 GLU- HN      5.44            #peak 693
 11 LEU  QQD    60 GLU- HA      5.44            #peak 1058
 11 LEU  QQD    60 GLU- QG      4.85            #peak 1066
 12 TYR  HN     59 VAL  QQG     5.44            #peak 527
 12 TYR  QB     14 TYR  QE      3.70            #peak 105
 12 TYR  QB     58 TYR  QD      4.50            #peak 36
 13 ASP- QB     25 LYS+ HA      5.34            #peak 1070
 13 ASP- QB     25 LYS+ QG      5.34            #peak 1147
 13 ASP- QB     26 ALA  QB      5.34            #peak 1158
 14 TYR  HN     25 LYS+ QD      5.34            #peak 532
 14 TYR  QB     16 GLY  HN      5.34            #peak 1461
 14 TYR  QB     24 PHE  QE      3.79            #peak 58
 14 TYR  QB     24 PHE  HZ      4.25            #peak 69
 14 TYR  QB     58 TYR  QB      5.34            #peak 1417
 14 TYR  QB     58 TYR  QD      3.32            #peak 42
 14 TYR  QB     58 TYR  QE      3.93            #peak 104
 15 THR  HA     23 SER  QB      5.34            #peak 46
 16 GLY  HN     23 SER  QB      5.34            #peak 377
 16 GLY  HA1    21 GLU- QB      5.34            #peak 1075
 16 GLY  HA2    21 GLU- QB      5.34            #peak 1101
 17 GLN  HN     21 GLU- QB      5.34            #peak 542
 17 GLN  HA     18 GLU- QB      5.34            #peak 1082
 17 GLN  QB     18 GLU- HA      5.34            #peak 168
 17 GLN  QG     18 GLU- HN      5.34            #peak 544
 18 GLU- QB     19 ALA  QB      5.34            #peak 930
 21 GLU- HN     53 LEU  QQD     5.44            #peak 562
 21 GLU- HA     52 GLY  QA      5.34            #peak 258
 21 GLU- QB     22 LEU  HA      5.34            #peak 1106
 21 GLU- QB     41 TRP  HZ3     4.88            #peak 92
 21 GLU- QB     41 TRP  HZ2     5.34            #peak 1103
 21 GLU- QB     41 TRP  HH2     3.81            #peak 96
 21 GLU- QG     53 LEU  QQD     5.44            #peak 1360
 22 LEU  HN     22 LEU  QQD     5.44            #peak 163
 22 LEU  HA     46 LEU  QQD     5.44            #peak 793
 22 LEU  QB     53 LEU  HN      5.34            #peak 190
 22 LEU  QB     54 TYR  QD      4.16            #peak 209
 22 LEU  HG     52 GLY  QA      5.34            #peak 1347
 22 LEU  QQD    23 SER  HN      5.44            #peak 471
 22 LEU  QQD    30 LEU  HB3     5.44            #peak 1113
 22 LEU  QQD    30 LEU  QQD     4.85            #peak 1111
 22 LEU  QQD    31 MET  HN      5.44            #peak 599
 22 LEU  QQD    44 GLY  HN      5.44            #peak 430
 22 LEU  QQD    44 GLY  HA2     5.44            #peak 1118
 22 LEU  QQD    46 LEU  HN      5.44            #peak 69
 22 LEU  QQD    46 LEU  QQD     4.56            #peak 1112
 22 LEU  QQD    50 HIS  HN      5.44            #peak 217
 22 LEU  QQD    50 HIS  QB      5.28            #peak 637
 22 LEU  QQD    50 HIS  HD2     5.44            #peak 1132
 22 LEU  QQD    51 VAL  HN      5.44            #peak 78
 22 LEU  QQD    52 GLY  QA      4.85            #peak 852
 22 LEU  QQD    54 TYR  HN      5.44            #peak 678
 22 LEU  QQD    54 TYR  HB2     5.44            #peak 1116
 22 LEU  QQD    54 TYR  HB3     5.44            #peak 1117
 22 LEU  QQD    54 TYR  QD      3.42            #peak 7
 24 PHE  HN     46 LEU  QQD     5.44            #peak 577
 24 PHE  HA     28 GLU- QB      5.34            #peak 650
 24 PHE  HA     30 LEU  QQD     5.44            #peak 1199
 24 PHE  HA     46 LEU  QQD     5.44            #peak 1303
 24 PHE  HB2    28 GLU- QB      5.34            #peak 1140
 24 PHE  HB2    30 LEU  QQD     5.44            #peak 805
 24 PHE  HB2    46 LEU  QQD     5.44            #peak 1300
 24 PHE  HB3    28 GLU- QB      5.34            #peak 424
 24 PHE  HB3    46 LEU  QQD     5.44            #peak 1299
 24 PHE  QD     25 LYS+ QD      5.34            #peak 728
 24 PHE  QD     28 GLU- QB      3.87            #peak 25
 24 PHE  QD     30 LEU  QQD     3.14            #peak 29
 24 PHE  QD     46 LEU  QQD     5.44            #peak 839
 24 PHE  QD     59 VAL  QQG     3.90            #peak 28
 24 PHE  QE     30 LEU  QQD     4.00            #peak 60
 24 PHE  QE     59 VAL  QQG     3.60            #peak 51
 24 PHE  HZ     30 LEU  QQD     5.05            #peak 79
 24 PHE  HZ     59 VAL  QQG     3.51            #peak 78
 25 LYS+ HN     25 LYS+ QD      5.34            #peak 178
 25 LYS+ HN     30 LEU  QQD     5.44            #peak 808
 25 LYS+ HN     46 LEU  QQD     5.44            #peak 1027
 25 LYS+ QB     28 GLU- HN      5.34            #peak 588
 25 LYS+ QB     28 GLU- QB      5.18            #peak 1166
 25 LYS+ QD     28 GLU- QB      5.18            #peak 1164
 26 ALA  HA     27 GLY  QA      5.34            #peak 183
 26 ALA  QB     27 GLY  QA      5.34            #peak 1154
 28 GLU- HN     30 LEU  QQD     5.44            #peak 589
 28 GLU- HA     47 LEU  QQD     5.44            #peak 1327
 28 GLU- QB     30 LEU  QQD     5.28            #peak 1198
 28 GLU- QB     47 LEU  QQD     5.28            #peak 1326
 29 GLU- HN     30 LEU  QQD     5.44            #peak 167
 29 GLU- HN     47 LEU  QQD     5.44            #peak 591
 29 GLU- HA     30 LEU  QQD     5.44            #peak 809
 29 GLU- QG     47 LEU  QQD     5.28            #peak 1316
 30 LEU  HN     30 LEU  QQD     5.44            #peak 297
 30 LEU  HN     46 LEU  QQD     5.44            #peak 598
 30 LEU  HA     47 LEU  QQD     5.44            #peak 1318
 30 LEU  HB2    46 LEU  QQD     5.44            #peak 352
 30 LEU  HB3    46 LEU  QQD     5.44            #peak 1180
 30 LEU  QQD    31 MET  HN      5.44            #peak 387
 30 LEU  QQD    32 LYS+ HB2     5.44            #peak 1188
 30 LEU  QQD    44 GLY  HN      5.44            #peak 432
 30 LEU  QQD    44 GLY  HA1     5.44            #peak 1192
 30 LEU  QQD    44 GLY  HA2     5.44            #peak 788
 30 LEU  QQD    45 ARG+ HN      5.44            #peak 222
 30 LEU  QQD    46 LEU  QQD     4.85            #peak 834
 30 LEU  QQD    47 LEU  HN      5.44            #peak 656
 30 LEU  QQD    54 TYR  QD      3.52            #peak 9
 30 LEU  QQD    54 TYR  QE      3.77            #peak 131
 30 LEU  QQD    59 VAL  QQG     4.85            #peak 904
 31 MET  HN     46 LEU  QQD     5.44            #peak 388
 31 MET  HN     47 LEU  QQD     5.44            #peak 599
 31 MET  QB     33 ILE  QG2     5.34            #peak 597
 31 MET  QB     45 ARG+ HA      5.34            #peak 1286
 31 MET  QB     45 ARG+ QB      5.18            #peak 1289
 31 MET  QG     47 LEU  QQD     4.85            #peak 620
 31 MET  QE     47 LEU  QQD     5.44            #peak 1210
 32 LYS+ QD     35 GLU- QB      5.34            #peak 702
 32 LYS+ QE     36 GLU- HN      5.34            #peak 97
 33 ILE  HN     43 LYS+ QD      5.34            #peak 605
 33 ILE  QG2    51 VAL  QQG     5.44            #peak 952
 33 ILE  QD1    43 LYS+ QD      5.34            #peak 1237
 33 ILE  QD1    45 ARG+ QB      5.34            #peak 558
 33 ILE  QD1    45 ARG+ QG      5.34            #peak 1236
 33 ILE  QD1    51 VAL  QQG     5.44            #peak 1235
 34 SER  QB     43 LYS+ HN      5.34            #peak 174
 34 SER  QB     43 LYS+ QD      5.18            #peak 14
 36 GLU- HN     36 GLU- QG      5.34            #peak 98
 36 GLU- QB     56 ALA  QB      5.34            #peak 703
 36 GLU- QG     40 GLY  QA      4.76            #peak 244
 36 GLU- QG     41 TRP  HN      5.34            #peak 98
 37 ASP- QB     38 GLU- HA      5.34            #peak 1261
 37 ASP- QB     39 GLN  HN      5.34            #peak 331
 38 GLU- QB     39 GLN  QE2     4.76            #peak 725
 38 GLU- QB     40 GLY  HN      5.34            #peak 626
 38 GLU- QG     39 GLN  QE2     5.34            #peak 466
 39 GLN  HN     40 GLY  QA      5.34            #peak 336
 39 GLN  QB     41 TRP  HD1     2.86            #peak 65
 39 GLN  QG     41 TRP  HD1     4.01            #peak 68
 40 GLY  QA     55 PRO  HA      5.34            #peak 1386
 41 TRP  HD1    53 LEU  QQD     4.79            #peak 181
 41 TRP  HZ3    53 LEU  QQD     4.52            #peak 204
 41 TRP  HH2    53 LEU  QQD     5.44            #peak 194
 42 CYS  HA     53 LEU  QQD     5.44            #peak 1378
 43 LYS+ HN     43 LYS+ QD      5.34            #peak 176
 43 LYS+ HN     53 LEU  QQD     5.44            #peak 641
 43 LYS+ HA     53 LEU  QQD     5.44            #peak 1375
 43 LYS+ QB     43 LYS+ QE      5.34            #peak 565
 43 LYS+ QD     51 VAL  QQG     4.85            #peak 1553
 43 LYS+ QD     52 GLY  HN      5.34            #peak 446
 43 LYS+ QD     52 GLY  QA      5.18            #peak 1349
 43 LYS+ QE     51 VAL  QQG     4.53            #peak 1279
 43 LYS+ QE     53 LEU  HA      5.34            #peak 157
 43 LYS+ QE     53 LEU  HB2     5.34            #peak 294
 43 LYS+ QE     53 LEU  HB3     5.34            #peak 1354
 43 LYS+ QE     53 LEU  HG      5.34            #peak 387
 43 LYS+ QE     53 LEU  QQD     4.53            #peak 391
 44 GLY  HN     51 VAL  QQG     5.44            #peak 429
 44 GLY  HN     53 LEU  QQD     5.44            #peak 431
 45 ARG+ HA     46 LEU  QQD     5.44            #peak 1304
 45 ARG+ HA     51 VAL  QQG     5.44            #peak 171
 45 ARG+ QB     46 LEU  QQD     5.28            #peak 1307
 45 ARG+ QB     51 VAL  QQG     4.85            #peak 557
 45 ARG+ QG     46 LEU  HN      5.34            #peak 651
 45 ARG+ QG     49 GLY  HN      5.34            #peak 668
 45 ARG+ QG     51 VAL  QQG     4.85            #peak 1292
 45 ARG+ QD     51 VAL  QQG     5.44            #peak 881
 46 LEU  HN     49 GLY  QA      5.34            #peak 647
 46 LEU  HN     51 VAL  QQG     5.44            #peak 654
 46 LEU  QQD    47 LEU  HA      5.44            #peak 1301
 46 LEU  QQD    47 LEU  QB      5.28            #peak 1298
 46 LEU  QQD    48 THR  HB      5.44            #peak 1309
 46 LEU  QQD    50 HIS  QB      4.85            #peak 629
 46 LEU  QQD    50 HIS  HD2     4.25            #peak 225
 47 LEU  QB     48 THR  HA      5.34            #peak 1329
 47 LEU  QB     48 THR  QG2     5.34            #peak 1332
 48 THR  HN     49 GLY  QA      5.34            #peak 502
 48 THR  HA     49 GLY  QA      5.34            #peak 33
 49 GLY  HN     50 HIS  QB      5.34            #peak 666
 50 HIS  HN     51 VAL  QQG     5.44            #peak 672
 50 HIS  HA     51 VAL  QQG     5.44            #peak 88
 50 HIS  QB     50 HIS  HD2     3.30            #peak 228
 51 VAL  QQG    52 GLY  QA      4.85            #peak 1348
 54 TYR  QD     59 VAL  QQG     3.42            #peak 8
 54 TYR  QE     59 VAL  QQG     3.43            #peak 126
 56 ALA  HA     59 VAL  QQG     5.44            #peak 124
 56 ALA  QB     57 ASN  QB      5.34            #peak 459
 56 ALA  QB     59 VAL  QQG     5.44            #peak 1429
 57 ASN  QB     58 TYR  QD      4.10            #peak 38
 58 TYR  HA     59 VAL  QQG     5.44            #peak 923
 58 TYR  QB     59 VAL  QQG     5.44            #peak 1425
 61 LYS+ QG     62 VAL  HN      5.34            #peak 698
 61 LYS+ QG     62 VAL  HA      5.34            #peak 1449
 61 LYS+ QE     62 VAL  QQG     5.44            #peak 384
 62 VAL  HA     62 VAL  QQG     2.39            #peak 1426
 62 VAL  QQG    63 GLY  HN      5.44            #peak 699
 63 GLY  QA     64 LEU  HN      2.50            #peak 736
 64 LEU  QQD    65 ALA  QB      5.44            #peak 1479
 64 LEU  QQD    67 ALA  QB      5.44            #peak 1473
 14 TYR  QD    106 PRO  HB3     4.50
 14 TYR  QD    106 PRO  QG      3.50
 14 TYR  QD    106 PRO  HB2     3.50
 57 ASN  HD21  106 PRO  QG      6.00
 57 ASN  HD21  106 PRO  HB2     6.00
 58 TYR  QD    110 PRO  HB2     6.00
 41 TRP  HD1   105 ALA  HN      4.50
 41 TRP  HE1   105 ALA  HN      4.50
 57 ASN  HD21  106 PRO  HD3     6.00
 12 TYR  QD    112 LEU  QD2     3.50
 12 TYR  QD    111 ILE  HG12    3.50
 41 TRP  HD1   105 ALA  HN      4.50
 41 TRP  HZ2   105 ALA  HN      4.50
 39 GLN  HG3   101 THR  QG2     3.50
 39 GLN  HG2   101 THR  QG2     3.50
 53 LEU  QD1   101 THR  QG2     4.50
 39 GLN  HG3   104 PRO  HA      3.50
 39 GLN  HB3   104 PRO  HA      4.50
 39 GLN  HG2   104 PRO  HA      3.50
 39 GLN  HB3   105 ALA  HN      3.50
 39 GLN  HG3   105 ALA  HN      3.50
 41 TRP  HZ2   105 ALA  HN      4.50
 41 TRP  HD1   105 ALA  HN      6.00
 57 ASN  HB2   107 ASN  HA      6.00
 57 ASN  HB3   107 ASN  HA      6.00
 12 TYR  QE    111 ILE  QD1     3.50
 12 TYR  QD    111 ILE  QD1     4.50
 12 TYR  QE    112 LEU  HA      6.00
110 PRO  HB3   111 ILE  HN      4.00
110 PRO  HB2   111 ILE  HN      4.00
110 PRO  QG    111 ILE  HN      5.50
110 PRO  HB2   111 ILE  QD1     5.50
102 LYS+ HA    103 GLY  HN      4.00
113 LYS+ QE    115 TRP  HN      5.50
106 PRO  HB3   107 ASN  HN      4.00
106 PRO  HB2   107 ASN  HN      4.00
106 PRO  QG    107 ASN  HN      5.50
105 ALA  QB    106 PRO  QG      5.50
105 ALA  QB    106 PRO  QG      5.50
107 ASN  QB    108 PRO  QD      4.00
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H        MET   1 -20.623   8.393   7.771
    2    HA   MET   1           HA       MET   1 -18.566   7.255   5.974
    3    HB2  MET   1           HB2      MET   1 -19.029  10.152   6.828
    4    HB3  MET   1           HB3      MET   1 -17.567   9.549   6.026
    5    HG2  MET   1           HG2      MET   1 -18.833   8.841   4.096
    6    HG3  MET   1           HG3      MET   1 -20.349   9.345   4.854
    7    HE1  MET   1           HE1      MET   1 -16.767  11.243   4.611
    8    HE2  MET   1           HE2      MET   1 -17.066  10.362   3.094
    9    HE3  MET   1           HE3      MET   1 -17.096  12.138   3.117
   10    H    LYS   2           H        LYS   2 -17.441   5.942   7.347
   11    HA   LYS   2           HA       LYS   2 -16.436   7.152   9.902
   12    HB2  LYS   2           HB2      LYS   2 -17.503   4.373   9.296
   13    HB3  LYS   2           HB3      LYS   2 -16.480   4.715  10.687
   14    HG2  LYS   2           HG2      LYS   2 -18.081   5.996  11.770
   15    HG3  LYS   2           HG3      LYS   2 -18.875   6.503  10.290
   16    HD2  LYS   2           HD2      LYS   2 -20.317   5.057  11.581
   17    HD3  LYS   2           HD3      LYS   2 -19.951   4.361   9.996
   18    HE2  LYS   2           HE2      LYS   2 -18.374   2.786  10.973
   19    HE3  LYS   2           HE3      LYS   2 -18.454   3.601  12.540
   20    HZ1  LYS   2           HZ1      LYS   2 -20.680   2.877  12.825
   21    HZ2  LYS   2           HZ2      LYS   2 -19.783   1.578  12.448
   22    HZ3  LYS   2           HZ3      LYS   2 -20.766   2.237  11.300
   23    H    VAL   3           H        VAL   3 -15.720   4.944   7.141
   24    HA   VAL   3           HA       VAL   3 -12.862   5.559   7.596
   25    HB   VAL   3           HB       VAL   3 -13.822   2.732   7.043
   26   HG11  VAL   3          HG11      VAL   3 -11.594   3.311   6.103
   27   HG12  VAL   3          HG12      VAL   3 -11.087   3.937   7.691
   28   HG13  VAL   3          HG13      VAL   3 -11.429   2.209   7.470
   29   HG21  VAL   3          HG21      VAL   3 -14.384   3.232   9.371
   30   HG22  VAL   3          HG22      VAL   3 -12.960   2.199   9.319
   31   HG23  VAL   3          HG23      VAL   3 -12.769   3.930   9.638
   32    HA   PRO   4           HA       PRO   4 -14.246   6.183   3.229
   33    HB2  PRO   4           HB2      PRO   4 -12.993   8.559   2.734
   34    HB3  PRO   4           HB3      PRO   4 -14.543   8.474   3.627
   35    HG2  PRO   4           HG2      PRO   4 -11.739   8.654   4.765
   36    HG3  PRO   4           HG3      PRO   4 -13.167   9.644   5.204
   37    HD2  PRO   4           HD2      PRO   4 -12.396   7.458   6.653
   38    HD3  PRO   4           HD3      PRO   4 -14.122   7.875   6.441
   39    H    GLY   5           H        GLY   5 -12.597   6.445   1.201
   40    HA2  GLY   5           HA2      GLY   5 -10.500   4.546   1.595
   41    HA3  GLY   5           HA3      GLY   5 -10.815   5.562   0.165
   42    H    VAL   6           H        VAL   6  -8.308   4.894   2.098
   43    HA   VAL   6           HA       VAL   6  -7.540   7.747   2.611
   44    HB   VAL   6           HB       VAL   6  -6.097   5.167   3.295
   45   HG11  VAL   6          HG11      VAL   6  -5.653   7.986   4.318
   46   HG12  VAL   6          HG12      VAL   6  -4.814   6.530   4.873
   47   HG13  VAL   6          HG13      VAL   6  -4.594   7.090   3.213
   48   HG21  VAL   6          HG21      VAL   6  -6.919   5.631   5.652
   49   HG22  VAL   6          HG22      VAL   6  -8.061   6.786   4.930
   50   HG23  VAL   6          HG23      VAL   6  -8.153   5.068   4.515
   51    H    ARG   7           H        ARG   7  -6.654   8.698   0.880
   52    HA   ARG   7           HA       ARG   7  -5.816   7.223  -1.464
   53    HB2  ARG   7           HB2      ARG   7  -6.980   9.419  -1.491
   54    HB3  ARG   7           HB3      ARG   7  -5.603  10.162  -0.675
   55    HG2  ARG   7           HG2      ARG   7  -4.181   9.450  -2.697
   56    HG3  ARG   7           HG3      ARG   7  -5.702   8.999  -3.484
   57    HD2  ARG   7           HD2      ARG   7  -6.540  11.335  -3.052
   58    HD3  ARG   7           HD3      ARG   7  -4.954  11.728  -2.331
   59    HE   ARG   7           HE       ARG   7  -4.716  10.658  -5.008
   60   HH11  ARG   7          HH11      ARG   7  -5.803  13.617  -3.389
   61   HH12  ARG   7          HH12      ARG   7  -5.490  14.592  -4.815
   62   HH21  ARG   7          HH21      ARG   7  -3.930  11.988  -6.627
   63   HH22  ARG   7          HH22      ARG   7  -4.094  13.719  -6.513
   64    H    VAL   8           H        VAL   8  -3.866   6.247  -1.686
   65    HA   VAL   8           HA       VAL   8  -1.462   7.718  -0.717
   66    HB   VAL   8           HB       VAL   8  -0.355   5.649  -0.025
   67   HG11  VAL   8          HG11      VAL   8  -2.860   6.313   1.541
   68   HG12  VAL   8          HG12      VAL   8  -1.506   5.298   2.118
   69   HG13  VAL   8          HG13      VAL   8  -1.240   6.977   1.726
   70   HG21  VAL   8          HG21      VAL   8  -2.966   4.313  -0.676
   71   HG22  VAL   8          HG22      VAL   8  -1.316   3.953  -1.202
   72   HG23  VAL   8          HG23      VAL   8  -1.764   3.613   0.463
   73    H    ARG   9           H        ARG   9   0.503   7.070  -1.827
   74    HA   ARG   9           HA       ARG   9   0.019   6.020  -4.559
   75    HB2  ARG   9           HB2      ARG   9   0.098   8.430  -4.614
   76    HB3  ARG   9           HB3      ARG   9   1.572   8.485  -3.631
   77    HG2  ARG   9           HG2      ARG   9   2.883   7.511  -5.442
   78    HG3  ARG   9           HG3      ARG   9   1.403   7.127  -6.335
   79    HD2  ARG   9           HD2      ARG   9   2.194   9.040  -7.404
   80    HD3  ARG   9           HD3      ARG   9   0.898   9.630  -6.362
   81    HE   ARG   9           HE       ARG   9   3.350   9.858  -4.939
   82   HH11  ARG   9          HH11      ARG   9   1.727  11.225  -7.808
   83   HH12  ARG   9          HH12      ARG   9   2.534  12.761  -7.659
   84   HH21  ARG   9          HH21      ARG   9   4.528  11.757  -4.893
   85   HH22  ARG   9          HH22      ARG   9   4.231  13.075  -5.962
   86    H    ALA  10           H        ALA  10   1.569   4.610  -5.272
   87    HA   ALA  10           HA       ALA  10   3.464   3.680  -3.220
   88    HB1  ALA  10           HB1      ALA  10   3.286   2.683  -6.073
   89    HB2  ALA  10           HB2      ALA  10   4.142   1.946  -4.707
   90    HB3  ALA  10           HB3      ALA  10   2.378   2.019  -4.676
   91    H    LEU  11           H        LEU  11   5.573   3.867  -3.113
   92    HA   LEU  11           HA       LEU  11   6.882   6.043  -4.566
   93    HB2  LEU  11           HB2      LEU  11   7.882   4.069  -2.471
   94    HB3  LEU  11           HB3      LEU  11   8.773   5.475  -3.033
   95    HG   LEU  11           HG       LEU  11   6.082   5.621  -1.586
   96   HD11  LEU  11          HD11      LEU  11   8.897   6.039  -0.494
   97   HD12  LEU  11          HD12      LEU  11   7.817   4.683  -0.130
   98   HD13  LEU  11          HD13      LEU  11   7.376   6.311   0.388
   99   HD21  LEU  11          HD21      LEU  11   6.546   7.623  -2.987
  100   HD22  LEU  11          HD22      LEU  11   8.132   7.786  -2.228
  101   HD23  LEU  11          HD23      LEU  11   6.673   8.015  -1.259
  102    H    TYR  12           H        TYR  12   6.520   2.653  -5.074
  103    HA   TYR  12           HA       TYR  12   8.444   2.652  -7.238
  104    HB2  TYR  12           HB2      TYR  12   8.729   0.166  -5.682
  105    HB3  TYR  12           HB3      TYR  12   9.935   1.131  -6.505
  106    HD1  TYR  12           HD1      TYR  12   8.033   0.658  -3.401
  107    HD2  TYR  12           HD2      TYR  12  11.361   2.775  -5.181
  108    HE1  TYR  12           HE1      TYR  12   8.863   1.324  -1.142
  109    HE2  TYR  12           HE2      TYR  12  12.017   3.571  -3.000
  110    HH   TYR  12           HH       TYR  12  10.337   2.766   0.010
  111    H    ASP  13           H        ASP  13   8.227   0.321  -8.254
  112    HA   ASP  13           HA       ASP  13   5.301  -0.230  -8.632
  113    HB2  ASP  13           HB2      ASP  13   6.535   0.670 -10.559
  114    HB3  ASP  13           HB3      ASP  13   7.733  -0.607 -10.433
  115    H    TYR  14           H        TYR  14   4.743  -1.974  -7.338
  116    HA   TYR  14           HA       TYR  14   6.371  -4.442  -7.422
  117    HB2  TYR  14           HB2      TYR  14   5.837  -2.726  -5.060
  118    HB3  TYR  14           HB3      TYR  14   5.281  -4.364  -4.832
  119    HD1  TYR  14           HD1      TYR  14   6.807  -5.879  -3.832
  120    HD2  TYR  14           HD2      TYR  14   8.332  -2.593  -6.194
  121    HE1  TYR  14           HE1      TYR  14   9.100  -6.676  -3.451
  122    HE2  TYR  14           HE2      TYR  14  10.619  -3.382  -5.811
  123    HH   TYR  14           HH       TYR  14  11.934  -5.119  -5.011
  124    H    THR  15           H        THR  15   5.037  -6.414  -6.977
  125    HA   THR  15           HA       THR  15   2.125  -5.913  -7.256
  126    HB   THR  15           HB       THR  15   3.083  -6.193  -9.442
  127    HG1  THR  15           HG1      THR  15   1.804  -8.330  -9.815
  128   HG21  THR  15          HG21      THR  15   3.982  -9.010  -8.735
  129   HG22  THR  15          HG22      THR  15   5.055  -7.622  -9.013
  130   HG23  THR  15          HG23      THR  15   4.013  -8.221 -10.313
  131    H    GLY  16           H        GLY  16   1.964  -6.311  -5.041
  132    HA2  GLY  16           HA2      GLY  16   1.534  -7.612  -3.201
  133    HA3  GLY  16           HA3      GLY  16   1.067  -8.829  -4.412
  134    H    GLN  17           H        GLN  17   1.745 -10.369  -2.768
  135    HA   GLN  17           HA       GLN  17   4.593 -11.011  -3.030
  136    HB2  GLN  17           HB2      GLN  17   4.151  -9.950  -0.758
  137    HB3  GLN  17           HB3      GLN  17   3.136 -11.361  -0.398
  138    HG2  GLN  17           HG2      GLN  17   5.427 -11.475   0.548
  139    HG3  GLN  17           HG3      GLN  17   5.027 -12.839  -0.485
  140   HE21  GLN  17          HE21      GLN  17   7.280 -13.331  -0.853
  141   HE22  GLN  17          HE22      GLN  17   8.166 -12.374  -2.027
  142    H    GLU  18           H        GLU  18   1.249 -11.932  -3.031
  143    HA   GLU  18           HA       GLU  18   1.886 -14.562  -4.030
  144    HB2  GLU  18           HB2      GLU  18  -0.195 -14.136  -1.839
  145    HB3  GLU  18           HB3      GLU  18   0.217 -15.632  -2.639
  146    HG2  GLU  18           HG2      GLU  18   2.513 -15.515  -1.622
  147    HG3  GLU  18           HG3      GLU  18   1.971 -14.108  -0.681
  148    H    ALA  19           H        ALA  19  -0.506 -15.399  -4.725
  149    HA   ALA  19           HA       ALA  19  -1.494 -13.511  -6.637
  150    HB1  ALA  19           HB1      ALA  19  -2.705 -16.161  -5.727
  151    HB2  ALA  19           HB2      ALA  19  -2.986 -15.335  -7.269
  152    HB3  ALA  19           HB3      ALA  19  -1.385 -16.019  -6.908
  153    H    ASP  20           H        ASP  20  -2.242 -13.515  -3.341
  154    HA   ASP  20           HA       ASP  20  -5.118 -12.783  -3.712
  155    HB2  ASP  20           HB2      ASP  20  -3.401 -13.650  -1.370
  156    HB3  ASP  20           HB3      ASP  20  -4.915 -12.790  -1.104
  157    H    GLU  21           H        GLU  21  -2.163 -11.278  -3.736
  158    HA   GLU  21           HA       GLU  21  -3.017  -8.873  -2.229
  159    HB2  GLU  21           HB2      GLU  21  -0.421  -9.971  -3.358
  160    HB3  GLU  21           HB3      GLU  21  -0.574  -8.290  -2.829
  161    HG2  GLU  21           HG2      GLU  21   0.485  -9.811  -1.209
  162    HG3  GLU  21           HG3      GLU  21  -0.860  -8.868  -0.587
  163    H    LEU  22           H        LEU  22  -2.718  -6.841  -3.216
  164    HA   LEU  22           HA       LEU  22  -3.803  -6.524  -5.888
  165    HB2  LEU  22           HB2      LEU  22  -2.689  -4.620  -3.775
  166    HB3  LEU  22           HB3      LEU  22  -3.400  -4.045  -5.270
  167    HG   LEU  22           HG       LEU  22  -5.105  -5.834  -3.596
  168   HD11  LEU  22          HD11      LEU  22  -5.825  -3.851  -2.239
  169   HD12  LEU  22          HD12      LEU  22  -4.458  -2.954  -2.904
  170   HD13  LEU  22          HD13      LEU  22  -4.170  -4.367  -1.891
  171   HD21  LEU  22          HD21      LEU  22  -5.722  -3.244  -5.054
  172   HD22  LEU  22          HD22      LEU  22  -6.891  -4.378  -4.374
  173   HD23  LEU  22          HD23      LEU  22  -5.897  -4.857  -5.762
  174    H    SER  23           H        SER  23  -2.810  -5.117  -7.464
  175    HA   SER  23           HA       SER  23   0.176  -5.078  -7.416
  176    HB2  SER  23           HB2      SER  23  -0.999  -6.683  -9.038
  177    HB3  SER  23           HB3      SER  23  -1.672  -5.250  -9.839
  178    HG   SER  23           HG       SER  23   0.850  -6.326  -9.746
  179    H    PHE  24           H        PHE  24   1.037  -2.982  -7.586
  180    HA   PHE  24           HA       PHE  24  -0.761  -0.900  -8.748
  181    HB2  PHE  24           HB2      PHE  24  -0.015   0.692  -7.104
  182    HB3  PHE  24           HB3      PHE  24  -0.987  -0.590  -6.433
  183    HD1  PHE  24           HD1      PHE  24   2.720  -0.011  -7.030
  184    HD2  PHE  24           HD2      PHE  24  -0.387  -1.116  -4.250
  185    HE1  PHE  24           HE1      PHE  24   4.429  -0.496  -5.307
  186    HE2  PHE  24           HE2      PHE  24   1.316  -1.419  -2.487
  187    HZ   PHE  24           HZ       PHE  24   3.734  -1.185  -3.030
  188    H    LYS  25           H        LYS  25   0.591   1.045  -9.400
  189    HA   LYS  25           HA       LYS  25   3.182   0.122 -10.583
  190    HB2  LYS  25           HB2      LYS  25   0.859   1.696 -11.714
  191    HB3  LYS  25           HB3      LYS  25   2.476   2.158 -12.189
  192    HG2  LYS  25           HG2      LYS  25   1.597   0.691 -13.837
  193    HG3  LYS  25           HG3      LYS  25   2.906  -0.143 -12.996
  194    HD2  LYS  25           HD2      LYS  25   1.291  -1.437 -11.706
  195    HD3  LYS  25           HD3      LYS  25  -0.074  -0.564 -12.432
  196    HE2  LYS  25           HE2      LYS  25   0.288  -1.532 -14.565
  197    HE3  LYS  25           HE3      LYS  25   1.952  -1.996 -14.173
  198    HZ1  LYS  25           HZ1      LYS  25   1.066  -3.634 -12.633
  199    HZ2  LYS  25           HZ2      LYS  25   0.501  -3.899 -14.174
  200    HZ3  LYS  25           HZ3      LYS  25  -0.477  -3.233 -13.053
  201    H    ALA  26           H        ALA  26   4.774   1.924 -10.836
  202    HA   ALA  26           HA       ALA  26   5.070   3.337  -8.346
  203    HB1  ALA  26           HB1      ALA  26   6.950   4.477  -9.524
  204    HB2  ALA  26           HB2      ALA  26   7.057   2.720  -9.638
  205    HB3  ALA  26           HB3      ALA  26   6.493   3.666 -11.035
  206    H    GLY  27           H        GLY  27   3.915   5.111  -7.762
  207    HA2  GLY  27           HA2      GLY  27   3.199   7.305  -7.999
  208    HA3  GLY  27           HA3      GLY  27   3.312   7.221  -9.747
  209    H    GLU  28           H        GLU  28   1.702   4.418  -9.027
  210    HA   GLU  28           HA       GLU  28  -0.846   5.411  -9.917
  211    HB2  GLU  28           HB2      GLU  28   0.021   3.114 -10.342
  212    HB3  GLU  28           HB3      GLU  28  -0.005   2.740  -8.656
  213    HG2  GLU  28           HG2      GLU  28  -1.818   1.630  -9.589
  214    HG3  GLU  28           HG3      GLU  28  -2.512   2.938  -8.652
  215    H    GLU  29           H        GLU  29  -2.858   5.318  -8.575
  216    HA   GLU  29           HA       GLU  29  -2.344   5.938  -5.704
  217    HB2  GLU  29           HB2      GLU  29  -4.357   7.009  -7.697
  218    HB3  GLU  29           HB3      GLU  29  -4.594   7.131  -5.945
  219    HG2  GLU  29           HG2      GLU  29  -2.503   8.354  -5.676
  220    HG3  GLU  29           HG3      GLU  29  -2.125   8.195  -7.391
  221    H    LEU  30           H        LEU  30  -3.434   4.844  -4.183
  222    HA   LEU  30           HA       LEU  30  -5.640   2.994  -4.983
  223    HB2  LEU  30           HB2      LEU  30  -4.665   1.448  -3.205
  224    HB3  LEU  30           HB3      LEU  30  -3.863   1.464  -4.787
  225    HG   LEU  30           HG       LEU  30  -2.775   3.320  -2.727
  226   HD11  LEU  30          HD11      LEU  30  -3.206   1.385  -1.301
  227   HD12  LEU  30          HD12      LEU  30  -1.469   1.568  -1.586
  228   HD13  LEU  30          HD13      LEU  30  -2.363   0.324  -2.464
  229   HD21  LEU  30          HD21      LEU  30  -0.614   2.621  -3.638
  230   HD22  LEU  30          HD22      LEU  30  -1.696   3.050  -4.957
  231   HD23  LEU  30          HD23      LEU  30  -1.391   1.347  -4.589
  232    H    MET  31           H        MET  31  -7.061   2.420  -3.152
  233    HA   MET  31           HA       MET  31  -7.080   4.534  -1.075
  234    HB2  MET  31           HB2      MET  31  -9.549   3.049  -1.973
  235    HB3  MET  31           HB3      MET  31  -9.341   4.489  -0.995
  236    HG2  MET  31           HG2      MET  31  -8.206   5.197  -3.427
  237    HG3  MET  31           HG3      MET  31  -9.582   4.195  -3.889
  238    HE1  MET  31           HE1      MET  31  -8.314   7.594  -2.910
  239    HE2  MET  31           HE2      MET  31  -9.532   8.286  -1.814
  240    HE3  MET  31           HE3      MET  31  -8.526   6.922  -1.276
  241    H    LYS  32           H        LYS  32  -6.352   3.610   0.833
  242    HA   LYS  32           HA       LYS  32  -6.608   0.752   1.302
  243    HB2  LYS  32           HB2      LYS  32  -4.889   1.909   2.340
  244    HB3  LYS  32           HB3      LYS  32  -5.979   3.113   3.063
  245    HG2  LYS  32           HG2      LYS  32  -6.987   1.355   4.487
  246    HG3  LYS  32           HG3      LYS  32  -5.824   0.206   3.799
  247    HD2  LYS  32           HD2      LYS  32  -4.785   0.879   5.837
  248    HD3  LYS  32           HD3      LYS  32  -3.965   1.808   4.594
  249    HE2  LYS  32           HE2      LYS  32  -5.769   3.651   5.099
  250    HE3  LYS  32           HE3      LYS  32  -6.104   2.704   6.558
  251    HZ1  LYS  32           HZ1      LYS  32  -4.429   4.345   7.105
  252    HZ2  LYS  32           HZ2      LYS  32  -3.563   3.986   5.754
  253    HZ3  LYS  32           HZ3      LYS  32  -3.626   2.927   6.983
  254    H    ILE  33           H        ILE  33  -8.158  -0.340   2.587
  255    HA   ILE  33           HA       ILE  33 -10.476   1.309   3.424
  256    HB   ILE  33           HB       ILE  33 -11.954  -0.380   2.656
  257   HG12  ILE  33          HG12      ILE  33 -10.388  -1.960   0.844
  258   HG13  ILE  33          HG13      ILE  33  -9.606  -2.069   2.406
  259   HG21  ILE  33          HG21      ILE  33 -11.875   0.030   0.278
  260   HG22  ILE  33          HG22      ILE  33 -11.281   1.479   1.095
  261   HG23  ILE  33          HG23      ILE  33 -10.143   0.378   0.322
  262   HD11  ILE  33          HD11      ILE  33 -11.153  -3.873   2.186
  263   HD12  ILE  33          HD12      ILE  33 -11.783  -2.759   3.423
  264   HD13  ILE  33          HD13      ILE  33 -12.485  -2.765   1.786
  265    H    SER  34           H        SER  34  -8.189  -1.186   4.292
  266    HA   SER  34           HA       SER  34  -9.606  -1.536   6.872
  267    HB2  SER  34           HB2      SER  34  -7.953  -3.613   5.452
  268    HB3  SER  34           HB3      SER  34  -8.916  -3.792   6.935
  269    HG   SER  34           HG       SER  34 -10.787  -3.426   5.744
  270    H    GLU  35           H        GLU  35  -7.638  -2.573   8.425
  271    HA   GLU  35           HA       GLU  35  -5.735  -0.302   8.520
  272    HB2  GLU  35           HB2      GLU  35  -5.405  -1.052  10.845
  273    HB3  GLU  35           HB3      GLU  35  -7.082  -0.670  10.464
  274    HG2  GLU  35           HG2      GLU  35  -7.645  -3.053  10.281
  275    HG3  GLU  35           HG3      GLU  35  -5.944  -3.510  10.445
  276    H    GLU  36           H        GLU  36  -3.619  -0.804   9.540
  277    HA   GLU  36           HA       GLU  36  -2.150  -2.580   7.845
  278    HB2  GLU  36           HB2      GLU  36  -1.548  -0.271   8.636
  279    HB3  GLU  36           HB3      GLU  36  -1.203  -0.950  10.230
  280    HG2  GLU  36           HG2      GLU  36   0.579  -2.314   9.313
  281    HG3  GLU  36           HG3      GLU  36   0.109  -1.935   7.653
  282    H    ASP  37           H        ASP  37  -0.886  -4.274   8.483
  283    HA   ASP  37           HA       ASP  37  -1.698  -5.836  10.894
  284    HB2  ASP  37           HB2      ASP  37  -0.248  -6.562   8.332
  285    HB3  ASP  37           HB3      ASP  37  -0.551  -7.703   9.630
  286    H    GLU  38           H        GLU  38   0.154  -7.207  11.747
  287    HA   GLU  38           HA       GLU  38   2.258  -5.625  12.697
  288    HB2  GLU  38           HB2      GLU  38   1.130  -7.785  13.531
  289    HB3  GLU  38           HB3      GLU  38   2.288  -8.653  12.526
  290    HG2  GLU  38           HG2      GLU  38   4.103  -8.007  13.868
  291    HG3  GLU  38           HG3      GLU  38   3.270  -6.583  14.509
  292    H    GLN  39           H        GLN  39   2.042  -7.383   9.724
  293    HA   GLN  39           HA       GLN  39   4.945  -7.319   9.127
  294    HB2  GLN  39           HB2      GLN  39   2.703  -8.967   8.421
  295    HB3  GLN  39           HB3      GLN  39   3.243  -8.225   6.939
  296    HG2  GLN  39           HG2      GLN  39   4.350 -10.348   7.181
  297    HG3  GLN  39           HG3      GLN  39   5.546  -9.090   7.332
  298   HE21  GLN  39          HE21      GLN  39   7.114  -9.904   8.818
  299   HE22  GLN  39          HE22      GLN  39   6.669 -10.552  10.375
  300    H    GLY  40           H        GLY  40   2.710  -4.925   9.130
  301    HA2  GLY  40           HA2      GLY  40   2.608  -2.931   8.071
  302    HA3  GLY  40           HA3      GLY  40   4.050  -3.349   7.144
  303    H    TRP  41           H        TRP  41   1.155  -5.390   7.157
  304    HA   TRP  41           HA       TRP  41   0.809  -5.068   4.241
  305    HB2  TRP  41           HB2      TRP  41   0.141  -7.069   6.386
  306    HB3  TRP  41           HB3      TRP  41  -1.072  -6.864   5.166
  307    HD1  TRP  41           HD1      TRP  41   1.295  -9.208   5.910
  308    HE1  TRP  41           HE1      TRP  41   2.135 -10.471   3.885
  309    HE3  TRP  41           HE3      TRP  41  -0.113  -5.890   2.332
  310    HZ2  TRP  41           HZ2      TRP  41   2.520  -9.896   1.054
  311    HZ3  TRP  41           HZ3      TRP  41   0.502  -6.288  -0.040
  312    HH2  TRP  41           HH2      TRP  41   1.872  -8.150  -0.688
  313    H    CYS  42           H        CYS  42  -1.085  -4.017   3.397
  314    HA   CYS  42           HA       CYS  42  -3.156  -3.202   5.384
  315    HB2  CYS  42           HB2      CYS  42  -1.610  -1.463   3.448
  316    HB3  CYS  42           HB3      CYS  42  -3.309  -1.109   3.799
  317    HG   CYS  42           HG       CYS  42  -3.079  -1.059   6.417
  318    H    LYS  43           H        LYS  43  -5.206  -3.454   4.621
  319    HA   LYS  43           HA       LYS  43  -5.471  -4.652   1.925
  320    HB2  LYS  43           HB2      LYS  43  -6.623  -5.187   4.512
  321    HB3  LYS  43           HB3      LYS  43  -7.926  -4.701   3.441
  322    HG2  LYS  43           HG2      LYS  43  -6.034  -6.665   2.204
  323    HG3  LYS  43           HG3      LYS  43  -6.811  -7.242   3.682
  324    HD2  LYS  43           HD2      LYS  43  -9.018  -6.733   2.741
  325    HD3  LYS  43           HD3      LYS  43  -8.278  -6.020   1.313
  326    HE2  LYS  43           HE2      LYS  43  -9.068  -8.299   0.845
  327    HE3  LYS  43           HE3      LYS  43  -7.316  -8.195   0.690
  328    HZ1  LYS  43           HZ1      LYS  43  -8.460  -9.105   3.237
  329    HZ2  LYS  43           HZ2      LYS  43  -7.036  -9.569   2.503
  330    HZ3  LYS  43           HZ3      LYS  43  -8.469 -10.129   1.979
  331    H    GLY  44           H        GLY  44  -6.504  -3.630   0.280
  332    HA2  GLY  44           HA2      GLY  44  -8.176  -1.293   0.827
  333    HA3  GLY  44           HA3      GLY  44  -6.641  -0.925   0.068
  334    H    ARG  45           H        ARG  45  -8.257  -0.067  -1.476
  335    HA   ARG  45           HA       ARG  45  -8.936  -2.079  -3.497
  336    HB2  ARG  45           HB2      ARG  45 -10.681   0.171  -2.427
  337    HB3  ARG  45           HB3      ARG  45 -10.928  -0.510  -4.047
  338    HG2  ARG  45           HG2      ARG  45 -11.198  -2.731  -3.157
  339    HG3  ARG  45           HG3      ARG  45 -10.912  -2.140  -1.495
  340    HD2  ARG  45           HD2      ARG  45 -12.883  -0.606  -1.828
  341    HD3  ARG  45           HD3      ARG  45 -13.258  -1.509  -3.302
  342    HE   ARG  45           HE       ARG  45 -13.224  -3.559  -1.754
  343   HH11  ARG  45          HH11      ARG  45 -14.395  -0.375  -0.662
  344   HH12  ARG  45          HH12      ARG  45 -15.328  -1.020   0.638
  345   HH21  ARG  45          HH21      ARG  45 -14.386  -4.397  -0.001
  346   HH22  ARG  45          HH22      ARG  45 -15.336  -3.363   1.022
  347    H    LEU  46           H        LEU  46  -8.332  -1.611  -5.440
  348    HA   LEU  46           HA       LEU  46  -6.776   0.869  -5.966
  349    HB2  LEU  46           HB2      LEU  46  -7.624  -1.543  -7.603
  350    HB3  LEU  46           HB3      LEU  46  -6.946  -0.137  -8.417
  351    HG   LEU  46           HG       LEU  46  -5.439  -1.333  -6.101
  352   HD11  LEU  46          HD11      LEU  46  -5.492  -2.305  -8.973
  353   HD12  LEU  46          HD12      LEU  46  -6.012  -3.215  -7.554
  354   HD13  LEU  46          HD13      LEU  46  -4.309  -2.825  -7.740
  355   HD21  LEU  46          HD21      LEU  46  -4.565   0.094  -8.656
  356   HD22  LEU  46          HD22      LEU  46  -3.493  -0.472  -7.374
  357   HD23  LEU  46          HD23      LEU  46  -4.651   0.835  -7.046
  358    H    LEU  47           H        LEU  47  -7.432   2.299  -7.846
  359    HA   LEU  47           HA       LEU  47 -10.101   3.243  -7.557
  360    HB2  LEU  47           HB2      LEU  47  -9.606   4.670  -9.488
  361    HB3  LEU  47           HB3      LEU  47  -8.361   4.729  -8.270
  362    HG   LEU  47           HG       LEU  47  -7.689   2.613 -10.148
  363   HD11  LEU  47          HD11      LEU  47  -7.390   3.918 -12.207
  364   HD12  LEU  47          HD12      LEU  47  -8.196   5.311 -11.449
  365   HD13  LEU  47          HD13      LEU  47  -9.099   3.797 -11.765
  366   HD21  LEU  47          HD21      LEU  47  -5.676   4.081 -10.506
  367   HD22  LEU  47          HD22      LEU  47  -6.023   3.534  -8.872
  368   HD23  LEU  47          HD23      LEU  47  -6.399   5.211  -9.333
  369    H    THR  48           H        THR  48  -8.927   0.602  -9.453
  370    HA   THR  48           HA       THR  48 -11.133   0.647 -11.363
  371    HB   THR  48           HB       THR  48  -8.759  -0.013 -11.903
  372    HG1  THR  48           HG1      THR  48  -9.409  -1.699 -13.255
  373   HG21  THR  48          HG21      THR  48  -8.218  -1.400  -9.959
  374   HG22  THR  48          HG22      THR  48  -8.104  -2.358 -11.434
  375   HG23  THR  48          HG23      THR  48  -9.509  -2.550 -10.389
  376    H    GLY  49           H        GLY  49 -10.965  -0.097  -8.128
  377    HA2  GLY  49           HA2      GLY  49 -12.609  -0.987  -6.807
  378    HA3  GLY  49           HA3      GLY  49 -13.342  -1.801  -8.189
  379    H    HIS  50           H        HIS  50 -10.061  -2.542  -8.316
  380    HA   HIS  50           HA       HIS  50 -10.464  -5.272  -7.555
  381    HB2  HIS  50           HB2      HIS  50  -8.244  -3.688  -8.675
  382    HB3  HIS  50           HB3      HIS  50  -7.698  -4.854  -7.477
  383    HD1  HIS  50           HD1      HIS  50  -8.076  -7.461  -8.021
  384    HD2  HIS  50           HD2      HIS  50  -9.469  -4.706 -10.892
  385    HE1  HIS  50           HE1      HIS  50  -8.997  -8.834  -9.962
  386    H    VAL  51           H        VAL  51  -9.915  -6.394  -5.709
  387    HA   VAL  51           HA       VAL  51  -9.311  -4.772  -3.292
  388    HB   VAL  51           HB       VAL  51 -10.549  -6.613  -2.115
  389   HG11  VAL  51          HG11      VAL  51 -11.792  -4.653  -2.392
  390   HG12  VAL  51          HG12      VAL  51 -12.110  -4.959  -4.117
  391   HG13  VAL  51          HG13      VAL  51 -12.875  -5.953  -2.857
  392   HG21  VAL  51          HG21      VAL  51 -10.395  -8.410  -3.796
  393   HG22  VAL  51          HG22      VAL  51 -12.033  -8.098  -3.291
  394   HG23  VAL  51          HG23      VAL  51 -11.495  -7.499  -4.866
  395    H    GLY  52           H        GLY  52  -7.920  -5.712  -1.695
  396    HA2  GLY  52           HA2      GLY  52  -6.932  -8.202  -1.438
  397    HA3  GLY  52           HA3      GLY  52  -5.929  -7.595  -2.744
  398    H    LEU  53           H        LEU  53  -4.263  -7.991  -1.077
  399    HA   LEU  53           HA       LEU  53  -3.949  -5.924   1.038
  400    HB2  LEU  53           HB2      LEU  53  -2.895  -8.677   0.443
  401    HB3  LEU  53           HB3      LEU  53  -1.804  -7.589   1.249
  402    HG   LEU  53           HG       LEU  53  -4.510  -8.442   2.307
  403   HD11  LEU  53          HD11      LEU  53  -2.642 -10.175   2.263
  404   HD12  LEU  53          HD12      LEU  53  -3.302  -9.804   3.847
  405   HD13  LEU  53          HD13      LEU  53  -1.713  -9.134   3.344
  406   HD21  LEU  53          HD21      LEU  53  -2.350  -6.626   3.438
  407   HD22  LEU  53          HD22      LEU  53  -3.593  -7.403   4.460
  408   HD23  LEU  53          HD23      LEU  53  -4.059  -6.266   3.211
  409    H    TYR  54           H        TYR  54  -2.049  -4.542   0.937
  410    HA   TYR  54           HA       TYR  54  -0.349  -4.705  -1.455
  411    HB2  TYR  54           HB2      TYR  54  -0.522  -2.420  -1.971
  412    HB3  TYR  54           HB3      TYR  54  -2.139  -3.019  -1.980
  413    HD1  TYR  54           HD1      TYR  54  -3.760  -2.280  -0.170
  414    HD2  TYR  54           HD2      TYR  54   0.334  -0.882  -0.270
  415    HE1  TYR  54           HE1      TYR  54  -4.317  -0.468   1.449
  416    HE2  TYR  54           HE2      TYR  54  -0.223   0.832   1.404
  417    HH   TYR  54           HH       TYR  54  -1.760   1.690   2.840
  418    HA   PRO  55           HA       PRO  55   2.418  -4.175   1.934
  419    HB2  PRO  55           HB2      PRO  55   4.745  -3.430   0.754
  420    HB3  PRO  55           HB3      PRO  55   4.039  -5.065   0.615
  421    HG2  PRO  55           HG2      PRO  55   3.910  -2.796  -1.376
  422    HG3  PRO  55           HG3      PRO  55   4.271  -4.516  -1.685
  423    HD2  PRO  55           HD2      PRO  55   1.748  -3.528  -2.084
  424    HD3  PRO  55           HD3      PRO  55   2.066  -5.157  -1.454
  425    H    ALA  56           H        ALA  56   1.705  -2.532   3.257
  426    HA   ALA  56           HA       ALA  56   1.321   0.142   2.551
  427    HB1  ALA  56           HB1      ALA  56   0.484  -1.114   4.620
  428    HB2  ALA  56           HB2      ALA  56   2.061  -0.786   5.345
  429    HB3  ALA  56           HB3      ALA  56   1.018   0.563   4.878
  430    H    ASN  57           H        ASN  57   4.148  -1.476   3.799
  431    HA   ASN  57           HA       ASN  57   5.782   0.737   4.360
  432    HB2  ASN  57           HB2      ASN  57   6.854  -1.879   3.250
  433    HB3  ASN  57           HB3      ASN  57   7.632  -0.746   4.344
  434   HD21  ASN  57          HD21      ASN  57   6.351  -3.792   4.329
  435   HD22  ASN  57          HD22      ASN  57   5.796  -3.812   6.007
  436    H    TYR  58           H        TYR  58   4.713  -0.197   1.194
  437    HA   TYR  58           HA       TYR  58   7.088   1.026  -0.109
  438    HB2  TYR  58           HB2      TYR  58   4.935  -0.870  -1.073
  439    HB3  TYR  58           HB3      TYR  58   6.034  -0.066  -2.161
  440    HD1  TYR  58           HD1      TYR  58   6.462  -2.088   1.042
  441    HD2  TYR  58           HD2      TYR  58   7.614  -1.530  -3.078
  442    HE1  TYR  58           HE1      TYR  58   8.156  -3.850   1.281
  443    HE2  TYR  58           HE2      TYR  58   9.304  -3.257  -2.825
  444    HH   TYR  58           HH       TYR  58  10.003  -5.015   0.204
  445    H    VAL  59           H        VAL  59   4.176   2.114   1.063
  446    HA   VAL  59           HA       VAL  59   3.971   4.093  -1.139
  447    HB   VAL  59           HB       VAL  59   1.655   3.870  -1.353
  448   HG11  VAL  59          HG11      VAL  59   2.355   0.946  -0.880
  449   HG12  VAL  59          HG12      VAL  59   1.163   1.628  -2.004
  450   HG13  VAL  59          HG13      VAL  59   2.886   1.826  -2.308
  451   HG21  VAL  59          HG21      VAL  59   1.589   2.153   1.133
  452   HG22  VAL  59          HG22      VAL  59   0.942   3.801   0.966
  453   HG23  VAL  59          HG23      VAL  59   0.212   2.487   0.049
  454    H    GLU  60           H        GLU  60   2.510   6.027  -0.444
  455    HA   GLU  60           HA       GLU  60   2.442   6.591   2.374
  456    HB2  GLU  60           HB2      GLU  60   4.781   7.398   0.886
  457    HB3  GLU  60           HB3      GLU  60   3.842   8.852   1.210
  458    HG2  GLU  60           HG2      GLU  60   4.498   6.778   3.343
  459    HG3  GLU  60           HG3      GLU  60   5.560   8.128   2.964
  460    H    LYS  61           H        LYS  61   1.443   8.803   2.694
  461    HA   LYS  61           HA       LYS  61  -0.908   8.950   1.026
  462    HB2  LYS  61           HB2      LYS  61   0.161  10.647   3.311
  463    HB3  LYS  61           HB3      LYS  61  -1.263  11.151   2.371
  464    HG2  LYS  61           HG2      LYS  61  -2.363   9.036   2.786
  465    HG3  LYS  61           HG3      LYS  61  -0.977   8.469   3.740
  466    HD2  LYS  61           HD2      LYS  61  -2.624   9.133   5.295
  467    HD3  LYS  61           HD3      LYS  61  -1.393  10.408   5.339
  468    HE2  LYS  61           HE2      LYS  61  -2.826  11.827   3.881
  469    HE3  LYS  61           HE3      LYS  61  -3.984  10.497   3.729
  470    HZ1  LYS  61           HZ1      LYS  61  -3.424  12.036   6.181
  471    HZ2  LYS  61           HZ2      LYS  61  -4.312  10.644   6.149
  472    HZ3  LYS  61           HZ3      LYS  61  -4.838  11.937   5.334
  473    H    VAL  62           H        VAL  62  -1.719  10.699  -0.063
  474    HA   VAL  62           HA       VAL  62   0.153  12.660  -1.039
  475    HB   VAL  62           HB       VAL  62   0.403  10.650  -2.455
  476   HG11  VAL  62          HG11      VAL  62  -1.296  10.051  -4.144
  477   HG12  VAL  62          HG12      VAL  62  -1.803   9.685  -2.483
  478   HG13  VAL  62          HG13      VAL  62  -2.451  11.099  -3.352
  479   HG21  VAL  62          HG21      VAL  62   0.366  11.797  -4.615
  480   HG22  VAL  62          HG22      VAL  62  -0.714  13.044  -3.959
  481   HG23  VAL  62          HG23      VAL  62   0.944  12.877  -3.339
  482    H    GLY  63           H        GLY  63  -1.596  13.000   0.835
  483    HA2  GLY  63           HA2      GLY  63  -4.185  13.953  -0.244
  484    HA3  GLY  63           HA3      GLY  63  -3.778  13.653   1.440
  485    H    LEU  64           H        LEU  64  -2.162  15.170   2.485
  486    HA   LEU  64           HA       LEU  64  -2.067  17.878   1.297
  487    HB2  LEU  64           HB2      LEU  64  -3.042  16.960   4.018
  488    HB3  LEU  64           HB3      LEU  64  -2.667  18.650   3.665
  489    HG   LEU  64           HG       LEU  64  -4.841  17.044   2.237
  490   HD11  LEU  64          HD11      LEU  64  -4.973  19.039   4.512
  491   HD12  LEU  64          HD12      LEU  64  -5.437  17.326   4.559
  492   HD13  LEU  64          HD13      LEU  64  -6.388  18.465   3.598
  493   HD21  LEU  64          HD21      LEU  64  -5.623  19.219   1.422
  494   HD22  LEU  64          HD22      LEU  64  -3.967  18.932   0.879
  495   HD23  LEU  64          HD23      LEU  64  -4.266  20.032   2.226
  496    H    ALA  65           H        ALA  65  -0.615  19.209   2.996
  497    HA   ALA  65           HA       ALA  65   1.972  17.950   2.947
  498    HB1  ALA  65           HB1      ALA  65   1.553  20.425   2.839
  499    HB2  ALA  65           HB2      ALA  65   1.040  20.387   4.542
  500    HB3  ALA  65           HB3      ALA  65   2.710  19.978   4.093
  501    H    ALA  66           H        ALA  66   3.324  17.720   5.077
  502    HA   ALA  66           HA       ALA  66   1.989  15.817   6.771
  503    HB1  ALA  66           HB1      ALA  66   4.684  17.193   7.112
  504    HB2  ALA  66           HB2      ALA  66   4.104  15.801   8.040
  505    HB3  ALA  66           HB3      ALA  66   4.381  15.640   6.298
  506    H    ALA  67           H        ALA  67   2.213  19.169   6.807
  507    HA   ALA  67           HA       ALA  67   0.622  20.524   7.898
  508    HB1  ALA  67           HB1      ALA  67   1.562  19.288  10.502
  509    HB2  ALA  67           HB2      ALA  67   0.338  20.541  10.306
  510    HB3  ALA  67           HB3      ALA  67  -0.001  18.895   9.735
  511    H1   THR 101           H        THR 101  -0.946 -12.895  10.931
  512    HA   THR 101           HA       THR 101  -1.595 -11.160   9.424
  513    HB   THR 101           HB       THR 101   0.735 -10.179   9.460
  514    HG1  THR 101           HG1      THR 101  -0.968  -9.524   8.003
  515   HG21  THR 101          HG21      THR 101   2.228 -10.873   7.511
  516   HG22  THR 101          HG22      THR 101   1.242 -12.292   7.294
  517   HG23  THR 101          HG23      THR 101   2.134 -12.067   8.809
  518    H    LYS 102           H        LYS 102  -1.687 -11.475   6.785
  519    HA   LYS 102           HA       LYS 102  -2.661 -14.155   6.430
  520    HB2  LYS 102           HB2      LYS 102  -2.866 -11.706   4.972
  521    HB3  LYS 102           HB3      LYS 102  -2.133 -12.867   3.871
  522    HG2  LYS 102           HG2      LYS 102  -4.505 -13.036   3.602
  523    HG3  LYS 102           HG3      LYS 102  -3.970 -14.494   4.444
  524    HD2  LYS 102           HD2      LYS 102  -4.707 -13.428   6.602
  525    HD3  LYS 102           HD3      LYS 102  -5.257 -12.010   5.690
  526    HE2  LYS 102           HE2      LYS 102  -6.914 -13.233   4.543
  527    HE3  LYS 102           HE3      LYS 102  -6.200 -14.799   4.951
  528    HZ1  LYS 102           HZ1      LYS 102  -7.399 -12.977   6.936
  529    HZ2  LYS 102           HZ2      LYS 102  -6.854 -14.514   7.199
  530    HZ3  LYS 102           HZ3      LYS 102  -8.187 -14.246   6.243
  531    H    GLY 103           H        GLY 103   0.089 -12.547   4.715
  532    HA2  GLY 103           HA2      GLY 103   1.647 -15.037   4.962
  533    HA3  GLY 103           HA3      GLY 103   1.410 -14.267   3.382
  534    HA   PRO 104           HA       PRO 104   4.950 -12.319   5.955
  535    HB2  PRO 104           HB2      PRO 104   7.170 -13.523   4.898
  536    HB3  PRO 104           HB3      PRO 104   6.265 -14.164   6.299
  537    HG2  PRO 104           HG2      PRO 104   6.058 -14.980   3.398
  538    HG3  PRO 104           HG3      PRO 104   6.176 -16.047   4.835
  539    HD2  PRO 104           HD2      PRO 104   3.786 -15.473   3.647
  540    HD3  PRO 104           HD3      PRO 104   3.927 -15.658   5.421
  541    H    ALA 105           H        ALA 105   4.630 -10.470   5.023
  542    HA   ALA 105           HA       ALA 105   4.425  -9.588   2.461
  543    HB1  ALA 105           HB1      ALA 105   5.513  -7.420   3.835
  544    HB2  ALA 105           HB2      ALA 105   3.833  -7.943   3.965
  545    HB3  ALA 105           HB3      ALA 105   5.036  -8.444   5.156
  546    HA   PRO 106           HA       PRO 106   8.397  -9.121   0.561
  547    HB2  PRO 106           HB2      PRO 106   8.278  -6.656  -0.668
  548    HB3  PRO 106           HB3      PRO 106   7.345  -8.109  -1.100
  549    HG2  PRO 106           HG2      PRO 106   6.415  -5.735   0.413
  550    HG3  PRO 106           HG3      PRO 106   5.583  -6.605  -0.908
  551    HD2  PRO 106           HD2      PRO 106   5.084  -7.038   1.769
  552    HD3  PRO 106           HD3      PRO 106   4.851  -8.273   0.529
  553    H    ASN 107           H        ASN 107   7.443  -7.228   2.890
  554    HA   ASN 107           HA       ASN 107   9.193  -5.145   3.487
  555    HB2  ASN 107           HB2      ASN 107   8.392  -5.122   5.711
  556    HB3  ASN 107           HB3      ASN 107   7.073  -5.834   4.793
  557   HD21  ASN 107          HD21      ASN 107   9.100  -6.316   7.607
  558   HD22  ASN 107          HD22      ASN 107   8.720  -8.005   7.759
  559    HA   PRO 108           HA       PRO 108  10.409  -4.269   5.683
  560    HB2  PRO 108           HB2      PRO 108  12.983  -3.264   5.664
  561    HB3  PRO 108           HB3      PRO 108  12.290  -4.251   6.989
  562    HG2  PRO 108           HG2      PRO 108  14.051  -5.114   4.693
  563    HG3  PRO 108           HG3      PRO 108  14.207  -5.540   6.424
  564    HD2  PRO 108           HD2      PRO 108  13.027  -7.226   4.642
  565    HD3  PRO 108           HD3      PRO 108  12.393  -7.052   6.305
  566    HA   PRO 109           HA       PRO 109  10.199  -2.095   1.870
  567    HB2  PRO 109           HB2      PRO 109  10.982   0.517   2.363
  568    HB3  PRO 109           HB3      PRO 109   9.414  -0.204   2.820
  569    HG2  PRO 109           HG2      PRO 109  11.867   0.152   4.542
  570    HG3  PRO 109           HG3      PRO 109  10.145   0.487   4.953
  571    HD2  PRO 109           HD2      PRO 109  11.397  -1.777   5.742
  572    HD3  PRO 109           HD3      PRO 109   9.681  -1.792   5.259
  573    HA   PRO 110           HA       PRO 110  14.134  -2.280  -0.028
  574    HB2  PRO 110           HB2      PRO 110  13.810  -0.988  -2.414
  575    HB3  PRO 110           HB3      PRO 110  12.977  -2.507  -1.989
  576    HG2  PRO 110           HG2      PRO 110  11.939   0.308  -1.870
  577    HG3  PRO 110           HG3      PRO 110  11.112  -1.145  -2.502
  578    HD2  PRO 110           HD2      PRO 110  10.700  -0.130   0.043
  579    HD3  PRO 110           HD3      PRO 110  10.539  -1.859  -0.355
  580    H    ILE 111           H        ILE 111  13.136   1.202  -0.593
  581    HA   ILE 111           HA       ILE 111  15.640   2.062   0.684
  582    HB   ILE 111           HB       ILE 111  16.197   3.499  -1.228
  583   HG12  ILE 111          HG12      ILE 111  14.059   2.020  -2.903
  584   HG13  ILE 111          HG13      ILE 111  13.942   3.630  -2.242
  585   HG21  ILE 111          HG21      ILE 111  17.233   1.240  -0.940
  586   HG22  ILE 111          HG22      ILE 111  16.098   0.612  -2.152
  587   HG23  ILE 111          HG23      ILE 111  17.266   1.860  -2.598
  588   HD11  ILE 111          HD11      ILE 111  16.019   2.740  -4.269
  589   HD12  ILE 111          HD12      ILE 111  14.604   3.755  -4.565
  590   HD13  ILE 111          HD13      ILE 111  15.923   4.360  -3.542
  591    H    LEU 112           H        LEU 112  14.906   4.742  -0.620
  592    HA   LEU 112           HA       LEU 112  14.224   6.694   0.269
  593    HB2  LEU 112           HB2      LEU 112  11.891   5.169  -0.785
  594    HB3  LEU 112           HB3      LEU 112  11.551   6.676   0.029
  595    HG   LEU 112           HG       LEU 112  12.803   7.974  -1.491
  596   HD11  LEU 112          HD11      LEU 112  13.597   5.560  -3.123
  597   HD12  LEU 112          HD12      LEU 112  14.717   6.406  -2.016
  598   HD13  LEU 112          HD13      LEU 112  14.015   7.243  -3.400
  599   HD21  LEU 112          HD21      LEU 112  11.208   5.907  -3.069
  600   HD22  LEU 112          HD22      LEU 112  11.559   7.586  -3.545
  601   HD23  LEU 112          HD23      LEU 112  10.521   7.272  -2.154
  602    H    LYS 113           H        LYS 113  15.072   6.363   2.412
  603    HA   LYS 113           HA       LYS 113  13.026   6.941   4.398
  604    HB2  LYS 113           HB2      LYS 113  13.624   5.170   6.002
  605    HB3  LYS 113           HB3      LYS 113  12.865   4.566   4.545
  606    HG2  LYS 113           HG2      LYS 113  15.225   3.951   3.706
  607    HG3  LYS 113           HG3      LYS 113  15.773   4.327   5.354
  608    HD2  LYS 113           HD2      LYS 113  14.121   2.645   6.221
  609    HD3  LYS 113           HD3      LYS 113  13.926   2.111   4.519
  610    HE2  LYS 113           HE2      LYS 113  16.472   2.012   4.430
  611    HE3  LYS 113           HE3      LYS 113  16.492   2.337   6.160
  612    HZ1  LYS 113           HZ1      LYS 113  15.085   0.237   6.407
  613    HZ2  LYS 113           HZ2      LYS 113  16.597  -0.039   5.866
  614    HZ3  LYS 113           HZ3      LYS 113  15.363  -0.050   4.809
  615    H    VAL 114           H        VAL 114  16.368   5.742   4.617
  616    HA   VAL 114           HA       VAL 114  17.238   7.453   6.607
  617    HB   VAL 114           HB       VAL 114  18.173   5.276   5.980
  618   HG11  VAL 114          HG11      VAL 114  18.185   5.493   3.505
  619   HG12  VAL 114          HG12      VAL 114  19.551   6.626   3.640
  620   HG13  VAL 114          HG13      VAL 114  19.728   4.946   4.165
  621   HG21  VAL 114          HG21      VAL 114  20.495   5.713   6.399
  622   HG22  VAL 114          HG22      VAL 114  20.333   7.408   5.891
  623   HG23  VAL 114          HG23      VAL 114  19.525   6.824   7.361
  624    H    TRP 115           H        TRP 115  17.108   8.011   3.218
  625    HA   TRP 115           HA       TRP 115  17.668   9.860   1.905
  626    HB2  TRP 115           HB2      TRP 115  16.062  10.902   3.534
  627    HB3  TRP 115           HB3      TRP 115  17.433  11.469   4.473
  628    HD1  TRP 115           HD1      TRP 115  18.526  13.678   3.710
  629    HE1  TRP 115           HE1      TRP 115  18.093  15.395   1.839
  630    HE3  TRP 115           HE3      TRP 115  15.416  10.886   0.833
  631    HZ2  TRP 115           HZ2      TRP 115  16.417  15.550  -0.549
  632    HZ3  TRP 115           HZ3      TRP 115  14.389  11.822  -1.248
  633    HH2  TRP 115           HH2      TRP 115  14.871  14.160  -1.913
  Start of MODEL    2
    1    H1   MET   1           H        MET   1 -16.157   8.964  15.859
    2    HA   MET   1           HA       MET   1 -14.694   8.575  14.077
    3    HB2  MET   1           HB2      MET   1 -13.516   6.516  14.686
    4    HB3  MET   1           HB3      MET   1 -13.961   7.477  16.089
    5    HG2  MET   1           HG2      MET   1 -15.944   5.984  16.444
    6    HG3  MET   1           HG3      MET   1 -15.380   4.954  15.127
    7    HE1  MET   1           HE1      MET   1 -13.879   2.997  15.452
    8    HE2  MET   1           HE2      MET   1 -12.531   4.154  15.312
    9    HE3  MET   1           HE3      MET   1 -12.535   2.936  16.609
   10    H    LYS   2           H        LYS   2 -14.220   7.800  12.121
   11    HA   LYS   2           HA       LYS   2 -15.591   5.629  10.809
   12    HB2  LYS   2           HB2      LYS   2 -16.236   8.538  10.201
   13    HB3  LYS   2           HB3      LYS   2 -15.969   7.444   8.838
   14    HG2  LYS   2           HG2      LYS   2 -17.665   5.880   9.720
   15    HG3  LYS   2           HG3      LYS   2 -18.022   7.021  11.032
   16    HD2  LYS   2           HD2      LYS   2 -18.759   8.711   9.426
   17    HD3  LYS   2           HD3      LYS   2 -18.273   7.673   8.061
   18    HE2  LYS   2           HE2      LYS   2 -19.854   5.947   8.745
   19    HE3  LYS   2           HE3      LYS   2 -20.319   6.868  10.178
   20    HZ1  LYS   2           HZ1      LYS   2 -21.754   6.974   8.088
   21    HZ2  LYS   2           HZ2      LYS   2 -20.655   8.038   7.504
   22    HZ3  LYS   2           HZ3      LYS   2 -21.470   8.382   8.898
   23    H    VAL   3           H        VAL   3 -14.385   5.238   8.679
   24    HA   VAL   3           HA       VAL   3 -11.899   6.816   8.481
   25    HB   VAL   3           HB       VAL   3 -11.661   3.814   8.384
   26   HG11  VAL   3          HG11      VAL   3  -9.759   6.145   8.913
   27   HG12  VAL   3          HG12      VAL   3  -9.298   4.442   8.911
   28   HG13  VAL   3          HG13      VAL   3  -9.866   5.205   7.417
   29   HG21  VAL   3          HG21      VAL   3 -12.468   4.125  10.626
   30   HG22  VAL   3          HG22      VAL   3 -10.736   3.831  10.663
   31   HG23  VAL   3          HG23      VAL   3 -11.333   5.479  10.903
   32    HA   PRO   4           HA       PRO   4 -13.562   6.075   4.302
   33    HB2  PRO   4           HB2      PRO   4 -12.631   8.327   3.068
   34    HB3  PRO   4           HB3      PRO   4 -14.074   8.344   4.124
   35    HG2  PRO   4           HG2      PRO   4 -11.220   9.067   4.824
   36    HG3  PRO   4           HG3      PRO   4 -12.696  10.002   5.192
   37    HD2  PRO   4           HD2      PRO   4 -11.519   8.334   7.016
   38    HD3  PRO   4           HD3      PRO   4 -13.290   8.546   6.954
   39    H    GLY   5           H        GLY   5 -12.229   5.923   2.085
   40    HA2  GLY   5           HA2      GLY   5  -9.971   4.370   2.627
   41    HA3  GLY   5           HA3      GLY   5 -10.445   5.003   1.029
   42    H    VAL   6           H        VAL   6  -7.729   4.831   2.519
   43    HA   VAL   6           HA       VAL   6  -7.048   7.750   2.603
   44    HB   VAL   6           HB       VAL   6  -5.291   5.388   3.370
   45   HG11  VAL   6          HG11      VAL   6  -3.990   7.059   4.593
   46   HG12  VAL   6          HG12      VAL   6  -4.121   7.545   2.904
   47   HG13  VAL   6          HG13      VAL   6  -5.127   8.338   4.128
   48   HG21  VAL   6          HG21      VAL   6  -5.806   5.881   5.729
   49   HG22  VAL   6          HG22      VAL   6  -7.022   7.054   5.215
   50   HG23  VAL   6          HG23      VAL   6  -7.244   5.328   4.868
   51    H    ARG   7           H        ARG   7  -6.352   8.560   0.685
   52    HA   ARG   7           HA       ARG   7  -5.551   6.774  -1.469
   53    HB2  ARG   7           HB2      ARG   7  -5.386   8.602  -2.889
   54    HB3  ARG   7           HB3      ARG   7  -6.802   8.899  -1.910
   55    HG2  ARG   7           HG2      ARG   7  -4.126  10.300  -1.572
   56    HG3  ARG   7           HG3      ARG   7  -5.492  10.911  -2.471
   57    HD2  ARG   7           HD2      ARG   7  -5.566  10.337   0.505
   58    HD3  ARG   7           HD3      ARG   7  -5.247  11.907  -0.213
   59    HE   ARG   7           HE       ARG   7  -7.842  10.623   0.084
   60   HH11  ARG   7          HH11      ARG   7  -6.167  13.138  -1.965
   61   HH12  ARG   7          HH12      ARG   7  -7.638  14.031  -2.061
   62   HH21  ARG   7          HH21      ARG   7  -9.623  11.822  -0.235
   63   HH22  ARG   7          HH22      ARG   7  -9.592  13.278  -1.223
   64    H    VAL   8           H        VAL   8  -3.488   6.042  -1.833
   65    HA   VAL   8           HA       VAL   8  -1.216   7.536  -0.650
   66    HB   VAL   8           HB       VAL   8  -0.278   5.376   0.178
   67   HG11  VAL   8          HG11      VAL   8  -2.941   6.085   1.479
   68   HG12  VAL   8          HG12      VAL   8  -1.529   5.358   2.248
   69   HG13  VAL   8          HG13      VAL   8  -1.445   7.031   1.667
   70   HG21  VAL   8          HG21      VAL   8  -3.111   4.270  -0.189
   71   HG22  VAL   8          HG22      VAL   8  -1.648   3.751  -1.049
   72   HG23  VAL   8          HG23      VAL   8  -1.783   3.495   0.690
   73    H    ARG   9           H        ARG   9   0.621   7.481  -1.936
   74    HA   ARG   9           HA       ARG   9   0.209   6.351  -4.647
   75    HB2  ARG   9           HB2      ARG   9   0.526   8.788  -4.506
   76    HB3  ARG   9           HB3      ARG   9   2.094   8.557  -3.715
   77    HG2  ARG   9           HG2      ARG   9   2.993   7.517  -5.757
   78    HG3  ARG   9           HG3      ARG   9   1.373   7.493  -6.479
   79    HD2  ARG   9           HD2      ARG   9   2.503   9.315  -7.480
   80    HD3  ARG   9           HD3      ARG   9   1.333   9.994  -6.354
   81    HE   ARG   9           HE       ARG   9   4.070   9.626  -5.324
   82   HH11  ARG   9          HH11      ARG   9   1.676  12.003  -6.573
   83   HH12  ARG   9          HH12      ARG   9   2.755  13.334  -6.364
   84   HH21  ARG   9          HH21      ARG   9   5.524  11.428  -5.236
   85   HH22  ARG   9          HH22      ARG   9   4.951  12.998  -5.645
   86    H    ALA  10           H        ALA  10   1.531   4.926  -5.456
   87    HA   ALA  10           HA       ALA  10   3.441   3.477  -3.785
   88    HB1  ALA  10           HB1      ALA  10   2.483   3.339  -6.661
   89    HB2  ALA  10           HB2      ALA  10   3.615   2.174  -5.948
   90    HB3  ALA  10           HB3      ALA  10   1.948   2.324  -5.317
   91    H    LEU  11           H        LEU  11   5.556   4.106  -3.560
   92    HA   LEU  11           HA       LEU  11   6.668   5.987  -5.559
   93    HB2  LEU  11           HB2      LEU  11   7.875   4.936  -2.987
   94    HB3  LEU  11           HB3      LEU  11   8.582   6.161  -4.026
   95    HG   LEU  11           HG       LEU  11   5.954   6.457  -2.504
   96   HD11  LEU  11          HD11      LEU  11   7.185   7.998  -1.089
   97   HD12  LEU  11          HD12      LEU  11   8.653   7.797  -2.063
   98   HD13  LEU  11          HD13      LEU  11   8.026   6.443  -1.102
   99   HD21  LEU  11          HD21      LEU  11   7.438   8.393  -4.321
  100   HD22  LEU  11          HD22      LEU  11   6.156   8.867  -3.185
  101   HD23  LEU  11          HD23      LEU  11   5.783   7.769  -4.517
  102    H    TYR  12           H        TYR  12   6.623   2.615  -5.014
  103    HA   TYR  12           HA       TYR  12   8.876   2.155  -6.892
  104    HB2  TYR  12           HB2      TYR  12   8.218   0.192  -4.665
  105    HB3  TYR  12           HB3      TYR  12   9.672   0.295  -5.626
  106    HD1  TYR  12           HD1      TYR  12   7.870   1.517  -2.619
  107    HD2  TYR  12           HD2      TYR  12  11.366   2.170  -5.130
  108    HE1  TYR  12           HE1      TYR  12   8.724   3.091  -1.027
  109    HE2  TYR  12           HE2      TYR  12  12.137   3.870  -3.544
  110    HH   TYR  12           HH       TYR  12  11.245   5.367  -1.756
  111    H    ASP  13           H        ASP  13   8.521  -0.160  -7.911
  112    HA   ASP  13           HA       ASP  13   5.612  -0.582  -8.383
  113    HB2  ASP  13           HB2      ASP  13   6.143  -1.059 -10.620
  114    HB3  ASP  13           HB3      ASP  13   6.882   0.480 -10.215
  115    H    TYR  14           H        TYR  14   4.942  -2.375  -7.272
  116    HA   TYR  14           HA       TYR  14   6.401  -4.892  -7.638
  117    HB2  TYR  14           HB2      TYR  14   5.972  -3.431  -5.056
  118    HB3  TYR  14           HB3      TYR  14   5.500  -5.067  -5.012
  119    HD1  TYR  14           HD1      TYR  14   7.047  -6.762  -4.572
  120    HD2  TYR  14           HD2      TYR  14   8.438  -2.927  -5.990
  121    HE1  TYR  14           HE1      TYR  14   9.359  -7.470  -4.203
  122    HE2  TYR  14           HE2      TYR  14  10.748  -3.596  -5.629
  123    HH   TYR  14           HH       TYR  14  11.561  -6.966  -4.513
  124    H    THR  15           H        THR  15   4.906  -6.755  -7.336
  125    HA   THR  15           HA       THR  15   2.020  -6.007  -7.374
  126    HB   THR  15           HB       THR  15   2.820  -6.343  -9.606
  127    HG1  THR  15           HG1      THR  15   1.380  -8.657  -8.979
  128   HG21  THR  15          HG21      THR  15   3.628  -8.342 -10.572
  129   HG22  THR  15          HG22      THR  15   3.459  -9.265  -9.077
  130   HG23  THR  15          HG23      THR  15   4.697  -8.016  -9.208
  131    H    GLY  16           H        GLY  16   2.020  -6.406  -5.116
  132    HA2  GLY  16           HA2      GLY  16   1.672  -7.655  -3.236
  133    HA3  GLY  16           HA3      GLY  16   0.996  -8.862  -4.353
  134    H    GLN  17           H        GLN  17   1.806 -10.405  -2.775
  135    HA   GLN  17           HA       GLN  17   4.546 -11.247  -3.382
  136    HB2  GLN  17           HB2      GLN  17   4.712 -10.100  -1.253
  137    HB3  GLN  17           HB3      GLN  17   3.500 -11.162  -0.530
  138    HG2  GLN  17           HG2      GLN  17   5.861 -11.689   0.094
  139    HG3  GLN  17           HG3      GLN  17   5.016 -13.045  -0.621
  140   HE21  GLN  17          HE21      GLN  17   5.578 -13.683  -2.801
  141   HE22  GLN  17          HE22      GLN  17   7.050 -13.144  -3.593
  142    H    GLU  18           H        GLU  18   1.279 -11.875  -3.551
  143    HA   GLU  18           HA       GLU  18   1.654 -14.673  -4.101
  144    HB2  GLU  18           HB2      GLU  18   0.872 -13.931  -1.487
  145    HB3  GLU  18           HB3      GLU  18  -0.673 -14.135  -2.294
  146    HG2  GLU  18           HG2      GLU  18   1.498 -16.245  -2.223
  147    HG3  GLU  18           HG3      GLU  18   0.130 -16.149  -1.109
  148    H    ALA  19           H        ALA  19  -0.697 -15.355  -5.025
  149    HA   ALA  19           HA       ALA  19  -1.481 -13.284  -6.928
  150    HB1  ALA  19           HB1      ALA  19  -2.944 -15.084  -7.830
  151    HB2  ALA  19           HB2      ALA  19  -1.259 -15.583  -7.675
  152    HB3  ALA  19           HB3      ALA  19  -2.468 -16.137  -6.483
  153    H    ASP  20           H        ASP  20  -2.696 -14.318  -3.827
  154    HA   ASP  20           HA       ASP  20  -5.445 -13.380  -4.314
  155    HB2  ASP  20           HB2      ASP  20  -4.125 -15.151  -2.455
  156    HB3  ASP  20           HB3      ASP  20  -4.921 -13.874  -1.547
  157    H    GLU  21           H        GLU  21  -2.727 -11.756  -4.065
  158    HA   GLU  21           HA       GLU  21  -3.616  -9.655  -2.205
  159    HB2  GLU  21           HB2      GLU  21  -0.834  -9.783  -3.278
  160    HB3  GLU  21           HB3      GLU  21  -1.411  -9.196  -1.728
  161    HG2  GLU  21           HG2      GLU  21  -1.013 -12.046  -2.580
  162    HG3  GLU  21           HG3      GLU  21  -0.073 -11.161  -1.406
  163    H    LEU  22           H        LEU  22  -2.652  -7.453  -3.014
  164    HA   LEU  22           HA       LEU  22  -4.016  -6.733  -5.493
  165    HB2  LEU  22           HB2      LEU  22  -3.391  -5.461  -2.971
  166    HB3  LEU  22           HB3      LEU  22  -2.531  -4.550  -4.185
  167    HG   LEU  22           HG       LEU  22  -5.467  -5.206  -4.120
  168   HD11  LEU  22          HD11      LEU  22  -5.836  -2.837  -3.589
  169   HD12  LEU  22          HD12      LEU  22  -4.079  -2.563  -3.582
  170   HD13  LEU  22          HD13      LEU  22  -4.831  -3.623  -2.368
  171   HD21  LEU  22          HD21      LEU  22  -4.789  -4.867  -6.478
  172   HD22  LEU  22          HD22      LEU  22  -3.974  -3.352  -6.032
  173   HD23  LEU  22          HD23      LEU  22  -5.738  -3.494  -5.923
  174    H    SER  23           H        SER  23  -2.785  -4.882  -6.771
  175    HA   SER  23           HA       SER  23   0.082  -5.355  -7.106
  176    HB2  SER  23           HB2      SER  23  -1.175  -6.983  -8.563
  177    HB3  SER  23           HB3      SER  23  -2.117  -5.627  -9.211
  178    HG   SER  23           HG       SER  23   0.450  -6.478  -9.718
  179    H    PHE  24           H        PHE  24   1.011  -3.227  -7.493
  180    HA   PHE  24           HA       PHE  24  -0.735  -1.205  -8.733
  181    HB2  PHE  24           HB2      PHE  24  -0.144   0.465  -7.098
  182    HB3  PHE  24           HB3      PHE  24  -1.147  -0.822  -6.462
  183    HD1  PHE  24           HD1      PHE  24   2.501   0.141  -6.710
  184    HD2  PHE  24           HD2      PHE  24  -0.614  -1.677  -4.310
  185    HE1  PHE  24           HE1      PHE  24   3.982   0.128  -4.760
  186    HE2  PHE  24           HE2      PHE  24   0.958  -1.695  -2.384
  187    HZ   PHE  24           HZ       PHE  24   3.231  -0.767  -2.586
  188    H    LYS  25           H        LYS  25   0.916   0.846  -9.134
  189    HA   LYS  25           HA       LYS  25   3.573  -0.221  -9.945
  190    HB2  LYS  25           HB2      LYS  25   1.754   1.517 -11.670
  191    HB3  LYS  25           HB3      LYS  25   3.353   0.915 -12.107
  192    HG2  LYS  25           HG2      LYS  25   0.897  -0.848 -11.637
  193    HG3  LYS  25           HG3      LYS  25   1.409  -0.256 -13.199
  194    HD2  LYS  25           HD2      LYS  25   3.600  -1.662 -11.761
  195    HD3  LYS  25           HD3      LYS  25   2.161  -2.655 -12.002
  196    HE2  LYS  25           HE2      LYS  25   3.623  -2.963 -13.909
  197    HE3  LYS  25           HE3      LYS  25   2.150  -2.130 -14.402
  198    HZ1  LYS  25           HZ1      LYS  25   3.402  -0.037 -14.347
  199    HZ2  LYS  25           HZ2      LYS  25   4.049  -1.101 -15.399
  200    HZ3  LYS  25           HZ3      LYS  25   4.782  -0.869 -13.972
  201    H    ALA  26           H        ALA  26   5.179   1.605 -10.246
  202    HA   ALA  26           HA       ALA  26   4.955   3.503  -8.164
  203    HB1  ALA  26           HB1      ALA  26   6.722   3.495 -10.642
  204    HB2  ALA  26           HB2      ALA  26   6.935   4.576  -9.245
  205    HB3  ALA  26           HB3      ALA  26   7.130   2.825  -9.049
  206    H    GLY  27           H        GLY  27   3.645   5.206  -8.060
  207    HA2  GLY  27           HA2      GLY  27   3.006   7.407  -8.812
  208    HA3  GLY  27           HA3      GLY  27   2.941   6.819 -10.481
  209    H    GLU  28           H        GLU  28   1.584   4.229  -9.129
  210    HA   GLU  28           HA       GLU  28  -1.088   5.069  -9.779
  211    HB2  GLU  28           HB2      GLU  28   0.140   2.673  -9.833
  212    HB3  GLU  28           HB3      GLU  28  -0.466   2.571  -8.182
  213    HG2  GLU  28           HG2      GLU  28  -2.073   1.534  -9.630
  214    HG3  GLU  28           HG3      GLU  28  -2.784   3.067  -9.127
  215    H    GLU  29           H        GLU  29  -2.887   5.264  -8.265
  216    HA   GLU  29           HA       GLU  29  -2.060   5.788  -5.456
  217    HB2  GLU  29           HB2      GLU  29  -4.055   7.244  -7.172
  218    HB3  GLU  29           HB3      GLU  29  -3.828   7.502  -5.434
  219    HG2  GLU  29           HG2      GLU  29  -1.410   8.099  -5.948
  220    HG3  GLU  29           HG3      GLU  29  -1.840   8.097  -7.667
  221    H    LEU  30           H        LEU  30  -2.818   4.214  -4.287
  222    HA   LEU  30           HA       LEU  30  -5.446   2.942  -4.925
  223    HB2  LEU  30           HB2      LEU  30  -4.592   1.264  -3.190
  224    HB3  LEU  30           HB3      LEU  30  -3.912   1.178  -4.828
  225    HG   LEU  30           HG       LEU  30  -2.434   2.777  -2.753
  226   HD11  LEU  30          HD11      LEU  30  -2.986   0.776  -1.495
  227   HD12  LEU  30          HD12      LEU  30  -1.291   0.718  -1.966
  228   HD13  LEU  30          HD13      LEU  30  -2.467  -0.268  -2.852
  229   HD21  LEU  30          HD21      LEU  30  -0.465   1.765  -3.976
  230   HD22  LEU  30          HD22      LEU  30  -1.508   2.704  -5.039
  231   HD23  LEU  30          HD23      LEU  30  -1.609   0.938  -5.038
  232    H    MET  31           H        MET  31  -6.826   2.390  -3.060
  233    HA   MET  31           HA       MET  31  -6.736   4.492  -0.981
  234    HB2  MET  31           HB2      MET  31  -9.309   3.167  -1.773
  235    HB3  MET  31           HB3      MET  31  -9.019   4.693  -0.988
  236    HG2  MET  31           HG2      MET  31  -8.398   4.083  -3.908
  237    HG3  MET  31           HG3      MET  31  -9.809   4.951  -3.325
  238    HE1  MET  31           HE1      MET  31  -9.037   7.114  -1.281
  239    HE2  MET  31           HE2      MET  31  -8.745   8.389  -2.501
  240    HE3  MET  31           HE3      MET  31 -10.010   7.190  -2.785
  241    H    LYS  32           H        LYS  32  -5.909   3.536   0.798
  242    HA   LYS  32           HA       LYS  32  -6.142   0.725   1.434
  243    HB2  LYS  32           HB2      LYS  32  -4.428   2.305   2.280
  244    HB3  LYS  32           HB3      LYS  32  -5.670   3.152   3.206
  245    HG2  LYS  32           HG2      LYS  32  -6.154   1.006   4.480
  246    HG3  LYS  32           HG3      LYS  32  -4.802   0.256   3.625
  247    HD2  LYS  32           HD2      LYS  32  -4.019   0.929   5.790
  248    HD3  LYS  32           HD3      LYS  32  -3.311   2.064   4.622
  249    HE2  LYS  32           HE2      LYS  32  -5.349   3.583   5.176
  250    HE3  LYS  32           HE3      LYS  32  -5.656   2.442   6.501
  251    HZ1  LYS  32           HZ1      LYS  32  -3.401   2.927   7.269
  252    HZ2  LYS  32           HZ2      LYS  32  -4.366   4.254   7.307
  253    HZ3  LYS  32           HZ3      LYS  32  -3.229   4.075   6.111
  254    H    ILE  33           H        ILE  33  -7.614  -0.299   3.052
  255    HA   ILE  33           HA       ILE  33  -9.853   1.444   3.925
  256    HB   ILE  33           HB       ILE  33 -11.502   0.034   3.283
  257   HG12  ILE  33          HG12      ILE  33  -9.644  -2.135   2.256
  258   HG13  ILE  33          HG13      ILE  33 -10.411  -2.164   3.826
  259   HG21  ILE  33          HG21      ILE  33 -10.654   1.461   1.489
  260   HG22  ILE  33          HG22      ILE  33  -9.751   0.091   0.824
  261   HG23  ILE  33          HG23      ILE  33 -11.525   0.048   0.898
  262   HD11  ILE  33          HD11      ILE  33 -11.876  -2.204   1.178
  263   HD12  ILE  33          HD12      ILE  33 -11.709  -3.501   2.379
  264   HD13  ILE  33          HD13      ILE  33 -12.646  -2.058   2.778
  265    H    SER  34           H        SER  34  -7.468  -0.714   4.974
  266    HA   SER  34           HA       SER  34  -8.924  -1.233   7.509
  267    HB2  SER  34           HB2      SER  34  -7.248  -3.105   5.766
  268    HB3  SER  34           HB3      SER  34  -7.630  -3.453   7.455
  269    HG   SER  34           HG       SER  34  -9.770  -3.514   6.989
  270    H    GLU  35           H        GLU  35  -6.993  -2.159   9.104
  271    HA   GLU  35           HA       GLU  35  -5.085   0.072   9.236
  272    HB2  GLU  35           HB2      GLU  35  -6.459  -1.532  11.128
  273    HB3  GLU  35           HB3      GLU  35  -4.790  -2.057  11.241
  274    HG2  GLU  35           HG2      GLU  35  -4.837  -0.303  12.759
  275    HG3  GLU  35           HG3      GLU  35  -4.225   0.504  11.314
  276    H    GLU  36           H        GLU  36  -2.727  -0.618   9.996
  277    HA   GLU  36           HA       GLU  36  -1.643  -2.461   7.969
  278    HB2  GLU  36           HB2      GLU  36  -0.769  -0.160   8.297
  279    HB3  GLU  36           HB3      GLU  36  -0.249  -0.583   9.930
  280    HG2  GLU  36           HG2      GLU  36   1.341  -2.188   9.048
  281    HG3  GLU  36           HG3      GLU  36   0.648  -2.088   7.426
  282    H    ASP  37           H        ASP  37  -0.426  -4.236   8.533
  283    HA   ASP  37           HA       ASP  37  -0.824  -5.373  11.261
  284    HB2  ASP  37           HB2      ASP  37  -0.173  -6.559   8.550
  285    HB3  ASP  37           HB3      ASP  37  -0.108  -7.503  10.036
  286    H    GLU  38           H        GLU  38   0.991  -6.912  11.891
  287    HA   GLU  38           HA       GLU  38   3.428  -5.668  12.373
  288    HB2  GLU  38           HB2      GLU  38   4.122  -7.961  13.125
  289    HB3  GLU  38           HB3      GLU  38   2.559  -7.438  13.758
  290    HG2  GLU  38           HG2      GLU  38   1.366  -8.828  12.098
  291    HG3  GLU  38           HG3      GLU  38   2.898  -9.278  11.338
  292    H    GLN  39           H        GLN  39   2.498  -7.202   9.464
  293    HA   GLN  39           HA       GLN  39   5.306  -7.622   8.521
  294    HB2  GLN  39           HB2      GLN  39   2.604  -8.778   7.806
  295    HB3  GLN  39           HB3      GLN  39   3.758  -8.599   6.511
  296    HG2  GLN  39           HG2      GLN  39   4.148 -10.370   8.941
  297    HG3  GLN  39           HG3      GLN  39   3.817 -10.824   7.309
  298   HE21  GLN  39          HE21      GLN  39   6.389  -9.481   9.483
  299   HE22  GLN  39          HE22      GLN  39   7.650  -9.707   8.297
  300    H    GLY  40           H        GLY  40   3.210  -5.062   8.711
  301    HA2  GLY  40           HA2      GLY  40   3.146  -3.131   7.573
  302    HA3  GLY  40           HA3      GLY  40   4.462  -3.697   6.520
  303    H    TRP  41           H        TRP  41   1.456  -5.494   7.033
  304    HA   TRP  41           HA       TRP  41   0.801  -5.369   4.151
  305    HB2  TRP  41           HB2      TRP  41   0.186  -7.153   6.498
  306    HB3  TRP  41           HB3      TRP  41  -1.090  -6.968   5.322
  307    HD1  TRP  41           HD1      TRP  41   1.258  -9.389   6.068
  308    HE1  TRP  41           HE1      TRP  41   1.868 -10.837   4.032
  309    HE3  TRP  41           HE3      TRP  41  -0.314  -6.258   2.376
  310    HZ2  TRP  41           HZ2      TRP  41   2.082 -10.466   1.231
  311    HZ3  TRP  41           HZ3      TRP  41   0.107  -6.842  -0.015
  312    HH2  TRP  41           HH2      TRP  41   1.181  -8.859  -0.624
  313    H    CYS  42           H        CYS  42  -1.077  -4.377   3.414
  314    HA   CYS  42           HA       CYS  42  -3.002  -3.351   5.393
  315    HB2  CYS  42           HB2      CYS  42  -1.385  -1.784   3.363
  316    HB3  CYS  42           HB3      CYS  42  -3.070  -1.331   3.680
  317    HG   CYS  42           HG       CYS  42  -1.329   0.203   4.955
  318    H    LYS  43           H        LYS  43  -5.089  -3.426   4.570
  319    HA   LYS  43           HA       LYS  43  -5.414  -4.779   1.940
  320    HB2  LYS  43           HB2      LYS  43  -6.346  -5.531   4.471
  321    HB3  LYS  43           HB3      LYS  43  -7.750  -4.725   3.775
  322    HG2  LYS  43           HG2      LYS  43  -6.242  -6.703   2.069
  323    HG3  LYS  43           HG3      LYS  43  -7.168  -7.353   3.415
  324    HD2  LYS  43           HD2      LYS  43  -9.229  -6.527   2.524
  325    HD3  LYS  43           HD3      LYS  43  -8.378  -5.484   1.371
  326    HE2  LYS  43           HE2      LYS  43  -9.303  -7.446   0.229
  327    HE3  LYS  43           HE3      LYS  43  -7.545  -7.382   0.138
  328    HZ1  LYS  43           HZ1      LYS  43  -9.072  -9.120   1.993
  329    HZ2  LYS  43           HZ2      LYS  43  -7.426  -9.115   1.786
  330    HZ3  LYS  43           HZ3      LYS  43  -8.415  -9.576   0.573
  331    H    GLY  44           H        GLY  44  -6.522  -3.720   0.338
  332    HA2  GLY  44           HA2      GLY  44  -8.182  -1.404   0.994
  333    HA3  GLY  44           HA3      GLY  44  -6.642  -1.025   0.278
  334    H    ARG  45           H        ARG  45  -8.275  -0.111  -1.256
  335    HA   ARG  45           HA       ARG  45  -8.902  -2.089  -3.375
  336    HB2  ARG  45           HB2      ARG  45 -10.523   0.284  -2.384
  337    HB3  ARG  45           HB3      ARG  45 -10.693  -0.279  -4.045
  338    HG2  ARG  45           HG2      ARG  45 -11.438  -2.462  -3.346
  339    HG3  ARG  45           HG3      ARG  45 -11.194  -2.040  -1.629
  340    HD2  ARG  45           HD2      ARG  45 -12.833  -0.150  -1.937
  341    HD3  ARG  45           HD3      ARG  45 -13.149  -0.734  -3.577
  342    HE   ARG  45           HE       ARG  45 -13.635  -2.975  -2.172
  343   HH11  ARG  45          HH11      ARG  45 -14.935   0.360  -1.665
  344   HH12  ARG  45          HH12      ARG  45 -16.278  -0.242  -0.745
  345   HH21  ARG  45          HH21      ARG  45 -15.430  -3.638  -1.163
  346   HH22  ARG  45          HH22      ARG  45 -16.724  -2.580  -0.705
  347    H    LEU  46           H        LEU  46  -8.883  -1.076  -5.533
  348    HA   LEU  46           HA       LEU  46  -6.819   1.097  -5.707
  349    HB2  LEU  46           HB2      LEU  46  -7.123  -1.411  -7.160
  350    HB3  LEU  46           HB3      LEU  46  -7.175  -0.064  -8.289
  351    HG   LEU  46           HG       LEU  46  -5.035  -0.461  -6.183
  352   HD11  LEU  46          HD11      LEU  46  -4.865  -0.983  -9.168
  353   HD12  LEU  46          HD12      LEU  46  -4.979  -2.240  -7.940
  354   HD13  LEU  46          HD13      LEU  46  -3.564  -1.170  -7.988
  355   HD21  LEU  46          HD21      LEU  46  -5.242   1.942  -6.949
  356   HD22  LEU  46          HD22      LEU  46  -5.074   1.388  -8.628
  357   HD23  LEU  46          HD23      LEU  46  -3.735   1.202  -7.485
  358    H    LEU  47           H        LEU  47  -7.211   2.454  -7.902
  359    HA   LEU  47           HA       LEU  47  -9.735   3.743  -7.507
  360    HB2  LEU  47           HB2      LEU  47  -9.227   4.989  -9.579
  361    HB3  LEU  47           HB3      LEU  47  -8.040   5.119  -8.316
  362    HG   LEU  47           HG       LEU  47  -7.341   2.933 -10.156
  363   HD11  LEU  47          HD11      LEU  47  -8.571   4.309 -11.814
  364   HD12  LEU  47          HD12      LEU  47  -6.831   4.328 -12.128
  365   HD13  LEU  47          HD13      LEU  47  -7.604   5.729 -11.355
  366   HD21  LEU  47          HD21      LEU  47  -5.784   3.917  -8.594
  367   HD22  LEU  47          HD22      LEU  47  -5.964   5.515  -9.332
  368   HD23  LEU  47          HD23      LEU  47  -5.210   4.188 -10.244
  369    H    THR  48           H        THR  48  -8.703   1.228  -9.821
  370    HA   THR  48           HA       THR  48 -11.121   1.324 -11.378
  371    HB   THR  48           HB       THR  48  -8.831   0.497 -12.043
  372    HG1  THR  48           HG1      THR  48 -10.956  -1.311 -12.508
  373   HG21  THR  48          HG21      THR  48  -9.614  -2.083 -10.633
  374   HG22  THR  48          HG22      THR  48  -8.337  -0.959 -10.096
  375   HG23  THR  48          HG23      THR  48  -8.185  -1.809 -11.638
  376    H    GLY  49           H        GLY  49 -10.813   0.473  -8.120
  377    HA2  GLY  49           HA2      GLY  49 -12.458  -0.422  -6.804
  378    HA3  GLY  49           HA3      GLY  49 -13.251  -1.138  -8.211
  379    H    HIS  50           H        HIS  50  -9.937  -1.922  -8.350
  380    HA   HIS  50           HA       HIS  50 -10.321  -4.678  -7.933
  381    HB2  HIS  50           HB2      HIS  50  -8.295  -3.099  -8.942
  382    HB3  HIS  50           HB3      HIS  50  -7.607  -3.544  -7.392
  383    HD1  HIS  50           HD1      HIS  50  -8.563  -5.031 -10.792
  384    HD2  HIS  50           HD2      HIS  50  -6.850  -6.123  -7.069
  385    HE1  HIS  50           HE1      HIS  50  -7.461  -7.281 -11.122
  386    H    VAL  51           H        VAL  51  -9.656  -6.046  -6.064
  387    HA   VAL  51           HA       VAL  51  -9.217  -4.568  -3.526
  388    HB   VAL  51           HB       VAL  51 -11.468  -4.963  -3.349
  389   HG11  VAL  51          HG11      VAL  51 -11.222  -7.713  -4.622
  390   HG12  VAL  51          HG12      VAL  51 -12.701  -7.021  -3.941
  391   HG13  VAL  51          HG13      VAL  51 -11.965  -6.265  -5.352
  392   HG21  VAL  51          HG21      VAL  51 -11.845  -6.628  -1.680
  393   HG22  VAL  51          HG22      VAL  51 -10.489  -7.617  -2.234
  394   HG23  VAL  51          HG23      VAL  51 -10.182  -6.059  -1.453
  395    H    GLY  52           H        GLY  52  -7.655  -5.386  -2.235
  396    HA2  GLY  52           HA2      GLY  52  -6.932  -8.112  -2.027
  397    HA3  GLY  52           HA3      GLY  52  -5.867  -7.356  -3.217
  398    H    LEU  53           H        LEU  53  -4.462  -8.204  -1.304
  399    HA   LEU  53           HA       LEU  53  -4.091  -6.320   0.948
  400    HB2  LEU  53           HB2      LEU  53  -3.359  -9.151   0.259
  401    HB3  LEU  53           HB3      LEU  53  -2.132  -8.271   1.140
  402    HG   LEU  53           HG       LEU  53  -4.998  -8.405   2.109
  403   HD11  LEU  53          HD11      LEU  53  -4.114 -10.665   1.902
  404   HD12  LEU  53          HD12      LEU  53  -4.299 -10.199   3.608
  405   HD13  LEU  53          HD13      LEU  53  -2.688 -10.219   2.839
  406   HD21  LEU  53          HD21      LEU  53  -3.538  -6.582   3.040
  407   HD22  LEU  53          HD22      LEU  53  -2.380  -7.819   3.557
  408   HD23  LEU  53          HD23      LEU  53  -4.003  -7.749   4.258
  409    H    TYR  54           H        TYR  54  -2.392  -4.813   0.791
  410    HA   TYR  54           HA       TYR  54  -0.549  -5.082  -1.497
  411    HB2  TYR  54           HB2      TYR  54  -0.754  -2.865  -2.068
  412    HB3  TYR  54           HB3      TYR  54  -2.381  -3.417  -1.911
  413    HD1  TYR  54           HD1      TYR  54  -3.887  -2.403  -0.236
  414    HD2  TYR  54           HD2      TYR  54   0.320  -1.419  -0.287
  415    HE1  TYR  54           HE1      TYR  54  -4.280  -0.566   1.381
  416    HE2  TYR  54           HE2      TYR  54  -0.079   0.327   1.368
  417    HH   TYR  54           HH       TYR  54  -1.554   1.444   2.700
  418    HA   PRO  55           HA       PRO  55   2.213  -4.494   2.007
  419    HB2  PRO  55           HB2      PRO  55   4.604  -4.019   0.826
  420    HB3  PRO  55           HB3      PRO  55   3.761  -5.602   0.749
  421    HG2  PRO  55           HG2      PRO  55   3.845  -3.422  -1.322
  422    HG3  PRO  55           HG3      PRO  55   4.071  -5.167  -1.572
  423    HD2  PRO  55           HD2      PRO  55   1.656  -3.917  -2.011
  424    HD3  PRO  55           HD3      PRO  55   1.789  -5.605  -1.433
  425    H    ALA  56           H        ALA  56   1.820  -2.752   3.238
  426    HA   ALA  56           HA       ALA  56   1.524  -0.065   2.463
  427    HB1  ALA  56           HB1      ALA  56   2.372  -1.107   5.185
  428    HB2  ALA  56           HB2      ALA  56   1.474   0.378   4.848
  429    HB3  ALA  56           HB3      ALA  56   0.719  -1.211   4.588
  430    H    ASN  57           H        ASN  57   4.364  -1.872   3.285
  431    HA   ASN  57           HA       ASN  57   6.101   0.351   3.825
  432    HB2  ASN  57           HB2      ASN  57   7.358  -2.093   2.644
  433    HB3  ASN  57           HB3      ASN  57   7.754  -1.130   4.049
  434   HD21  ASN  57          HD21      ASN  57   5.720  -3.864   2.872
  435   HD22  ASN  57          HD22      ASN  57   5.255  -4.366   4.492
  436    H    TYR  58           H        TYR  58   4.793  -0.780   0.793
  437    HA   TYR  58           HA       TYR  58   7.005   0.499  -0.729
  438    HB2  TYR  58           HB2      TYR  58   4.969  -1.577  -1.540
  439    HB3  TYR  58           HB3      TYR  58   6.092  -0.773  -2.616
  440    HD1  TYR  58           HD1      TYR  58   6.341  -2.715   0.637
  441    HD2  TYR  58           HD2      TYR  58   7.818  -2.122  -3.358
  442    HE1  TYR  58           HE1      TYR  58   8.093  -4.409   1.043
  443    HE2  TYR  58           HE2      TYR  58   9.646  -3.712  -2.906
  444    HH   TYR  58           HH       TYR  58   9.888  -5.787  -0.103
  445    H    VAL  59           H        VAL  59   4.335   1.631   0.634
  446    HA   VAL  59           HA       VAL  59   3.714   3.397  -1.655
  447    HB   VAL  59           HB       VAL  59   1.999   1.397  -1.199
  448   HG11  VAL  59          HG11      VAL  59   1.025   3.494   0.791
  449   HG12  VAL  59          HG12      VAL  59   0.137   2.085   0.235
  450   HG13  VAL  59          HG13      VAL  59   1.630   1.869   1.192
  451   HG21  VAL  59          HG21      VAL  59   0.118   2.762  -1.959
  452   HG22  VAL  59          HG22      VAL  59   1.073   4.230  -1.690
  453   HG23  VAL  59          HG23      VAL  59   1.566   3.002  -2.894
  454    H    GLU  60           H        GLU  60   2.913   5.573  -0.876
  455    HA   GLU  60           HA       GLU  60   3.262   6.033   2.020
  456    HB2  GLU  60           HB2      GLU  60   5.493   6.291   1.014
  457    HB3  GLU  60           HB3      GLU  60   4.868   7.455  -0.166
  458    HG2  GLU  60           HG2      GLU  60   4.531   9.114   1.494
  459    HG3  GLU  60           HG3      GLU  60   4.492   7.942   2.797
  460    H    LYS  61           H        LYS  61   2.630   8.394   2.497
  461    HA   LYS  61           HA       LYS  61   0.040   8.832   1.265
  462    HB2  LYS  61           HB2      LYS  61   1.586  10.198   3.478
  463    HB3  LYS  61           HB3      LYS  61   0.359  11.134   2.611
  464    HG2  LYS  61           HG2      LYS  61  -1.167   9.040   2.938
  465    HG3  LYS  61           HG3      LYS  61  -0.029   8.621   4.227
  466    HD2  LYS  61           HD2      LYS  61  -1.859  11.032   3.936
  467    HD3  LYS  61           HD3      LYS  61  -1.855   9.804   5.210
  468    HE2  LYS  61           HE2      LYS  61   0.394  10.639   5.939
  469    HE3  LYS  61           HE3      LYS  61   0.307  11.899   4.686
  470    HZ1  LYS  61           HZ1      LYS  61  -1.731  11.615   6.804
  471    HZ2  LYS  61           HZ2      LYS  61  -1.487  12.895   5.779
  472    HZ3  LYS  61           HZ3      LYS  61  -0.402  12.609   6.948
  473    H    VAL  62           H        VAL  62  -0.642  10.837   0.360
  474    HA   VAL  62           HA       VAL  62   1.444  12.252  -1.082
  475    HB   VAL  62           HB       VAL  62   0.996  10.302  -2.441
  476   HG11  VAL  62          HG11      VAL  62  -1.094   9.666  -3.401
  477   HG12  VAL  62          HG12      VAL  62  -1.396   9.867  -1.680
  478   HG13  VAL  62          HG13      VAL  62  -1.902  11.116  -2.852
  479   HG21  VAL  62          HG21      VAL  62   1.526  12.452  -3.517
  480   HG22  VAL  62          HG22      VAL  62   0.584  11.358  -4.535
  481   HG23  VAL  62          HG23      VAL  62  -0.211  12.746  -3.768
  482    H    GLY  63           H        GLY  63  -2.137  11.926  -1.220
  483    HA2  GLY  63           HA2      GLY  63  -3.806  13.439  -0.832
  484    HA3  GLY  63           HA3      GLY  63  -2.660  14.315   0.200
  485    H    LEU  64           H        LEU  64  -3.970  16.086  -0.720
  486    HA   LEU  64           HA       LEU  64  -3.615  16.931  -3.485
  487    HB2  LEU  64           HB2      LEU  64  -4.479  18.457  -0.984
  488    HB3  LEU  64           HB3      LEU  64  -4.624  19.048  -2.646
  489    HG   LEU  64           HG       LEU  64  -6.072  16.604  -1.522
  490   HD11  LEU  64          HD11      LEU  64  -7.103  19.377  -2.222
  491   HD12  LEU  64          HD12      LEU  64  -6.897  18.717  -0.577
  492   HD13  LEU  64          HD13      LEU  64  -8.083  17.998  -1.678
  493   HD21  LEU  64          HD21      LEU  64  -6.229  17.983  -4.241
  494   HD22  LEU  64          HD22      LEU  64  -7.364  16.755  -3.654
  495   HD23  LEU  64          HD23      LEU  64  -5.679  16.326  -3.905
  496    H    ALA  65           H        ALA  65  -2.577  19.112  -3.948
  497    HA   ALA  65           HA       ALA  65   0.141  19.080  -2.920
  498    HB1  ALA  65           HB1      ALA  65  -0.383  19.418  -5.308
  499    HB2  ALA  65           HB2      ALA  65  -1.181  20.951  -4.897
  500    HB3  ALA  65           HB3      ALA  65   0.563  20.738  -4.606
  501    H    ALA  66           H        ALA  66  -0.945  19.504  -0.632
  502    HA   ALA  66           HA       ALA  66  -0.251  22.158   0.200
  503    HB1  ALA  66           HB1      ALA  66  -2.400  22.887   1.057
  504    HB2  ALA  66           HB2      ALA  66  -2.641  22.550  -0.664
  505    HB3  ALA  66           HB3      ALA  66  -3.184  21.378   0.558
  506    H    ALA  67           H        ALA  67  -0.070  22.223   2.472
  507    HA   ALA  67           HA       ALA  67   0.449  21.379   4.516
  508    HB1  ALA  67           HB1      ALA  67  -1.967  21.855   4.783
  509    HB2  ALA  67           HB2      ALA  67  -2.354  20.202   4.256
  510    HB3  ALA  67           HB3      ALA  67  -1.466  20.482   5.775
  511    H1   THR 101           H        THR 101  -4.193  -9.898   7.573
  512    HA   THR 101           HA       THR 101  -2.091 -10.210   6.413
  513    HB   THR 101           HB       THR 101  -1.115 -10.564   9.261
  514    HG1  THR 101           HG1      THR 101  -1.142  -8.508   7.993
  515   HG21  THR 101          HG21      THR 101   0.010 -12.425   8.138
  516   HG22  THR 101          HG22      THR 101   1.144 -11.087   8.338
  517   HG23  THR 101          HG23      THR 101   0.404 -11.369   6.758
  518    H    LYS 102           H        LYS 102  -1.263 -12.304   5.764
  519    HA   LYS 102           HA       LYS 102  -2.527 -14.729   6.790
  520    HB2  LYS 102           HB2      LYS 102  -3.494 -15.308   4.556
  521    HB3  LYS 102           HB3      LYS 102  -4.312 -13.972   5.363
  522    HG2  LYS 102           HG2      LYS 102  -3.420 -12.336   3.978
  523    HG3  LYS 102           HG3      LYS 102  -2.104 -13.349   3.393
  524    HD2  LYS 102           HD2      LYS 102  -5.042 -13.819   2.720
  525    HD3  LYS 102           HD3      LYS 102  -3.884 -12.917   1.718
  526    HE2  LYS 102           HE2      LYS 102  -2.378 -15.024   1.897
  527    HE3  LYS 102           HE3      LYS 102  -3.850 -15.871   2.402
  528    HZ1  LYS 102           HZ1      LYS 102  -3.481 -15.982   0.024
  529    HZ2  LYS 102           HZ2      LYS 102  -3.484 -14.337  -0.105
  530    HZ3  LYS 102           HZ3      LYS 102  -4.867 -15.165   0.336
  531    H    GLY 103           H        GLY 103   0.263 -13.281   5.900
  532    HA2  GLY 103           HA2      GLY 103   1.796 -15.493   5.658
  533    HA3  GLY 103           HA3      GLY 103   1.402 -15.032   3.979
  534    HA   PRO 104           HA       PRO 104   4.643 -12.173   5.892
  535    HB2  PRO 104           HB2      PRO 104   6.985 -13.086   4.782
  536    HB3  PRO 104           HB3      PRO 104   6.295 -13.716   6.308
  537    HG2  PRO 104           HG2      PRO 104   6.094 -14.893   3.532
  538    HG3  PRO 104           HG3      PRO 104   6.423 -15.727   5.086
  539    HD2  PRO 104           HD2      PRO 104   3.929 -15.646   3.916
  540    HD3  PRO 104           HD3      PRO 104   4.181 -15.707   5.676
  541    H    ALA 105           H        ALA 105   4.804 -10.378   4.892
  542    HA   ALA 105           HA       ALA 105   4.115  -9.716   2.232
  543    HB1  ALA 105           HB1      ALA 105   5.460  -8.267   4.586
  544    HB2  ALA 105           HB2      ALA 105   4.773  -7.405   3.214
  545    HB3  ALA 105           HB3      ALA 105   3.721  -8.321   4.268
  546    HA   PRO 106           HA       PRO 106   8.203  -9.622   0.359
  547    HB2  PRO 106           HB2      PRO 106   8.145  -7.507  -1.327
  548    HB3  PRO 106           HB3      PRO 106   7.009  -8.907  -1.354
  549    HG2  PRO 106           HG2      PRO 106   6.470  -6.198  -0.171
  550    HG3  PRO 106           HG3      PRO 106   5.509  -7.062  -1.418
  551    HD2  PRO 106           HD2      PRO 106   5.016  -7.227   1.258
  552    HD3  PRO 106           HD3      PRO 106   4.648  -8.564   0.168
  553    H    ASN 107           H        ASN 107   7.458  -7.761   2.549
  554    HA   ASN 107           HA       ASN 107   9.376  -5.567   2.630
  555    HB2  ASN 107           HB2      ASN 107   8.415  -4.739   4.402
  556    HB3  ASN 107           HB3      ASN 107   7.090  -5.874   4.020
  557   HD21  ASN 107          HD21      ASN 107   7.353  -4.548   6.504
  558   HD22  ASN 107          HD22      ASN 107   7.748  -5.745   7.696
  559    HA   PRO 108           HA       PRO 108  10.331  -4.542   5.339
  560    HB2  PRO 108           HB2      PRO 108  12.948  -3.641   5.345
  561    HB3  PRO 108           HB3      PRO 108  12.161  -4.560   6.654
  562    HG2  PRO 108           HG2      PRO 108  13.916  -5.620   4.424
  563    HG3  PRO 108           HG3      PRO 108  14.022  -5.949   6.175
  564    HD2  PRO 108           HD2      PRO 108  12.732  -7.699   4.602
  565    HD3  PRO 108           HD3      PRO 108  11.950  -7.201   6.120
  566    HA   PRO 109           HA       PRO 109  10.194  -2.252   1.610
  567    HB2  PRO 109           HB2      PRO 109  10.916   0.332   2.314
  568    HB3  PRO 109           HB3      PRO 109   9.357  -0.427   2.663
  569    HG2  PRO 109           HG2      PRO 109  11.734  -0.137   4.497
  570    HG3  PRO 109           HG3      PRO 109  10.011   0.147   4.857
  571    HD2  PRO 109           HD2      PRO 109  11.290  -2.155   5.513
  572    HD3  PRO 109           HD3      PRO 109   9.585  -2.174   5.001
  573    HA   PRO 110           HA       PRO 110  14.123  -1.880  -0.357
  574    HB2  PRO 110           HB2      PRO 110  13.656  -0.211  -2.478
  575    HB3  PRO 110           HB3      PRO 110  12.969  -1.851  -2.346
  576    HG2  PRO 110           HG2      PRO 110  11.617   0.785  -1.729
  577    HG3  PRO 110           HG3      PRO 110  10.967  -0.629  -2.605
  578    HD2  PRO 110           HD2      PRO 110  10.467  -0.123   0.058
  579    HD3  PRO 110           HD3      PRO 110  10.513  -1.770  -0.630
  580    H    ILE 111           H        ILE 111  12.933   1.542  -0.704
  581    HA   ILE 111           HA       ILE 111  15.146   2.492   1.028
  582    HB   ILE 111           HB       ILE 111  15.721   4.187  -0.641
  583   HG12  ILE 111          HG12      ILE 111  13.861   2.689  -2.577
  584   HG13  ILE 111          HG13      ILE 111  13.539   4.261  -1.831
  585   HG21  ILE 111          HG21      ILE 111  15.917   1.410  -1.873
  586   HG22  ILE 111          HG22      ILE 111  17.020   2.770  -2.082
  587   HG23  ILE 111          HG23      ILE 111  16.919   1.982  -0.507
  588   HD11  ILE 111          HD11      ILE 111  15.827   3.684  -3.739
  589   HD12  ILE 111          HD12      ILE 111  14.326   4.538  -4.096
  590   HD13  ILE 111          HD13      ILE 111  15.478   5.244  -2.942
  591    H    LEU 112           H        LEU 112  12.265   2.202   1.464
  592    HA   LEU 112           HA       LEU 112  10.830   4.619   1.231
  593    HB2  LEU 112           HB2      LEU 112  10.050   2.266   1.869
  594    HB3  LEU 112           HB3      LEU 112  10.548   2.645   3.514
  595    HG   LEU 112           HG       LEU 112   8.205   2.851   3.332
  596   HD11  LEU 112          HD11      LEU 112   9.046   5.752   3.209
  597   HD12  LEU 112          HD12      LEU 112   9.307   4.708   4.629
  598   HD13  LEU 112          HD13      LEU 112   7.668   5.044   4.039
  599   HD21  LEU 112          HD21      LEU 112   7.015   4.292   1.753
  600   HD22  LEU 112          HD22      LEU 112   7.940   3.024   0.925
  601   HD23  LEU 112          HD23      LEU 112   8.552   4.699   0.942
  602    H    LYS 113           H        LYS 113  13.113   3.578   3.861
  603    HA   LYS 113           HA       LYS 113  13.043   6.415   4.826
  604    HB2  LYS 113           HB2      LYS 113  11.898   4.798   6.338
  605    HB3  LYS 113           HB3      LYS 113  13.397   3.884   6.463
  606    HG2  LYS 113           HG2      LYS 113  14.311   6.404   7.161
  607    HG3  LYS 113           HG3      LYS 113  12.622   6.529   7.619
  608    HD2  LYS 113           HD2      LYS 113  13.414   5.734   9.556
  609    HD3  LYS 113           HD3      LYS 113  13.129   4.171   8.828
  610    HE2  LYS 113           HE2      LYS 113  15.783   5.693   8.896
  611    HE3  LYS 113           HE3      LYS 113  15.330   4.405  10.005
  612    HZ1  LYS 113           HZ1      LYS 113  16.741   3.561   8.276
  613    HZ2  LYS 113           HZ2      LYS 113  15.777   4.127   7.098
  614    HZ3  LYS 113           HZ3      LYS 113  15.270   2.892   8.057
  615    H    VAL 114           H        VAL 114  14.873   7.026   3.524
  616    HA   VAL 114           HA       VAL 114  17.382   5.528   3.841
  617    HB   VAL 114           HB       VAL 114  16.697   8.149   2.488
  618   HG11  VAL 114          HG11      VAL 114  19.029   8.311   3.247
  619   HG12  VAL 114          HG12      VAL 114  19.390   6.726   2.532
  620   HG13  VAL 114          HG13      VAL 114  18.961   8.108   1.500
  621   HG21  VAL 114          HG21      VAL 114  17.524   5.447   1.352
  622   HG22  VAL 114          HG22      VAL 114  15.872   6.086   1.367
  623   HG23  VAL 114          HG23      VAL 114  17.118   6.898   0.417
  624    H    TRP 115           H        TRP 115  16.611   8.948   4.548
  625    HA   TRP 115           HA       TRP 115  17.276  10.365   6.075
  626    HB2  TRP 115           HB2      TRP 115  15.467   8.697   7.154
  627    HB3  TRP 115           HB3      TRP 115  16.755   8.425   8.304
  628    HD1  TRP 115           HD1      TRP 115  17.357  11.860   7.683
  629    HE1  TRP 115           HE1      TRP 115  15.971  13.479   9.033
  630    HE3  TRP 115           HE3      TRP 115  13.798   8.600   9.406
  631    HZ2  TRP 115           HZ2      TRP 115  13.690  13.364  10.853
  632    HZ3  TRP 115           HZ3      TRP 115  12.067   9.374  11.001
  633    HH2  TRP 115           HH2      TRP 115  12.007  11.751  11.737
  Start of MODEL    3
    1    H1   MET   1           H        MET   1 -13.648   2.140  12.132
    2    HA   MET   1           HA       MET   1 -15.871   0.454  11.137
    3    HB2  MET   1           HB2      MET   1 -16.024   2.760  13.113
    4    HB3  MET   1           HB3      MET   1 -17.377   1.901  12.419
    5    HG2  MET   1           HG2      MET   1 -17.060   1.050  14.584
    6    HG3  MET   1           HG3      MET   1 -16.552  -0.209  13.464
    7    HE1  MET   1           HE1      MET   1 -14.460  -0.598  16.799
    8    HE2  MET   1           HE2      MET   1 -15.996   0.299  16.763
    9    HE3  MET   1           HE3      MET   1 -15.827  -1.208  15.841
   10    H    LYS   2           H        LYS   2 -16.291   1.011   9.087
   11    HA   LYS   2           HA       LYS   2 -16.132   2.185   7.099
   12    HB2  LYS   2           HB2      LYS   2 -18.430   2.021   7.833
   13    HB3  LYS   2           HB3      LYS   2 -18.300   3.528   8.725
   14    HG2  LYS   2           HG2      LYS   2 -18.137   4.831   6.686
   15    HG3  LYS   2           HG3      LYS   2 -18.002   3.373   5.705
   16    HD2  LYS   2           HD2      LYS   2 -20.403   3.458   7.466
   17    HD3  LYS   2           HD3      LYS   2 -20.351   4.769   6.301
   18    HE2  LYS   2           HE2      LYS   2 -19.776   1.936   5.386
   19    HE3  LYS   2           HE3      LYS   2 -21.447   2.441   5.686
   20    HZ1  LYS   2           HZ1      LYS   2 -21.350   4.040   4.076
   21    HZ2  LYS   2           HZ2      LYS   2 -20.606   2.742   3.372
   22    HZ3  LYS   2           HZ3      LYS   2 -19.699   4.004   3.908
   23    H    VAL   3           H        VAL   3 -13.905   3.065   7.489
   24    HA   VAL   3           HA       VAL   3 -13.867   5.963   8.099
   25    HB   VAL   3           HB       VAL   3 -11.414   5.659   8.127
   26   HG11  VAL   3          HG11      VAL   3 -12.866   3.628   9.878
   27   HG12  VAL   3          HG12      VAL   3 -11.294   4.373  10.194
   28   HG13  VAL   3          HG13      VAL   3 -12.757   5.371  10.194
   29   HG21  VAL   3          HG21      VAL   3 -11.194   3.764   6.521
   30   HG22  VAL   3          HG22      VAL   3 -10.377   3.471   8.053
   31   HG23  VAL   3          HG23      VAL   3 -11.922   2.679   7.727
   32    HA   PRO   4           HA       PRO   4 -13.592   6.958   3.772
   33    HB2  PRO   4           HB2      PRO   4 -12.073   9.221   3.688
   34    HB3  PRO   4           HB3      PRO   4 -13.723   9.188   4.381
   35    HG2  PRO   4           HG2      PRO   4 -11.076   9.015   5.849
   36    HG3  PRO   4           HG3      PRO   4 -12.491  10.043   6.235
   37    HD2  PRO   4           HD2      PRO   4 -12.035   7.664   7.486
   38    HD3  PRO   4           HD3      PRO   4 -13.692   8.217   7.115
   39    H    GLY   5           H        GLY   5 -12.033   7.000   1.870
   40    HA2  GLY   5           HA2      GLY   5  -9.870   5.175   2.345
   41    HA3  GLY   5           HA3      GLY   5 -10.333   5.937   0.808
   42    H    VAL   6           H        VAL   6  -7.607   5.704   1.753
   43    HA   VAL   6           HA       VAL   6  -6.930   8.590   2.206
   44    HB   VAL   6           HB       VAL   6  -5.053   6.349   2.918
   45   HG11  VAL   6          HG11      VAL   6  -4.086   8.571   2.737
   46   HG12  VAL   6          HG12      VAL   6  -5.390   9.272   3.716
   47   HG13  VAL   6          HG13      VAL   6  -4.237   8.174   4.464
   48   HG21  VAL   6          HG21      VAL   6  -5.740   6.525   5.256
   49   HG22  VAL   6          HG22      VAL   6  -7.068   7.600   4.818
   50   HG23  VAL   6          HG23      VAL   6  -7.086   5.912   4.282
   51    H    ARG   7           H        ARG   7  -5.897   9.527   0.595
   52    HA   ARG   7           HA       ARG   7  -5.370   8.081  -1.855
   53    HB2  ARG   7           HB2      ARG   7  -4.499  10.281  -2.641
   54    HB3  ARG   7           HB3      ARG   7  -6.167  10.290  -2.141
   55    HG2  ARG   7           HG2      ARG   7  -4.184  11.142  -0.046
   56    HG3  ARG   7           HG3      ARG   7  -4.304  12.173  -1.464
   57    HD2  ARG   7           HD2      ARG   7  -6.752  11.318   0.110
   58    HD3  ARG   7           HD3      ARG   7  -5.798  12.734   0.543
   59    HE   ARG   7           HE       ARG   7  -7.452  12.335  -1.880
   60   HH11  ARG   7          HH11      ARG   7  -5.566  14.592   0.071
   61   HH12  ARG   7          HH12      ARG   7  -5.798  15.949  -1.000
   62   HH21  ARG   7          HH21      ARG   7  -7.943  14.113  -3.169
   63   HH22  ARG   7          HH22      ARG   7  -7.404  15.707  -2.760
   64    H    VAL   8           H        VAL   8  -3.570   6.953  -2.268
   65    HA   VAL   8           HA       VAL   8  -1.007   7.827  -1.071
   66    HB   VAL   8           HB       VAL   8  -0.347   5.644  -0.389
   67   HG11  VAL   8          HG11      VAL   8  -1.712   5.259   1.554
   68   HG12  VAL   8          HG12      VAL   8  -1.626   6.999   1.252
   69   HG13  VAL   8          HG13      VAL   8  -3.097   6.107   0.828
   70   HG21  VAL   8          HG21      VAL   8  -1.964   3.733  -0.298
   71   HG22  VAL   8          HG22      VAL   8  -3.070   4.671  -1.328
   72   HG23  VAL   8          HG23      VAL   8  -1.443   4.210  -1.916
   73    H    ARG   9           H        ARG   9   0.884   6.920  -2.280
   74    HA   ARG   9           HA       ARG   9   0.260   6.140  -5.081
   75    HB2  ARG   9           HB2      ARG   9   0.631   8.674  -4.685
   76    HB3  ARG   9           HB3      ARG   9   2.298   8.263  -4.275
   77    HG2  ARG   9           HG2      ARG   9   2.598   7.291  -6.555
   78    HG3  ARG   9           HG3      ARG   9   0.891   7.638  -6.908
   79    HD2  ARG   9           HD2      ARG   9   1.451  10.101  -6.293
   80    HD3  ARG   9           HD3      ARG   9   3.145   9.620  -6.399
   81    HE   ARG   9           HE       ARG   9   3.005   9.563  -8.667
   82   HH11  ARG   9          HH11      ARG   9  -0.221  10.268  -7.382
   83   HH12  ARG   9          HH12      ARG   9  -1.015  10.151  -8.929
   84   HH21  ARG   9          HH21      ARG   9   1.909   9.568 -10.749
   85   HH22  ARG   9          HH22      ARG   9   0.163   9.742 -10.804
   86    H    ALA  10           H        ALA  10   1.659   4.476  -5.721
   87    HA   ALA  10           HA       ALA  10   3.396   3.416  -3.666
   88    HB1  ALA  10           HB1      ALA  10   3.672   1.514  -4.874
   89    HB2  ALA  10           HB2      ALA  10   1.992   1.971  -5.228
   90    HB3  ALA  10           HB3      ALA  10   3.295   2.238  -6.422
   91    H    LEU  11           H        LEU  11   5.591   3.294  -3.622
   92    HA   LEU  11           HA       LEU  11   7.018   5.261  -5.333
   93    HB2  LEU  11           HB2      LEU  11   7.348   4.207  -2.543
   94    HB3  LEU  11           HB3      LEU  11   8.812   4.592  -3.430
   95    HG   LEU  11           HG       LEU  11   7.938   6.427  -2.007
   96   HD11  LEU  11          HD11      LEU  11   8.401   8.202  -3.644
   97   HD12  LEU  11          HD12      LEU  11   8.204   7.052  -4.980
   98   HD13  LEU  11          HD13      LEU  11   9.528   6.844  -3.825
   99   HD21  LEU  11          HD21      LEU  11   5.767   6.789  -4.106
  100   HD22  LEU  11          HD22      LEU  11   6.123   7.838  -2.735
  101   HD23  LEU  11          HD23      LEU  11   5.519   6.194  -2.453
  102    H    TYR  12           H        TYR  12   6.505   1.873  -5.253
  103    HA   TYR  12           HA       TYR  12   8.815   1.525  -7.063
  104    HB2  TYR  12           HB2      TYR  12   8.247  -0.514  -4.883
  105    HB3  TYR  12           HB3      TYR  12   9.609  -0.427  -5.978
  106    HD1  TYR  12           HD1      TYR  12   8.150   0.969  -2.835
  107    HD2  TYR  12           HD2      TYR  12  11.452   1.255  -5.625
  108    HE1  TYR  12           HE1      TYR  12   9.231   2.601  -1.383
  109    HE2  TYR  12           HE2      TYR  12  12.565   2.847  -4.130
  110    HH   TYR  12           HH       TYR  12  10.935   4.328  -1.355
  111    H    ASP  13           H        ASP  13   8.567  -0.691  -8.217
  112    HA   ASP  13           HA       ASP  13   5.793  -1.040  -9.137
  113    HB2  ASP  13           HB2      ASP  13   6.901  -2.049 -11.103
  114    HB3  ASP  13           HB3      ASP  13   7.401  -0.390 -10.824
  115    H    TYR  14           H        TYR  14   5.036  -2.445  -7.384
  116    HA   TYR  14           HA       TYR  14   6.132  -5.214  -7.524
  117    HB2  TYR  14           HB2      TYR  14   5.893  -3.359  -5.205
  118    HB3  TYR  14           HB3      TYR  14   5.268  -4.946  -4.939
  119    HD1  TYR  14           HD1      TYR  14   6.744  -6.685  -4.190
  120    HD2  TYR  14           HD2      TYR  14   8.296  -3.332  -6.442
  121    HE1  TYR  14           HE1      TYR  14   9.028  -7.618  -4.024
  122    HE2  TYR  14           HE2      TYR  14  10.535  -4.315  -6.387
  123    HH   TYR  14           HH       TYR  14  11.405  -7.249  -4.551
  124    H    THR  15           H        THR  15   4.606  -6.900  -7.305
  125    HA   THR  15           HA       THR  15   1.757  -6.086  -7.411
  126    HB   THR  15           HB       THR  15   2.567  -6.523  -9.615
  127    HG1  THR  15           HG1      THR  15   0.625  -7.285  -9.492
  128   HG21  THR  15          HG21      THR  15   3.419  -8.687 -10.363
  129   HG22  THR  15          HG22      THR  15   3.552  -9.248  -8.692
  130   HG23  THR  15          HG23      THR  15   4.551  -7.893  -9.253
  131    H    GLY  16           H        GLY  16   1.730  -6.424  -5.149
  132    HA2  GLY  16           HA2      GLY  16   1.257  -7.586  -3.271
  133    HA3  GLY  16           HA3      GLY  16   0.562  -8.827  -4.356
  134    H    GLN  17           H        GLN  17   1.251 -10.362  -2.687
  135    HA   GLN  17           HA       GLN  17   4.102 -11.085  -2.957
  136    HB2  GLN  17           HB2      GLN  17   2.762 -10.175  -0.582
  137    HB3  GLN  17           HB3      GLN  17   2.939 -11.901  -0.373
  138    HG2  GLN  17           HG2      GLN  17   5.292 -10.148  -1.188
  139    HG3  GLN  17           HG3      GLN  17   4.757 -10.314   0.490
  140   HE21  GLN  17          HE21      GLN  17   5.878 -12.390  -2.302
  141   HE22  GLN  17          HE22      GLN  17   6.489 -13.613  -1.218
  142    H    GLU  18           H        GLU  18   0.714 -11.990  -3.008
  143    HA   GLU  18           HA       GLU  18   1.304 -14.495  -4.128
  144    HB2  GLU  18           HB2      GLU  18   1.347 -14.613  -1.387
  145    HB3  GLU  18           HB3      GLU  18  -0.394 -14.685  -1.628
  146    HG2  GLU  18           HG2      GLU  18   0.600 -16.922  -1.462
  147    HG3  GLU  18           HG3      GLU  18  -0.104 -16.677  -3.057
  148    H    ALA  19           H        ALA  19  -1.008 -15.611  -4.340
  149    HA   ALA  19           HA       ALA  19  -2.550 -14.054  -6.014
  150    HB1  ALA  19           HB1      ALA  19  -4.014 -16.007  -6.104
  151    HB2  ALA  19           HB2      ALA  19  -2.341 -16.521  -6.035
  152    HB3  ALA  19           HB3      ALA  19  -3.352 -16.605  -4.579
  153    H    ASP  20           H        ASP  20  -2.800 -13.422  -2.649
  154    HA   ASP  20           HA       ASP  20  -5.684 -12.698  -3.026
  155    HB2  ASP  20           HB2      ASP  20  -5.198 -14.494  -1.312
  156    HB3  ASP  20           HB3      ASP  20  -4.388 -13.246  -0.352
  157    H    GLU  21           H        GLU  21  -2.742 -11.403  -3.216
  158    HA   GLU  21           HA       GLU  21  -3.464  -8.868  -1.863
  159    HB2  GLU  21           HB2      GLU  21  -0.851  -9.988  -2.980
  160    HB3  GLU  21           HB3      GLU  21  -1.050  -8.384  -2.279
  161    HG2  GLU  21           HG2      GLU  21  -0.411  -9.442  -0.387
  162    HG3  GLU  21           HG3      GLU  21  -2.125  -9.755  -0.251
  163    H    LEU  22           H        LEU  22  -2.870  -6.927  -3.000
  164    HA   LEU  22           HA       LEU  22  -4.192  -6.697  -5.618
  165    HB2  LEU  22           HB2      LEU  22  -3.161  -4.822  -3.432
  166    HB3  LEU  22           HB3      LEU  22  -3.578  -4.163  -4.996
  167    HG   LEU  22           HG       LEU  22  -5.520  -5.721  -3.280
  168   HD11  LEU  22          HD11      LEU  22  -4.891  -3.650  -2.202
  169   HD12  LEU  22          HD12      LEU  22  -6.532  -3.501  -2.877
  170   HD13  LEU  22          HD13      LEU  22  -5.139  -2.782  -3.717
  171   HD21  LEU  22          HD21      LEU  22  -7.134  -4.526  -4.938
  172   HD22  LEU  22          HD22      LEU  22  -6.282  -5.980  -5.446
  173   HD23  LEU  22          HD23      LEU  22  -5.684  -4.398  -5.972
  174    H    SER  23           H        SER  23  -3.140  -4.959  -7.130
  175    HA   SER  23           HA       SER  23  -0.172  -5.251  -7.151
  176    HB2  SER  23           HB2      SER  23  -1.282  -6.965  -8.598
  177    HB3  SER  23           HB3      SER  23  -2.130  -5.673  -9.465
  178    HG   SER  23           HG       SER  23  -0.205  -4.944 -10.282
  179    H    PHE  24           H        PHE  24   0.825  -3.254  -7.475
  180    HA   PHE  24           HA       PHE  24  -0.814  -1.132  -8.792
  181    HB2  PHE  24           HB2      PHE  24   0.386   0.509  -7.350
  182    HB3  PHE  24           HB3      PHE  24  -0.826  -0.438  -6.551
  183    HD1  PHE  24           HD1      PHE  24   2.783  -0.271  -7.150
  184    HD2  PHE  24           HD2      PHE  24  -0.385  -1.547  -4.502
  185    HE1  PHE  24           HE1      PHE  24   4.493  -0.963  -5.419
  186    HE2  PHE  24           HE2      PHE  24   1.299  -1.928  -2.720
  187    HZ   PHE  24           HZ       PHE  24   3.708  -1.767  -3.196
  188    H    LYS  25           H        LYS  25   0.565   0.442  -9.935
  189    HA   LYS  25           HA       LYS  25   3.196  -0.702 -10.812
  190    HB2  LYS  25           HB2      LYS  25   0.938   0.591 -12.303
  191    HB3  LYS  25           HB3      LYS  25   2.521   1.145 -12.757
  192    HG2  LYS  25           HG2      LYS  25   1.664  -1.768 -12.832
  193    HG3  LYS  25           HG3      LYS  25   1.745  -0.654 -14.197
  194    HD2  LYS  25           HD2      LYS  25   4.257  -0.329 -13.584
  195    HD3  LYS  25           HD3      LYS  25   4.054  -1.738 -12.542
  196    HE2  LYS  25           HE2      LYS  25   4.883  -2.650 -14.516
  197    HE3  LYS  25           HE3      LYS  25   3.150  -2.968 -14.618
  198    HZ1  LYS  25           HZ1      LYS  25   4.583  -0.745 -15.960
  199    HZ2  LYS  25           HZ2      LYS  25   2.960  -1.041 -16.078
  200    HZ3  LYS  25           HZ3      LYS  25   4.021  -2.127 -16.674
  201    H    ALA  26           H        ALA  26   4.790   1.027 -11.518
  202    HA   ALA  26           HA       ALA  26   5.058   2.851  -9.364
  203    HB1  ALA  26           HB1      ALA  26   6.473   2.749 -12.079
  204    HB2  ALA  26           HB2      ALA  26   6.973   3.774 -10.722
  205    HB3  ALA  26           HB3      ALA  26   7.041   2.012 -10.560
  206    H    GLY  27           H        GLY  27   3.841   4.689  -9.067
  207    HA2  GLY  27           HA2      GLY  27   3.223   6.879  -9.718
  208    HA3  GLY  27           HA3      GLY  27   3.144   6.381 -11.412
  209    H    GLU  28           H        GLU  28   1.707   3.837  -9.911
  210    HA   GLU  28           HA       GLU  28  -0.962   4.651 -10.645
  211    HB2  GLU  28           HB2      GLU  28   0.129   2.229 -10.568
  212    HB3  GLU  28           HB3      GLU  28  -0.271   2.255  -8.865
  213    HG2  GLU  28           HG2      GLU  28  -2.700   2.997  -9.822
  214    HG3  GLU  28           HG3      GLU  28  -2.082   2.344 -11.321
  215    H    GLU  29           H        GLU  29  -2.756   4.703  -9.095
  216    HA   GLU  29           HA       GLU  29  -2.061   5.504  -6.325
  217    HB2  GLU  29           HB2      GLU  29  -4.057   6.716  -8.276
  218    HB3  GLU  29           HB3      GLU  29  -4.141   6.952  -6.525
  219    HG2  GLU  29           HG2      GLU  29  -1.785   7.844  -6.570
  220    HG3  GLU  29           HG3      GLU  29  -1.847   7.770  -8.344
  221    H    LEU  30           H        LEU  30  -3.622   4.938  -4.806
  222    HA   LEU  30           HA       LEU  30  -5.780   3.071  -5.464
  223    HB2  LEU  30           HB2      LEU  30  -4.792   1.676  -3.446
  224    HB3  LEU  30           HB3      LEU  30  -4.134   1.379  -5.089
  225    HG   LEU  30           HG       LEU  30  -2.717   3.440  -3.475
  226   HD11  LEU  30          HD11      LEU  30  -2.606   0.538  -2.577
  227   HD12  LEU  30          HD12      LEU  30  -3.227   1.907  -1.657
  228   HD13  LEU  30          HD13      LEU  30  -1.506   1.820  -2.075
  229   HD21  LEU  30          HD21      LEU  30  -0.719   2.333  -4.360
  230   HD22  LEU  30          HD22      LEU  30  -1.873   2.624  -5.670
  231   HD23  LEU  30          HD23      LEU  30  -1.716   1.007  -5.002
  232    H    MET  31           H        MET  31  -6.963   2.616  -3.269
  233    HA   MET  31           HA       MET  31  -6.726   5.001  -1.502
  234    HB2  MET  31           HB2      MET  31  -9.451   3.750  -1.850
  235    HB3  MET  31           HB3      MET  31  -8.920   5.275  -1.201
  236    HG2  MET  31           HG2      MET  31  -8.033   5.776  -3.573
  237    HG3  MET  31           HG3      MET  31  -9.056   4.453  -4.112
  238    HE1  MET  31           HE1      MET  31 -10.481   8.458  -2.249
  239    HE2  MET  31           HE2      MET  31  -9.867   7.177  -1.219
  240    HE3  MET  31           HE3      MET  31  -8.792   7.940  -2.414
  241    H    LYS  32           H        LYS  32  -5.901   4.329   0.340
  242    HA   LYS  32           HA       LYS  32  -5.914   1.562   1.199
  243    HB2  LYS  32           HB2      LYS  32  -4.258   3.180   1.897
  244    HB3  LYS  32           HB3      LYS  32  -5.502   4.211   2.618
  245    HG2  LYS  32           HG2      LYS  32  -5.937   1.778   3.965
  246    HG3  LYS  32           HG3      LYS  32  -4.190   1.834   3.775
  247    HD2  LYS  32           HD2      LYS  32  -4.242   3.037   5.677
  248    HD3  LYS  32           HD3      LYS  32  -4.642   4.404   4.677
  249    HE2  LYS  32           HE2      LYS  32  -7.065   4.029   5.160
  250    HE3  LYS  32           HE3      LYS  32  -6.657   2.525   5.991
  251    HZ1  LYS  32           HZ1      LYS  32  -5.290   3.953   7.529
  252    HZ2  LYS  32           HZ2      LYS  32  -6.915   4.050   7.682
  253    HZ3  LYS  32           HZ3      LYS  32  -6.054   5.259   6.945
  254    H    ILE  33           H        ILE  33  -7.540   0.465   2.456
  255    HA   ILE  33           HA       ILE  33  -9.772   2.198   3.322
  256    HB   ILE  33           HB       ILE  33 -11.282   0.563   2.938
  257   HG12  ILE  33          HG12      ILE  33  -9.458  -1.339   1.488
  258   HG13  ILE  33          HG13      ILE  33  -9.657  -1.466   3.228
  259   HG21  ILE  33          HG21      ILE  33  -9.701   0.872   0.364
  260   HG22  ILE  33          HG22      ILE  33 -11.442   0.654   0.520
  261   HG23  ILE  33          HG23      ILE  33 -10.680   2.142   1.087
  262   HD11  ILE  33          HD11      ILE  33 -12.080  -1.749   2.955
  263   HD12  ILE  33          HD12      ILE  33 -11.914  -1.586   1.192
  264   HD13  ILE  33          HD13      ILE  33 -11.173  -2.961   2.029
  265    H    SER  34           H        SER  34  -7.430  -0.073   4.592
  266    HA   SER  34           HA       SER  34  -8.939   0.023   7.166
  267    HB2  SER  34           HB2      SER  34  -7.413  -2.341   6.051
  268    HB3  SER  34           HB3      SER  34  -8.302  -2.272   7.581
  269    HG   SER  34           HG       SER  34  -9.287  -3.398   5.910
  270    H    GLU  35           H        GLU  35  -7.513  -0.690   8.981
  271    HA   GLU  35           HA       GLU  35  -5.174   0.956   9.164
  272    HB2  GLU  35           HB2      GLU  35  -5.082   0.044  11.445
  273    HB3  GLU  35           HB3      GLU  35  -6.593   0.823  11.007
  274    HG2  GLU  35           HG2      GLU  35  -6.466  -2.187  10.717
  275    HG3  GLU  35           HG3      GLU  35  -6.487  -1.515  12.342
  276    H    GLU  36           H        GLU  36  -3.030   0.346   9.477
  277    HA   GLU  36           HA       GLU  36  -2.047  -1.764   7.949
  278    HB2  GLU  36           HB2      GLU  36  -1.095   0.545   8.428
  279    HB3  GLU  36           HB3      GLU  36  -0.644  -0.048  10.025
  280    HG2  GLU  36           HG2      GLU  36   0.750  -1.828   8.854
  281    HG3  GLU  36           HG3      GLU  36   0.367  -1.044   7.321
  282    H    ASP  37           H        ASP  37  -1.074  -3.722   8.443
  283    HA   ASP  37           HA       ASP  37  -1.566  -4.883  11.126
  284    HB2  ASP  37           HB2      ASP  37  -0.226  -6.108   8.684
  285    HB3  ASP  37           HB3      ASP  37  -0.665  -6.969  10.139
  286    H    GLU  38           H        GLU  38   0.379  -6.294  11.976
  287    HA   GLU  38           HA       GLU  38   2.564  -4.666  12.622
  288    HB2  GLU  38           HB2      GLU  38   3.471  -6.656  13.697
  289    HB3  GLU  38           HB3      GLU  38   1.731  -6.498  13.984
  290    HG2  GLU  38           HG2      GLU  38   1.334  -8.184  12.163
  291    HG3  GLU  38           HG3      GLU  38   3.076  -8.404  12.012
  292    H    GLN  39           H        GLN  39   2.107  -6.351   9.724
  293    HA   GLN  39           HA       GLN  39   5.002  -6.546   9.011
  294    HB2  GLN  39           HB2      GLN  39   2.417  -7.836   8.118
  295    HB3  GLN  39           HB3      GLN  39   3.627  -7.610   6.899
  296    HG2  GLN  39           HG2      GLN  39   3.963  -9.394   9.330
  297    HG3  GLN  39           HG3      GLN  39   3.705  -9.825   7.685
  298   HE21  GLN  39          HE21      GLN  39   6.177  -8.349   9.875
  299   HE22  GLN  39          HE22      GLN  39   7.493  -8.520   8.762
  300    H    GLY  40           H        GLY  40   2.876  -4.066   9.047
  301    HA2  GLY  40           HA2      GLY  40   2.888  -2.086   7.860
  302    HA3  GLY  40           HA3      GLY  40   4.121  -2.752   6.796
  303    H    TRP  41           H        TRP  41   1.517  -4.891   7.000
  304    HA   TRP  41           HA       TRP  41   0.741  -4.535   4.242
  305    HB2  TRP  41           HB2      TRP  41  -0.061  -6.275   6.589
  306    HB3  TRP  41           HB3      TRP  41  -1.167  -6.158   5.246
  307    HD1  TRP  41           HD1      TRP  41   1.088  -8.543   6.343
  308    HE1  TRP  41           HE1      TRP  41   1.774 -10.024   4.397
  309    HE3  TRP  41           HE3      TRP  41  -0.262  -5.594   2.441
  310    HZ2  TRP  41           HZ2      TRP  41   2.472  -9.689   1.697
  311    HZ3  TRP  41           HZ3      TRP  41   0.264  -6.296   0.134
  312    HH2  TRP  41           HH2      TRP  41   1.661  -8.230  -0.312
  313    H    CYS  42           H        CYS  42  -1.246  -3.749   3.413
  314    HA   CYS  42           HA       CYS  42  -3.177  -2.618   5.338
  315    HB2  CYS  42           HB2      CYS  42  -1.632  -1.069   3.231
  316    HB3  CYS  42           HB3      CYS  42  -3.265  -0.584   3.713
  317    HG   CYS  42           HG       CYS  42  -0.769  -1.174   5.784
  318    H    LYS  43           H        LYS  43  -5.237  -2.683   4.526
  319    HA   LYS  43           HA       LYS  43  -5.542  -4.028   1.890
  320    HB2  LYS  43           HB2      LYS  43  -6.826  -4.323   4.443
  321    HB3  LYS  43           HB3      LYS  43  -8.041  -3.697   3.344
  322    HG2  LYS  43           HG2      LYS  43  -6.329  -5.953   2.266
  323    HG3  LYS  43           HG3      LYS  43  -7.348  -6.328   3.644
  324    HD2  LYS  43           HD2      LYS  43  -9.321  -5.418   2.401
  325    HD3  LYS  43           HD3      LYS  43  -8.288  -5.290   0.955
  326    HE2  LYS  43           HE2      LYS  43  -7.718  -7.714   1.148
  327    HE3  LYS  43           HE3      LYS  43  -8.553  -7.787   2.687
  328    HZ1  LYS  43           HZ1      LYS  43 -10.637  -7.099   1.353
  329    HZ2  LYS  43           HZ2      LYS  43 -10.106  -8.647   1.276
  330    HZ3  LYS  43           HZ3      LYS  43  -9.803  -7.694   0.039
  331    H    GLY  44           H        GLY  44  -6.608  -2.995   0.217
  332    HA2  GLY  44           HA2      GLY  44  -7.817  -0.356   0.684
  333    HA3  GLY  44           HA3      GLY  44  -6.372  -0.353  -0.275
  334    H    ARG  45           H        ARG  45  -8.214   0.557  -1.688
  335    HA   ARG  45           HA       ARG  45  -9.277  -1.612  -3.379
  336    HB2  ARG  45           HB2      ARG  45 -11.195  -0.821  -2.084
  337    HB3  ARG  45           HB3      ARG  45 -10.780   0.863  -2.378
  338    HG2  ARG  45           HG2      ARG  45 -11.457   0.821  -4.605
  339    HG3  ARG  45           HG3      ARG  45 -11.338  -0.931  -4.754
  340    HD2  ARG  45           HD2      ARG  45 -13.308   0.119  -2.772
  341    HD3  ARG  45           HD3      ARG  45 -13.682   0.400  -4.482
  342    HE   ARG  45           HE       ARG  45 -13.047  -2.195  -4.567
  343   HH11  ARG  45          HH11      ARG  45 -15.272  -0.545  -2.362
  344   HH12  ARG  45          HH12      ARG  45 -16.463  -1.799  -2.394
  345   HH21  ARG  45          HH21      ARG  45 -14.406  -3.976  -4.401
  346   HH22  ARG  45          HH22      ARG  45 -15.834  -3.914  -3.482
  347    H    LEU  46           H        LEU  46  -8.931  -1.308  -5.436
  348    HA   LEU  46           HA       LEU  46  -7.187   0.872  -6.352
  349    HB2  LEU  46           HB2      LEU  46  -8.274  -1.754  -7.442
  350    HB3  LEU  46           HB3      LEU  46  -7.719  -0.535  -8.599
  351    HG   LEU  46           HG       LEU  46  -5.562  -0.470  -7.667
  352   HD11  LEU  46          HD11      LEU  46  -6.732  -2.274  -5.528
  353   HD12  LEU  46          HD12      LEU  46  -5.789  -0.772  -5.332
  354   HD13  LEU  46          HD13      LEU  46  -4.999  -2.254  -5.862
  355   HD21  LEU  46          HD21      LEU  46  -6.488  -3.356  -8.041
  356   HD22  LEU  46          HD22      LEU  46  -4.831  -2.770  -8.211
  357   HD23  LEU  46          HD23      LEU  46  -6.067  -2.225  -9.342
  358    H    LEU  47           H        LEU  47  -7.734   2.029  -8.385
  359    HA   LEU  47           HA       LEU  47 -10.226   3.398  -8.168
  360    HB2  LEU  47           HB2      LEU  47  -8.171   3.190 -10.408
  361    HB3  LEU  47           HB3      LEU  47  -9.656   4.089 -10.623
  362    HG   LEU  47           HG       LEU  47  -7.773   5.530 -10.035
  363   HD11  LEU  47          HD11      LEU  47 -10.101   6.193  -9.457
  364   HD12  LEU  47          HD12      LEU  47  -8.899   6.897  -8.375
  365   HD13  LEU  47          HD13      LEU  47  -9.875   5.528  -7.825
  366   HD21  LEU  47          HD21      LEU  47  -6.555   3.966  -8.550
  367   HD22  LEU  47          HD22      LEU  47  -7.738   4.306  -7.263
  368   HD23  LEU  47          HD23      LEU  47  -6.715   5.600  -7.907
  369    H    THR  48           H        THR  48  -9.301   0.528  -9.932
  370    HA   THR  48           HA       THR  48 -11.676   0.241 -11.518
  371    HB   THR  48           HB       THR  48  -9.183  -0.527 -11.786
  372    HG1  THR  48           HG1      THR  48  -9.824  -2.239 -13.099
  373   HG21  THR  48          HG21      THR  48  -8.515  -2.628 -11.007
  374   HG22  THR  48          HG22      THR  48 -10.164  -3.118 -10.590
  375   HG23  THR  48          HG23      THR  48  -9.300  -1.914  -9.611
  376    H    GLY  49           H        GLY  49 -11.478   0.059  -8.209
  377    HA2  GLY  49           HA2      GLY  49 -13.004  -0.709  -6.718
  378    HA3  GLY  49           HA3      GLY  49 -13.823  -1.617  -7.990
  379    H    HIS  50           H        HIS  50 -10.633  -2.693  -8.268
  380    HA   HIS  50           HA       HIS  50 -11.261  -5.209  -7.034
  381    HB2  HIS  50           HB2      HIS  50  -9.788  -4.891  -9.010
  382    HB3  HIS  50           HB3      HIS  50  -8.606  -4.082  -7.988
  383    HD1  HIS  50           HD1      HIS  50 -10.369  -7.593  -7.532
  384    HD2  HIS  50           HD2      HIS  50  -6.621  -5.736  -8.047
  385    HE1  HIS  50           HE1      HIS  50  -8.626  -9.403  -7.295
  386    H    VAL  51           H        VAL  51 -10.275  -6.120  -5.038
  387    HA   VAL  51           HA       VAL  51  -9.106  -4.156  -3.166
  388    HB   VAL  51           HB       VAL  51 -10.538  -5.213  -1.369
  389   HG11  VAL  51          HG11      VAL  51 -11.986  -3.652  -3.519
  390   HG12  VAL  51          HG12      VAL  51 -12.488  -3.797  -1.814
  391   HG13  VAL  51          HG13      VAL  51 -10.965  -2.989  -2.223
  392   HG21  VAL  51          HG21      VAL  51 -11.349  -7.225  -2.617
  393   HG22  VAL  51          HG22      VAL  51 -12.664  -6.260  -1.941
  394   HG23  VAL  51          HG23      VAL  51 -12.298  -6.172  -3.675
  395    H    GLY  52           H        GLY  52  -7.794  -5.062  -1.520
  396    HA2  GLY  52           HA2      GLY  52  -7.383  -7.662  -0.839
  397    HA3  GLY  52           HA3      GLY  52  -6.388  -7.467  -2.284
  398    H    LEU  53           H        LEU  53  -4.763  -7.944  -0.458
  399    HA   LEU  53           HA       LEU  53  -4.021  -5.781   1.376
  400    HB2  LEU  53           HB2      LEU  53  -3.575  -8.625   1.060
  401    HB3  LEU  53           HB3      LEU  53  -2.013  -7.858   0.927
  402    HG   LEU  53           HG       LEU  53  -2.290  -6.798   3.121
  403   HD11  LEU  53          HD11      LEU  53  -4.573  -6.580   3.526
  404   HD12  LEU  53          HD12      LEU  53  -4.144  -7.961   4.541
  405   HD13  LEU  53          HD13      LEU  53  -4.928  -8.229   2.958
  406   HD21  LEU  53          HD21      LEU  53  -1.212  -9.073   2.707
  407   HD22  LEU  53          HD22      LEU  53  -2.760  -9.820   3.111
  408   HD23  LEU  53          HD23      LEU  53  -1.870  -8.876   4.329
  409    H    TYR  54           H        TYR  54  -2.151  -4.403   1.056
  410    HA   TYR  54           HA       TYR  54  -0.507  -4.731  -1.318
  411    HB2  TYR  54           HB2      TYR  54  -0.651  -2.561  -2.103
  412    HB3  TYR  54           HB3      TYR  54  -2.297  -3.041  -2.028
  413    HD1  TYR  54           HD1      TYR  54  -3.759  -2.001  -0.142
  414    HD2  TYR  54           HD2      TYR  54   0.343  -0.833  -0.803
  415    HE1  TYR  54           HE1      TYR  54  -4.089  -0.002   1.300
  416    HE2  TYR  54           HE2      TYR  54   0.016   1.129   0.595
  417    HH   TYR  54           HH       TYR  54  -1.341   2.242   2.004
  418    HA   PRO  55           HA       PRO  55   2.158  -3.872   2.116
  419    HB2  PRO  55           HB2      PRO  55   4.580  -3.543   0.944
  420    HB3  PRO  55           HB3      PRO  55   3.722  -5.111   0.986
  421    HG2  PRO  55           HG2      PRO  55   3.835  -3.131  -1.299
  422    HG3  PRO  55           HG3      PRO  55   3.990  -4.907  -1.330
  423    HD2  PRO  55           HD2      PRO  55   1.635  -3.767  -1.979
  424    HD3  PRO  55           HD3      PRO  55   1.812  -5.322  -1.152
  425    H    ALA  56           H        ALA  56   1.650  -1.984   3.138
  426    HA   ALA  56           HA       ALA  56   1.541   0.521   1.815
  427    HB1  ALA  56           HB1      ALA  56   0.348  -0.271   3.922
  428    HB2  ALA  56           HB2      ALA  56   1.807   0.155   4.815
  429    HB3  ALA  56           HB3      ALA  56   0.913   1.393   3.908
  430    H    ASN  57           H        ASN  57   4.179  -1.144   3.293
  431    HA   ASN  57           HA       ASN  57   5.874   1.068   3.812
  432    HB2  ASN  57           HB2      ASN  57   6.988  -1.589   2.863
  433    HB3  ASN  57           HB3      ASN  57   7.652  -0.474   4.043
  434   HD21  ASN  57          HD21      ASN  57   6.518  -3.473   3.935
  435   HD22  ASN  57          HD22      ASN  57   5.624  -3.563   5.437
  436    H    TYR  58           H        TYR  58   4.993  -0.464   0.782
  437    HA   TYR  58           HA       TYR  58   7.242   0.710  -0.705
  438    HB2  TYR  58           HB2      TYR  58   5.032  -1.228  -1.409
  439    HB3  TYR  58           HB3      TYR  58   6.112  -0.559  -2.610
  440    HD1  TYR  58           HD1      TYR  58   6.407  -2.279   0.753
  441    HD2  TYR  58           HD2      TYR  58   7.723  -2.104  -3.330
  442    HE1  TYR  58           HE1      TYR  58   8.070  -4.014   1.233
  443    HE2  TYR  58           HE2      TYR  58   9.423  -3.853  -2.849
  444    HH   TYR  58           HH       TYR  58  10.350  -5.295  -1.187
  445    H    VAL  59           H        VAL  59   4.521   2.093   0.518
  446    HA   VAL  59           HA       VAL  59   4.224   3.825  -1.844
  447    HB   VAL  59           HB       VAL  59   1.927   3.847  -1.811
  448   HG11  VAL  59          HG11      VAL  59   2.309   0.984  -0.899
  449   HG12  VAL  59          HG12      VAL  59   1.029   1.639  -1.941
  450   HG13  VAL  59          HG13      VAL  59   2.694   1.568  -2.524
  451   HG21  VAL  59          HG21      VAL  59   1.524   4.353   0.542
  452   HG22  VAL  59          HG22      VAL  59   0.413   3.155  -0.087
  453   HG23  VAL  59          HG23      VAL  59   1.773   2.653   0.954
  454    H    GLU  60           H        GLU  60   3.123   5.950  -1.160
  455    HA   GLU  60           HA       GLU  60   3.839   6.804   1.539
  456    HB2  GLU  60           HB2      GLU  60   5.813   7.095  -0.086
  457    HB3  GLU  60           HB3      GLU  60   4.819   8.309  -0.920
  458    HG2  GLU  60           HG2      GLU  60   4.855   9.756   0.992
  459    HG3  GLU  60           HG3      GLU  60   5.380   8.442   2.054
  460    H    LYS  61           H        LYS  61   2.755   8.995   1.896
  461    HA   LYS  61           HA       LYS  61   0.130   8.915   0.585
  462    HB2  LYS  61           HB2      LYS  61   1.180  10.205   3.081
  463    HB3  LYS  61           HB3      LYS  61  -0.233  10.938   2.276
  464    HG2  LYS  61           HG2      LYS  61  -1.437   8.921   2.246
  465    HG3  LYS  61           HG3      LYS  61  -0.023   7.956   2.688
  466    HD2  LYS  61           HD2      LYS  61  -0.159   9.048   5.003
  467    HD3  LYS  61           HD3      LYS  61  -1.735   9.700   4.463
  468    HE2  LYS  61           HE2      LYS  61  -2.359   7.669   5.429
  469    HE3  LYS  61           HE3      LYS  61  -2.248   7.310   3.682
  470    HZ1  LYS  61           HZ1      LYS  61  -0.192   6.672   5.738
  471    HZ2  LYS  61           HZ2      LYS  61   0.011   6.409   4.162
  472    HZ3  LYS  61           HZ3      LYS  61  -1.158   5.579   4.981
  473    H    VAL  62           H        VAL  62  -0.957  10.818  -0.218
  474    HA   VAL  62           HA       VAL  62   0.844  12.716  -1.530
  475    HB   VAL  62           HB       VAL  62   0.716  10.690  -2.920
  476   HG11  VAL  62          HG11      VAL  62  -1.367   9.925  -3.967
  477   HG12  VAL  62          HG12      VAL  62  -1.435   9.781  -2.208
  478   HG13  VAL  62          HG13      VAL  62  -2.291  11.105  -3.017
  479   HG21  VAL  62          HG21      VAL  62   0.871  12.906  -4.049
  480   HG22  VAL  62          HG22      VAL  62   0.197  11.596  -5.021
  481   HG23  VAL  62          HG23      VAL  62  -0.891  12.816  -4.359
  482    H    GLY  63           H        GLY  63  -0.711  14.265  -2.892
  483    HA2  GLY  63           HA2      GLY  63  -2.558  15.630  -3.006
  484    HA3  GLY  63           HA3      GLY  63  -3.367  14.670  -1.761
  485    H    LEU  64           H        LEU  64  -3.063  15.243   0.446
  486    HA   LEU  64           HA       LEU  64  -2.319  17.999   0.865
  487    HB2  LEU  64           HB2      LEU  64  -3.133  15.758   2.750
  488    HB3  LEU  64           HB3      LEU  64  -2.644  17.331   3.369
  489    HG   LEU  64           HG       LEU  64  -4.929  16.919   1.398
  490   HD11  LEU  64          HD11      LEU  64  -5.543  15.964   3.511
  491   HD12  LEU  64          HD12      LEU  64  -6.343  17.524   3.390
  492   HD13  LEU  64          HD13      LEU  64  -4.897  17.360   4.403
  493   HD21  LEU  64          HD21      LEU  64  -4.063  19.403   2.965
  494   HD22  LEU  64          HD22      LEU  64  -5.521  19.251   1.958
  495   HD23  LEU  64          HD23      LEU  64  -3.952  19.201   1.202
  496    H    ALA  65           H        ALA  65  -0.869  18.624   2.772
  497    HA   ALA  65           HA       ALA  65   1.695  17.164   2.713
  498    HB1  ALA  65           HB1      ALA  65   1.719  19.004   1.027
  499    HB2  ALA  65           HB2      ALA  65   1.212  20.153   2.287
  500    HB3  ALA  65           HB3      ALA  65   2.803  19.364   2.377
  501    H    ALA  66           H        ALA  66   3.160  18.320   4.363
  502    HA   ALA  66           HA       ALA  66   3.692  18.512   6.554
  503    HB1  ALA  66           HB1      ALA  66   1.347  20.447   6.622
  504    HB2  ALA  66           HB2      ALA  66   2.739  20.420   7.724
  505    HB3  ALA  66           HB3      ALA  66   2.973  20.823   6.016
  506    H    ALA  67           H        ALA  67   2.219  16.287   6.004
  507    HA   ALA  67           HA       ALA  67  -0.030  15.668   7.478
  508    HB1  ALA  67           HB1      ALA  67   0.741  13.317   7.233
  509    HB2  ALA  67           HB2      ALA  67   1.033  14.218   5.725
  510    HB3  ALA  67           HB3      ALA  67   2.368  13.889   6.847
  511    H1   THR 101           H        THR 101  -2.686 -11.388  11.103
  512    HA   THR 101           HA       THR 101  -2.212  -9.762   8.708
  513    HB   THR 101           HB       THR 101  -0.026 -11.516   9.803
  514    HG1  THR 101           HG1      THR 101   0.151 -10.223  11.429
  515   HG21  THR 101          HG21      THR 101   1.344  -9.891   8.571
  516   HG22  THR 101          HG22      THR 101  -0.105  -8.910   8.208
  517   HG23  THR 101          HG23      THR 101   0.083 -10.524   7.501
  518    H    LYS 102           H        LYS 102  -2.456 -10.899   6.795
  519    HA   LYS 102           HA       LYS 102  -3.496 -13.630   6.875
  520    HB2  LYS 102           HB2      LYS 102  -2.812 -11.625   4.689
  521    HB3  LYS 102           HB3      LYS 102  -3.246 -13.287   4.279
  522    HG2  LYS 102           HG2      LYS 102  -5.010 -11.673   6.143
  523    HG3  LYS 102           HG3      LYS 102  -5.107 -11.459   4.400
  524    HD2  LYS 102           HD2      LYS 102  -5.761 -13.724   4.004
  525    HD3  LYS 102           HD3      LYS 102  -5.299 -14.230   5.635
  526    HE2  LYS 102           HE2      LYS 102  -7.735 -14.043   5.463
  527    HE3  LYS 102           HE3      LYS 102  -7.070 -12.909   6.640
  528    HZ1  LYS 102           HZ1      LYS 102  -8.656 -11.784   5.366
  529    HZ2  LYS 102           HZ2      LYS 102  -8.025 -12.284   3.929
  530    HZ3  LYS 102           HZ3      LYS 102  -7.214 -11.199   4.847
  531    H    GLY 103           H        GLY 103  -0.695 -12.287   5.054
  532    HA2  GLY 103           HA2      GLY 103   0.954 -14.592   5.863
  533    HA3  GLY 103           HA3      GLY 103   0.787 -14.135   4.150
  534    HA   PRO 104           HA       PRO 104   4.042 -11.517   6.450
  535    HB2  PRO 104           HB2      PRO 104   6.342 -12.465   5.316
  536    HB3  PRO 104           HB3      PRO 104   5.601 -13.200   6.769
  537    HG2  PRO 104           HG2      PRO 104   5.353 -14.105   3.887
  538    HG3  PRO 104           HG3      PRO 104   5.705 -15.102   5.338
  539    HD2  PRO 104           HD2      PRO 104   3.190 -14.897   4.293
  540    HD3  PRO 104           HD3      PRO 104   3.466 -15.019   6.057
  541    H    ALA 105           H        ALA 105   5.019  -9.792   5.489
  542    HA   ALA 105           HA       ALA 105   4.124  -8.879   2.937
  543    HB1  ALA 105           HB1      ALA 105   4.131  -7.396   4.817
  544    HB2  ALA 105           HB2      ALA 105   5.823  -7.756   5.218
  545    HB3  ALA 105           HB3      ALA 105   5.452  -6.812   3.800
  546    HA   PRO 106           HA       PRO 106   7.716  -9.462   0.409
  547    HB2  PRO 106           HB2      PRO 106   7.948  -6.955  -0.828
  548    HB3  PRO 106           HB3      PRO 106   6.757  -8.242  -1.178
  549    HG2  PRO 106           HG2      PRO 106   6.379  -5.773   0.478
  550    HG3  PRO 106           HG3      PRO 106   5.309  -6.488  -0.779
  551    HD2  PRO 106           HD2      PRO 106   4.866  -6.883   1.831
  552    HD3  PRO 106           HD3      PRO 106   4.537  -8.134   0.626
  553    H    ASN 107           H        ASN 107   7.587  -7.215   2.690
  554    HA   ASN 107           HA       ASN 107   9.946  -5.712   2.769
  555    HB2  ASN 107           HB2      ASN 107   7.969  -6.544   4.813
  556    HB3  ASN 107           HB3      ASN 107   9.573  -6.327   5.476
  557   HD21  ASN 107          HD21      ASN 107   8.526  -4.634   6.750
  558   HD22  ASN 107          HD22      ASN 107   8.382  -3.054   6.055
  559    HA   PRO 108           HA       PRO 108  11.730  -5.328   5.079
  560    HB2  PRO 108           HB2      PRO 108  14.377  -4.923   4.362
  561    HB3  PRO 108           HB3      PRO 108  13.808  -5.762   5.839
  562    HG2  PRO 108           HG2      PRO 108  14.585  -6.994   3.181
  563    HG3  PRO 108           HG3      PRO 108  15.129  -7.480   4.817
  564    HD2  PRO 108           HD2      PRO 108  13.108  -8.801   3.655
  565    HD3  PRO 108           HD3      PRO 108  12.938  -8.320   5.368
  566    HA   PRO 109           HA       PRO 109  10.898  -2.768   1.705
  567    HB2  PRO 109           HB2      PRO 109  11.903  -0.300   2.492
  568    HB3  PRO 109           HB3      PRO 109  10.383  -1.037   3.094
  569    HG2  PRO 109           HG2      PRO 109  13.142  -1.055   4.351
  570    HG3  PRO 109           HG3      PRO 109  11.559  -0.738   5.139
  571    HD2  PRO 109           HD2      PRO 109  12.755  -3.171   5.260
  572    HD3  PRO 109           HD3      PRO 109  10.982  -3.024   5.099
  573    HA   PRO 110           HA       PRO 110  14.335  -2.559  -1.031
  574    HB2  PRO 110           HB2      PRO 110  13.495  -0.823  -2.975
  575    HB3  PRO 110           HB3      PRO 110  12.755  -2.419  -2.674
  576    HG2  PRO 110           HG2      PRO 110  11.789   0.266  -1.627
  577    HG3  PRO 110           HG3      PRO 110  10.839  -0.982  -2.474
  578    HD2  PRO 110           HD2      PRO 110  10.839  -0.868   0.215
  579    HD3  PRO 110           HD3      PRO 110  10.897  -2.432  -0.628
  580    H    ILE 111           H        ILE 111  13.396   0.924  -1.213
  581    HA   ILE 111           HA       ILE 111  16.221   1.610  -0.659
  582    HB   ILE 111           HB       ILE 111  14.099   3.453  -1.772
  583   HG12  ILE 111          HG12      ILE 111  14.191   1.624  -3.348
  584   HG13  ILE 111          HG13      ILE 111  14.937   3.064  -4.014
  585   HG21  ILE 111          HG21      ILE 111  16.039   4.587  -0.844
  586   HG22  ILE 111          HG22      ILE 111  17.133   3.577  -1.810
  587   HG23  ILE 111          HG23      ILE 111  16.029   4.725  -2.605
  588   HD11  ILE 111          HD11      ILE 111  16.114   1.060  -4.627
  589   HD12  ILE 111          HD12      ILE 111  17.168   2.092  -3.640
  590   HD13  ILE 111          HD13      ILE 111  16.410   0.638  -2.932
  591    H    LEU 112           H        LEU 112  12.988   2.976   0.038
  592    HA   LEU 112           HA       LEU 112  12.323   4.428   1.677
  593    HB2  LEU 112           HB2      LEU 112  12.888   1.760   2.968
  594    HB3  LEU 112           HB3      LEU 112  12.246   3.076   3.920
  595    HG   LEU 112           HG       LEU 112  10.494   1.551   3.136
  596   HD11  LEU 112          HD11      LEU 112  10.071   3.983   3.661
  597   HD12  LEU 112          HD12      LEU 112   8.891   3.249   2.558
  598   HD13  LEU 112          HD13      LEU 112  10.147   4.305   1.932
  599   HD21  LEU 112          HD21      LEU 112   9.772   1.387   0.845
  600   HD22  LEU 112          HD22      LEU 112  11.529   1.137   0.811
  601   HD23  LEU 112          HD23      LEU 112  10.843   2.693   0.349
  602    H    LYS 113           H        LYS 113  14.028   5.945   1.406
  603    HA   LYS 113           HA       LYS 113  16.257   5.920   3.316
  604    HB2  LYS 113           HB2      LYS 113  16.649   6.816   1.085
  605    HB3  LYS 113           HB3      LYS 113  15.271   7.908   1.259
  606    HG2  LYS 113           HG2      LYS 113  16.533   8.986   3.239
  607    HG3  LYS 113           HG3      LYS 113  17.910   7.967   2.803
  608    HD2  LYS 113           HD2      LYS 113  18.215  10.173   1.866
  609    HD3  LYS 113           HD3      LYS 113  17.907   9.037   0.548
  610    HE2  LYS 113           HE2      LYS 113  15.383   9.778   0.860
  611    HE3  LYS 113           HE3      LYS 113  16.057  11.136   1.769
  612    HZ1  LYS 113           HZ1      LYS 113  16.731  10.363  -0.997
  613    HZ2  LYS 113           HZ2      LYS 113  17.320  11.696  -0.226
  614    HZ3  LYS 113           HZ3      LYS 113  15.710  11.589  -0.617
  615    H    VAL 114           H        VAL 114  15.910   6.610   5.406
  616    HA   VAL 114           HA       VAL 114  13.913   8.771   5.865
  617    HB   VAL 114           HB       VAL 114  14.119   6.241   7.548
  618   HG11  VAL 114          HG11      VAL 114  13.355   8.167   8.851
  619   HG12  VAL 114          HG12      VAL 114  12.172   8.586   7.590
  620   HG13  VAL 114          HG13      VAL 114  11.974   7.108   8.540
  621   HG21  VAL 114          HG21      VAL 114  11.826   5.692   6.685
  622   HG22  VAL 114          HG22      VAL 114  12.012   6.975   5.463
  623   HG23  VAL 114          HG23      VAL 114  13.080   5.554   5.466
  624    H    TRP 115           H        TRP 115  14.511  10.224   7.438
  625    HA   TRP 115           HA       TRP 115  17.260   9.978   8.570
  626    HB2  TRP 115           HB2      TRP 115  15.347  12.314   8.081
  627    HB3  TRP 115           HB3      TRP 115  16.600  12.384   9.301
  628    HD1  TRP 115           HD1      TRP 115  16.118  13.766   6.175
  629    HE1  TRP 115           HE1      TRP 115  18.348  14.422   5.060
  630    HE3  TRP 115           HE3      TRP 115  19.293  11.023   9.057
  631    HZ2  TRP 115           HZ2      TRP 115  21.166  13.851   5.421
  632    HZ3  TRP 115           HZ3      TRP 115  21.758  11.237   8.787
  633    HH2  TRP 115           HH2      TRP 115  22.697  12.633   6.947
  Start of MODEL    4
    1    H1   MET   1           H        MET   1 -17.064   3.327   5.599
    2    HA   MET   1           HA       MET   1 -17.930   5.171   6.953
    3    HB2  MET   1           HB2      MET   1 -18.059   3.001   9.034
    4    HB3  MET   1           HB3      MET   1 -17.943   4.721   9.488
    5    HG2  MET   1           HG2      MET   1 -19.886   5.224   8.179
    6    HG3  MET   1           HG3      MET   1 -20.009   3.580   7.545
    7    HE1  MET   1           HE1      MET   1 -21.101   1.608   8.681
    8    HE2  MET   1           HE2      MET   1 -19.788   1.565   9.887
    9    HE3  MET   1           HE3      MET   1 -21.487   1.524  10.411
   10    H    LYS   2           H        LYS   2 -15.654   3.432   9.215
   11    HA   LYS   2           HA       LYS   2 -13.711   5.504   8.798
   12    HB2  LYS   2           HB2      LYS   2 -13.487   2.637   9.837
   13    HB3  LYS   2           HB3      LYS   2 -12.129   3.761   9.793
   14    HG2  LYS   2           HG2      LYS   2 -13.262   5.314  11.286
   15    HG3  LYS   2           HG3      LYS   2 -14.702   4.273  11.343
   16    HD2  LYS   2           HD2      LYS   2 -13.356   2.430  12.300
   17    HD3  LYS   2           HD3      LYS   2 -11.887   3.427  12.165
   18    HE2  LYS   2           HE2      LYS   2 -13.030   5.135  13.644
   19    HE3  LYS   2           HE3      LYS   2 -14.320   3.956  13.929
   20    HZ1  LYS   2           HZ1      LYS   2 -12.584   3.948  15.613
   21    HZ2  LYS   2           HZ2      LYS   2 -11.443   3.573  14.494
   22    HZ3  LYS   2           HZ3      LYS   2 -12.612   2.462  14.837
   23    H    VAL   3           H        VAL   3 -11.761   5.409   7.662
   24    HA   VAL   3           HA       VAL   3 -10.744   5.355   5.617
   25    HB   VAL   3           HB       VAL   3 -10.438   2.425   6.365
   26   HG11  VAL   3          HG11      VAL   3  -8.424   4.428   5.251
   27   HG12  VAL   3          HG12      VAL   3  -8.217   2.678   5.452
   28   HG13  VAL   3          HG13      VAL   3  -9.346   3.297   4.246
   29   HG21  VAL   3          HG21      VAL   3  -8.535   3.140   7.807
   30   HG22  VAL   3          HG22      VAL   3  -9.031   4.835   7.604
   31   HG23  VAL   3          HG23      VAL   3 -10.088   3.676   8.439
   32    HA   PRO   4           HA       PRO   4 -14.176   3.377   3.177
   33    HB2  PRO   4           HB2      PRO   4 -15.369   5.506   2.026
   34    HB3  PRO   4           HB3      PRO   4 -15.655   5.093   3.746
   35    HG2  PRO   4           HG2      PRO   4 -13.711   7.156   2.626
   36    HG3  PRO   4           HG3      PRO   4 -14.915   7.364   3.933
   37    HD2  PRO   4           HD2      PRO   4 -12.270   6.754   4.417
   38    HD3  PRO   4           HD3      PRO   4 -13.587   6.210   5.481
   39    H    GLY   5           H        GLY   5 -11.497   5.464   2.303
   40    HA2  GLY   5           HA2      GLY   5 -10.485   4.194   0.173
   41    HA3  GLY   5           HA3      GLY   5 -11.717   5.256  -0.551
   42    H    VAL   6           H        VAL   6  -8.721   5.162   1.307
   43    HA   VAL   6           HA       VAL   6  -8.525   8.150   1.338
   44    HB   VAL   6           HB       VAL   6  -6.880   6.059   2.832
   45   HG11  VAL   6          HG11      VAL   6  -5.611   8.116   2.481
   46   HG12  VAL   6          HG12      VAL   6  -6.975   9.088   3.074
   47   HG13  VAL   6          HG13      VAL   6  -6.122   8.002   4.172
   48   HG21  VAL   6          HG21      VAL   6  -9.141   7.803   3.854
   49   HG22  VAL   6          HG22      VAL   6  -9.173   6.040   3.695
   50   HG23  VAL   6          HG23      VAL   6  -8.077   6.809   4.857
   51    H    ARG   7           H        ARG   7  -7.396   8.960  -0.411
   52    HA   ARG   7           HA       ARG   7  -6.074   7.265  -2.226
   53    HB2  ARG   7           HB2      ARG   7  -5.548   9.109  -3.499
   54    HB3  ARG   7           HB3      ARG   7  -7.069   9.518  -2.738
   55    HG2  ARG   7           HG2      ARG   7  -4.311  10.592  -2.012
   56    HG3  ARG   7           HG3      ARG   7  -5.571  11.433  -2.864
   57    HD2  ARG   7           HD2      ARG   7  -5.575  10.619   0.046
   58    HD3  ARG   7           HD3      ARG   7  -5.506  12.252  -0.615
   59    HE   ARG   7           HE       ARG   7  -7.840  11.566  -1.618
   60   HH11  ARG   7          HH11      ARG   7  -6.523  11.580   1.650
   61   HH12  ARG   7          HH12      ARG   7  -8.038  11.175   2.438
   62   HH21  ARG   7          HH21      ARG   7  -9.933  11.175  -0.527
   63   HH22  ARG   7          HH22      ARG   7  -9.991  11.168   1.194
   64    H    VAL   8           H        VAL   8  -4.053   6.622  -2.566
   65    HA   VAL   8           HA       VAL   8  -1.790   7.745  -1.097
   66    HB   VAL   8           HB       VAL   8  -1.031   5.395  -0.604
   67   HG11  VAL   8          HG11      VAL   8  -3.556   6.215   0.873
   68   HG12  VAL   8          HG12      VAL   8  -2.244   5.167   1.476
   69   HG13  VAL   8          HG13      VAL   8  -1.925   6.883   1.159
   70   HG21  VAL   8          HG21      VAL   8  -2.630   3.583  -0.389
   71   HG22  VAL   8          HG22      VAL   8  -3.962   4.614  -0.943
   72   HG23  VAL   8          HG23      VAL   8  -2.663   4.175  -2.054
   73    H    ARG   9           H        ARG   9   0.225   7.228  -2.278
   74    HA   ARG   9           HA       ARG   9  -0.270   6.349  -5.078
   75    HB2  ARG   9           HB2      ARG   9  -0.072   8.834  -4.862
   76    HB3  ARG   9           HB3      ARG   9   1.570   8.620  -4.232
   77    HG2  ARG   9           HG2      ARG   9   2.217   7.516  -6.368
   78    HG3  ARG   9           HG3      ARG   9   0.540   7.604  -6.922
   79    HD2  ARG   9           HD2      ARG   9   1.760   9.338  -7.997
   80    HD3  ARG   9           HD3      ARG   9   0.654  10.093  -6.832
   81    HE   ARG   9           HE       ARG   9   3.228   9.643  -5.647
   82   HH11  ARG   9          HH11      ARG   9   1.866  11.723  -8.244
   83   HH12  ARG   9          HH12      ARG   9   2.916  13.013  -7.837
   84   HH21  ARG   9          HH21      ARG   9   4.631  11.470  -5.223
   85   HH22  ARG   9          HH22      ARG   9   4.266  12.965  -6.024
   86    H    ALA  10           H        ALA  10   1.140   4.922  -5.866
   87    HA   ALA  10           HA       ALA  10   2.811   3.399  -4.146
   88    HB1  ALA  10           HB1      ALA  10   2.631   3.587  -7.152
   89    HB2  ALA  10           HB2      ALA  10   3.428   2.274  -6.254
   90    HB3  ALA  10           HB3      ALA  10   1.672   2.512  -6.119
   91    H    LEU  11           H        LEU  11   4.856   3.334  -3.760
   92    HA   LEU  11           HA       LEU  11   6.638   5.559  -4.523
   93    HB2  LEU  11           HB2      LEU  11   6.857   3.220  -2.572
   94    HB3  LEU  11           HB3      LEU  11   8.097   4.438  -2.785
   95    HG   LEU  11           HG       LEU  11   5.265   5.004  -1.806
   96   HD11  LEU  11          HD11      LEU  11   7.874   4.795  -0.258
   97   HD12  LEU  11          HD12      LEU  11   6.516   3.663  -0.185
   98   HD13  LEU  11          HD13      LEU  11   6.316   5.313   0.407
   99   HD21  LEU  11          HD21      LEU  11   7.700   6.794  -2.135
  100   HD22  LEU  11          HD22      LEU  11   6.316   7.218  -1.131
  101   HD23  LEU  11          HD23      LEU  11   6.116   6.978  -2.879
  102    H    TYR  12           H        TYR  12   6.130   2.085  -5.101
  103    HA   TYR  12           HA       TYR  12   8.254   2.070  -7.118
  104    HB2  TYR  12           HB2      TYR  12   8.218  -0.299  -5.303
  105    HB3  TYR  12           HB3      TYR  12   9.544   0.397  -6.206
  106    HD1  TYR  12           HD1      TYR  12   7.723   0.303  -3.079
  107    HD2  TYR  12           HD2      TYR  12  10.744   2.441  -5.203
  108    HE1  TYR  12           HE1      TYR  12   8.577   1.192  -0.906
  109    HE2  TYR  12           HE2      TYR  12  11.536   3.444  -3.042
  110    HH   TYR  12           HH       TYR  12  11.520   3.117  -0.666
  111    H    ASP  13           H        ASP  13   8.167  -0.137  -8.258
  112    HA   ASP  13           HA       ASP  13   5.370  -0.776  -8.915
  113    HB2  ASP  13           HB2      ASP  13   6.333  -1.872 -10.881
  114    HB3  ASP  13           HB3      ASP  13   6.821  -0.187 -10.773
  115    H    TYR  14           H        TYR  14   4.795  -2.049  -7.060
  116    HA   TYR  14           HA       TYR  14   6.010  -4.781  -7.074
  117    HB2  TYR  14           HB2      TYR  14   5.489  -2.937  -4.765
  118    HB3  TYR  14           HB3      TYR  14   5.095  -4.637  -4.557
  119    HD1  TYR  14           HD1      TYR  14   6.751  -6.105  -3.793
  120    HD2  TYR  14           HD2      TYR  14   7.911  -2.571  -6.003
  121    HE1  TYR  14           HE1      TYR  14   9.137  -6.769  -3.643
  122    HE2  TYR  14           HE2      TYR  14  10.266  -3.237  -5.871
  123    HH   TYR  14           HH       TYR  14  11.611  -5.141  -5.556
  124    H    THR  15           H        THR  15   4.596  -6.488  -6.966
  125    HA   THR  15           HA       THR  15   1.699  -5.769  -7.209
  126    HB   THR  15           HB       THR  15   2.513  -6.317  -9.318
  127    HG1  THR  15           HG1      THR  15   1.480  -8.709  -8.243
  128   HG21  THR  15          HG21      THR  15   4.026  -8.725  -8.268
  129   HG22  THR  15          HG22      THR  15   4.711  -7.242  -8.971
  130   HG23  THR  15          HG23      THR  15   3.758  -8.323  -9.976
  131    H    GLY  16           H        GLY  16   1.649  -5.958  -4.838
  132    HA2  GLY  16           HA2      GLY  16   1.269  -7.111  -2.928
  133    HA3  GLY  16           HA3      GLY  16   0.603  -8.392  -3.981
  134    H    GLN  17           H        GLN  17   1.404  -9.951  -2.544
  135    HA   GLN  17           HA       GLN  17   4.289 -10.529  -2.856
  136    HB2  GLN  17           HB2      GLN  17   3.477  -9.644  -0.495
  137    HB3  GLN  17           HB3      GLN  17   2.897 -11.287  -0.293
  138    HG2  GLN  17           HG2      GLN  17   5.776 -10.495  -0.984
  139    HG3  GLN  17           HG3      GLN  17   5.198 -10.831   0.644
  140   HE21  GLN  17          HE21      GLN  17   7.001 -12.276  -1.759
  141   HE22  GLN  17          HE22      GLN  17   6.576 -13.935  -1.388
  142    H    GLU  18           H        GLU  18   0.897 -11.572  -2.880
  143    HA   GLU  18           HA       GLU  18   1.651 -14.173  -3.945
  144    HB2  GLU  18           HB2      GLU  18  -0.388 -13.832  -1.695
  145    HB3  GLU  18           HB3      GLU  18   0.204 -15.324  -2.397
  146    HG2  GLU  18           HG2      GLU  18   2.428 -14.932  -1.374
  147    HG3  GLU  18           HG3      GLU  18   1.824 -13.434  -0.645
  148    H    ALA  19           H        ALA  19  -0.633 -15.264  -4.519
  149    HA   ALA  19           HA       ALA  19  -1.927 -13.534  -6.386
  150    HB1  ALA  19           HB1      ALA  19  -2.873 -16.237  -5.328
  151    HB2  ALA  19           HB2      ALA  19  -3.251 -15.499  -6.893
  152    HB3  ALA  19           HB3      ALA  19  -1.600 -16.058  -6.545
  153    H    ASP  20           H        ASP  20  -2.694 -14.338  -3.036
  154    HA   ASP  20           HA       ASP  20  -5.503 -13.630  -3.242
  155    HB2  ASP  20           HB2      ASP  20  -4.222 -15.295  -1.657
  156    HB3  ASP  20           HB3      ASP  20  -3.964 -13.881  -0.661
  157    H    GLU  21           H        GLU  21  -2.793 -11.721  -3.213
  158    HA   GLU  21           HA       GLU  21  -3.917  -9.490  -1.620
  159    HB2  GLU  21           HB2      GLU  21  -1.155  -9.407  -2.740
  160    HB3  GLU  21           HB3      GLU  21  -1.773  -8.820  -1.208
  161    HG2  GLU  21           HG2      GLU  21  -0.970 -11.648  -1.931
  162    HG3  GLU  21           HG3      GLU  21  -0.129 -10.552  -0.860
  163    H    LEU  22           H        LEU  22  -3.132  -7.349  -2.673
  164    HA   LEU  22           HA       LEU  22  -4.425  -7.009  -5.282
  165    HB2  LEU  22           HB2      LEU  22  -4.662  -5.616  -2.972
  166    HB3  LEU  22           HB3      LEU  22  -3.217  -4.835  -3.529
  167    HG   LEU  22           HG       LEU  22  -4.382  -3.980  -5.486
  168   HD11  LEU  22          HD11      LEU  22  -7.030  -4.415  -5.422
  169   HD12  LEU  22          HD12      LEU  22  -6.509  -5.935  -4.666
  170   HD13  LEU  22          HD13      LEU  22  -5.909  -5.498  -6.253
  171   HD21  LEU  22          HD21      LEU  22  -5.944  -3.591  -2.935
  172   HD22  LEU  22          HD22      LEU  22  -6.073  -2.568  -4.379
  173   HD23  LEU  22          HD23      LEU  22  -4.535  -2.670  -3.491
  174    H    SER  23           H        SER  23  -3.243  -5.079  -6.657
  175    HA   SER  23           HA       SER  23  -0.337  -5.123  -6.368
  176    HB2  SER  23           HB2      SER  23  -0.191  -5.709  -8.881
  177    HB3  SER  23           HB3      SER  23  -0.443  -7.006  -7.700
  178    HG   SER  23           HG       SER  23  -2.572  -5.840  -9.171
  179    H    PHE  24           H        PHE  24   0.672  -3.287  -7.514
  180    HA   PHE  24           HA       PHE  24  -1.135  -1.436  -8.878
  181    HB2  PHE  24           HB2      PHE  24  -0.406   0.410  -7.428
  182    HB3  PHE  24           HB3      PHE  24  -1.506  -0.723  -6.682
  183    HD1  PHE  24           HD1      PHE  24   2.152   0.132  -6.895
  184    HD2  PHE  24           HD2      PHE  24  -1.025  -1.636  -4.519
  185    HE1  PHE  24           HE1      PHE  24   3.613   0.161  -4.908
  186    HE2  PHE  24           HE2      PHE  24   0.479  -1.495  -2.527
  187    HZ   PHE  24           HZ       PHE  24   2.706  -0.584  -2.697
  188    H    LYS  25           H        LYS  25   0.365   0.457  -9.687
  189    HA   LYS  25           HA       LYS  25   3.086  -0.624 -10.274
  190    HB2  LYS  25           HB2      LYS  25   0.961   0.446 -12.067
  191    HB3  LYS  25           HB3      LYS  25   2.539   1.143 -12.358
  192    HG2  LYS  25           HG2      LYS  25   2.025  -1.867 -12.241
  193    HG3  LYS  25           HG3      LYS  25   2.060  -0.899 -13.721
  194    HD2  LYS  25           HD2      LYS  25   4.395  -0.164 -13.160
  195    HD3  LYS  25           HD3      LYS  25   4.392  -1.258 -11.791
  196    HE2  LYS  25           HE2      LYS  25   4.017  -2.132 -14.678
  197    HE3  LYS  25           HE3      LYS  25   5.564  -2.094 -13.823
  198    HZ1  LYS  25           HZ1      LYS  25   4.396  -3.614 -12.147
  199    HZ2  LYS  25           HZ2      LYS  25   4.872  -4.231 -13.603
  200    HZ3  LYS  25           HZ3      LYS  25   3.297  -3.873 -13.349
  201    H    ALA  26           H        ALA  26   4.705   1.035 -10.859
  202    HA   ALA  26           HA       ALA  26   5.165   2.754  -8.709
  203    HB1  ALA  26           HB1      ALA  26   6.991   1.935 -10.025
  204    HB2  ALA  26           HB2      ALA  26   6.289   2.590 -11.525
  205    HB3  ALA  26           HB3      ALA  26   6.954   3.673 -10.298
  206    H    GLY  27           H        GLY  27   4.293   4.653  -8.158
  207    HA2  GLY  27           HA2      GLY  27   3.571   6.811  -8.345
  208    HA3  GLY  27           HA3      GLY  27   3.721   6.723 -10.100
  209    H    GLU  28           H        GLU  28   1.800   4.041  -9.297
  210    HA   GLU  28           HA       GLU  28  -0.562   5.318 -10.314
  211    HB2  GLU  28           HB2      GLU  28   0.047   2.897 -10.618
  212    HB3  GLU  28           HB3      GLU  28  -0.249   2.646  -8.872
  213    HG2  GLU  28           HG2      GLU  28  -2.598   3.227  -9.156
  214    HG3  GLU  28           HG3      GLU  28  -2.331   3.558 -10.868
  215    H    GLU  29           H        GLU  29  -2.508   5.766  -9.195
  216    HA   GLU  29           HA       GLU  29  -2.209   6.234  -6.270
  217    HB2  GLU  29           HB2      GLU  29  -4.200   7.401  -8.260
  218    HB3  GLU  29           HB3      GLU  29  -4.248   7.615  -6.508
  219    HG2  GLU  29           HG2      GLU  29  -1.934   8.622  -6.626
  220    HG3  GLU  29           HG3      GLU  29  -2.106   8.646  -8.384
  221    H    LEU  30           H        LEU  30  -3.611   5.208  -4.890
  222    HA   LEU  30           HA       LEU  30  -5.760   3.419  -5.897
  223    HB2  LEU  30           HB2      LEU  30  -4.795   1.913  -3.941
  224    HB3  LEU  30           HB3      LEU  30  -4.461   1.628  -5.632
  225    HG   LEU  30           HG       LEU  30  -2.500   3.155  -3.908
  226   HD11  LEU  30          HD11      LEU  30  -1.346   0.995  -3.541
  227   HD12  LEU  30          HD12      LEU  30  -2.695   0.139  -4.336
  228   HD13  LEU  30          HD13      LEU  30  -2.933   0.980  -2.798
  229   HD21  LEU  30          HD21      LEU  30  -1.988   3.264  -6.289
  230   HD22  LEU  30          HD22      LEU  30  -2.272   1.540  -6.487
  231   HD23  LEU  30          HD23      LEU  30  -0.872   2.140  -5.555
  232    H    MET  31           H        MET  31  -7.227   2.871  -3.943
  233    HA   MET  31           HA       MET  31  -7.166   5.065  -1.931
  234    HB2  MET  31           HB2      MET  31  -9.756   3.727  -2.698
  235    HB3  MET  31           HB3      MET  31  -9.455   5.242  -1.909
  236    HG2  MET  31           HG2      MET  31  -8.830   4.711  -4.828
  237    HG3  MET  31           HG3      MET  31 -10.260   5.534  -4.225
  238    HE1  MET  31           HE1      MET  31  -9.174   8.976  -3.126
  239    HE2  MET  31           HE2      MET  31 -10.468   7.809  -3.438
  240    HE3  MET  31           HE3      MET  31  -9.409   7.608  -2.017
  241    H    LYS  32           H        LYS  32  -6.463   4.245  -0.087
  242    HA   LYS  32           HA       LYS  32  -6.542   1.498   0.642
  243    HB2  LYS  32           HB2      LYS  32  -4.940   3.147   1.473
  244    HB3  LYS  32           HB3      LYS  32  -6.232   4.044   2.277
  245    HG2  LYS  32           HG2      LYS  32  -6.745   2.024   3.673
  246    HG3  LYS  32           HG3      LYS  32  -5.350   1.207   2.944
  247    HD2  LYS  32           HD2      LYS  32  -4.431   2.085   4.919
  248    HD3  LYS  32           HD3      LYS  32  -3.957   3.273   3.703
  249    HE2  LYS  32           HE2      LYS  32  -6.184   4.499   4.395
  250    HE3  LYS  32           HE3      LYS  32  -6.141   3.426   5.808
  251    HZ1  LYS  32           HZ1      LYS  32  -4.147   5.451   5.021
  252    HZ2  LYS  32           HZ2      LYS  32  -3.840   4.315   6.151
  253    HZ3  LYS  32           HZ3      LYS  32  -5.055   5.422   6.396
  254    H    ILE  33           H        ILE  33  -7.986   0.294   2.002
  255    HA   ILE  33           HA       ILE  33 -10.369   1.762   2.850
  256    HB   ILE  33           HB       ILE  33 -11.791   0.080   2.322
  257   HG12  ILE  33          HG12      ILE  33  -9.512  -1.620   1.251
  258   HG13  ILE  33          HG13      ILE  33 -10.386  -1.916   2.735
  259   HG21  ILE  33          HG21      ILE  33 -11.171   1.735   0.567
  260   HG22  ILE  33          HG22      ILE  33 -10.060   0.543  -0.135
  261   HG23  ILE  33          HG23      ILE  33 -11.795   0.224  -0.092
  262   HD11  ILE  33          HD11      ILE  33 -12.502  -2.109   1.363
  263   HD12  ILE  33          HD12      ILE  33 -11.495  -2.025  -0.088
  264   HD13  ILE  33          HD13      ILE  33 -11.274  -3.359   1.061
  265    H    SER  34           H        SER  34  -7.767   0.075   4.146
  266    HA   SER  34           HA       SER  34  -9.229  -0.346   6.668
  267    HB2  SER  34           HB2      SER  34  -7.448  -2.371   5.272
  268    HB3  SER  34           HB3      SER  34  -7.911  -2.472   6.970
  269    HG   SER  34           HG       SER  34  -9.257  -3.757   5.843
  270    H    GLU  35           H        GLU  35  -7.409  -0.837   8.416
  271    HA   GLU  35           HA       GLU  35  -5.562   1.421   8.230
  272    HB2  GLU  35           HB2      GLU  35  -5.325   1.231  10.539
  273    HB3  GLU  35           HB3      GLU  35  -7.000   0.788  10.238
  274    HG2  GLU  35           HG2      GLU  35  -5.957  -1.697  10.168
  275    HG3  GLU  35           HG3      GLU  35  -4.667  -0.934  11.103
  276    H    GLU  36           H        GLU  36  -3.268   0.993   9.254
  277    HA   GLU  36           HA       GLU  36  -2.001  -1.007   7.550
  278    HB2  GLU  36           HB2      GLU  36  -1.368   1.449   7.982
  279    HB3  GLU  36           HB3      GLU  36  -0.681   0.918   9.511
  280    HG2  GLU  36           HG2      GLU  36   0.994  -0.353   8.447
  281    HG3  GLU  36           HG3      GLU  36   0.108  -0.489   6.927
  282    H    ASP  37           H        ASP  37  -1.753  -2.994   8.228
  283    HA   ASP  37           HA       ASP  37  -2.101  -3.704  11.049
  284    HB2  ASP  37           HB2      ASP  37  -3.173  -4.817   9.058
  285    HB3  ASP  37           HB3      ASP  37  -1.622  -5.520   8.676
  286    H    GLU  38           H        GLU  38  -0.443  -5.610  11.698
  287    HA   GLU  38           HA       GLU  38   1.905  -4.398  12.426
  288    HB2  GLU  38           HB2      GLU  38   0.551  -6.651  13.123
  289    HB3  GLU  38           HB3      GLU  38   1.863  -7.398  12.218
  290    HG2  GLU  38           HG2      GLU  38   2.513  -7.313  14.507
  291    HG3  GLU  38           HG3      GLU  38   3.485  -6.106  13.683
  292    H    GLN  39           H        GLN  39   1.538  -6.264   9.445
  293    HA   GLN  39           HA       GLN  39   4.461  -6.033   8.956
  294    HB2  GLN  39           HB2      GLN  39   2.289  -7.875   7.986
  295    HB3  GLN  39           HB3      GLN  39   3.507  -7.462   6.829
  296    HG2  GLN  39           HG2      GLN  39   3.864  -8.999   9.387
  297    HG3  GLN  39           HG3      GLN  39   4.210  -9.469   7.745
  298   HE21  GLN  39          HE21      GLN  39   5.432  -7.590  10.497
  299   HE22  GLN  39          HE22      GLN  39   7.036  -7.322   9.868
  300    H    GLY  40           H        GLY  40   2.280  -3.829   8.793
  301    HA2  GLY  40           HA2      GLY  40   2.170  -1.919   7.512
  302    HA3  GLY  40           HA3      GLY  40   3.512  -2.518   6.521
  303    H    TRP  41           H        TRP  41   0.563  -4.391   7.155
  304    HA   TRP  41           HA       TRP  41   0.058  -4.556   4.252
  305    HB2  TRP  41           HB2      TRP  41  -0.584  -6.171   6.707
  306    HB3  TRP  41           HB3      TRP  41  -1.766  -6.174   5.413
  307    HD1  TRP  41           HD1      TRP  41   0.735  -8.343   6.461
  308    HE1  TRP  41           HE1      TRP  41   1.543  -9.843   4.537
  309    HE3  TRP  41           HE3      TRP  41  -0.953  -5.604   2.531
  310    HZ2  TRP  41           HZ2      TRP  41   1.775  -9.659   1.688
  311    HZ3  TRP  41           HZ3      TRP  41  -0.487  -6.357   0.208
  312    HH2  TRP  41           HH2      TRP  41   0.808  -8.289  -0.255
  313    H    CYS  42           H        CYS  42  -1.635  -3.440   3.315
  314    HA   CYS  42           HA       CYS  42  -3.700  -2.256   5.128
  315    HB2  CYS  42           HB2      CYS  42  -1.980  -0.956   3.006
  316    HB3  CYS  42           HB3      CYS  42  -3.625  -0.376   3.325
  317    HG   CYS  42           HG       CYS  42  -1.300  -0.783   5.596
  318    H    LYS  43           H        LYS  43  -5.694  -2.896   4.411
  319    HA   LYS  43           HA       LYS  43  -5.858  -4.111   1.707
  320    HB2  LYS  43           HB2      LYS  43  -7.439  -4.236   4.153
  321    HB3  LYS  43           HB3      LYS  43  -8.486  -3.768   2.812
  322    HG2  LYS  43           HG2      LYS  43  -6.598  -6.028   2.226
  323    HG3  LYS  43           HG3      LYS  43  -7.751  -6.315   3.526
  324    HD2  LYS  43           HD2      LYS  43  -9.602  -5.720   1.941
  325    HD3  LYS  43           HD3      LYS  43  -8.399  -5.484   0.668
  326    HE2  LYS  43           HE2      LYS  43  -9.267  -7.747   0.467
  327    HE3  LYS  43           HE3      LYS  43  -7.608  -7.882   1.050
  328    HZ1  LYS  43           HZ1      LYS  43  -8.424  -8.363   3.225
  329    HZ2  LYS  43           HZ2      LYS  43  -9.297  -9.278   2.186
  330    HZ3  LYS  43           HZ3      LYS  43  -9.983  -7.948   2.812
  331    H    GLY  44           H        GLY  44  -6.822  -3.118  -0.098
  332    HA2  GLY  44           HA2      GLY  44  -8.093  -0.498   0.197
  333    HA3  GLY  44           HA3      GLY  44  -6.535  -0.438  -0.542
  334    H    ARG  45           H        ARG  45  -8.409   0.457  -2.047
  335    HA   ARG  45           HA       ARG  45  -9.198  -1.650  -3.969
  336    HB2  ARG  45           HB2      ARG  45 -11.116  -0.643  -2.708
  337    HB3  ARG  45           HB3      ARG  45 -10.609   0.974  -3.202
  338    HG2  ARG  45           HG2      ARG  45 -11.177   0.544  -5.510
  339    HG3  ARG  45           HG3      ARG  45 -11.343  -1.186  -5.209
  340    HD2  ARG  45           HD2      ARG  45 -13.533  -0.484  -5.351
  341    HD3  ARG  45           HD3      ARG  45 -13.255  -0.582  -3.608
  342    HE   ARG  45           HE       ARG  45 -12.723   2.086  -4.607
  343   HH11  ARG  45          HH11      ARG  45 -15.340  -0.091  -3.675
  344   HH12  ARG  45          HH12      ARG  45 -16.541   1.145  -3.591
  345   HH21  ARG  45          HH21      ARG  45 -14.235   3.695  -4.444
  346   HH22  ARG  45          HH22      ARG  45 -15.901   3.420  -3.992
  347    H    LEU  46           H        LEU  46  -9.076  -0.981  -6.141
  348    HA   LEU  46           HA       LEU  46  -7.019   1.170  -6.693
  349    HB2  LEU  46           HB2      LEU  46  -7.826  -1.373  -8.133
  350    HB3  LEU  46           HB3      LEU  46  -6.841  -0.143  -8.912
  351    HG   LEU  46           HG       LEU  46  -5.900  -1.051  -6.216
  352   HD11  LEU  46          HD11      LEU  46  -6.638  -3.123  -7.203
  353   HD12  LEU  46          HD12      LEU  46  -4.862  -3.028  -7.315
  354   HD13  LEU  46          HD13      LEU  46  -5.840  -2.719  -8.736
  355   HD21  LEU  46          HD21      LEU  46  -3.715  -0.850  -7.290
  356   HD22  LEU  46          HD22      LEU  46  -4.643   0.629  -7.606
  357   HD23  LEU  46          HD23      LEU  46  -4.466  -0.595  -8.870
  358    H    LEU  47           H        LEU  47  -7.363   2.247  -8.923
  359    HA   LEU  47           HA       LEU  47  -9.859   3.604  -8.989
  360    HB2  LEU  47           HB2      LEU  47  -7.550   3.263 -10.903
  361    HB3  LEU  47           HB3      LEU  47  -9.022   3.967 -11.522
  362    HG   LEU  47           HG       LEU  47  -7.229   5.564 -10.808
  363   HD11  LEU  47          HD11      LEU  47  -8.780   7.189  -9.861
  364   HD12  LEU  47          HD12      LEU  47  -9.937   5.906  -9.448
  365   HD13  LEU  47          HD13      LEU  47  -9.559   6.266 -11.148
  366   HD21  LEU  47          HD21      LEU  47  -6.670   4.366  -8.653
  367   HD22  LEU  47          HD22      LEU  47  -8.115   5.106  -7.946
  368   HD23  LEU  47          HD23      LEU  47  -6.782   6.114  -8.588
  369    H    THR  48           H        THR  48  -8.740   0.714 -10.631
  370    HA   THR  48           HA       THR  48 -10.972   0.358 -12.368
  371    HB   THR  48           HB       THR  48  -8.651  -0.434 -12.747
  372    HG1  THR  48           HG1      THR  48 -10.220  -1.435 -13.926
  373   HG21  THR  48          HG21      THR  48  -9.249  -2.563 -10.650
  374   HG22  THR  48          HG22      THR  48  -8.031  -1.264 -10.527
  375   HG23  THR  48          HG23      THR  48  -7.858  -2.524 -11.744
  376    H    GLY  49           H        GLY  49 -11.044   0.250  -9.050
  377    HA2  GLY  49           HA2      GLY  49 -12.726  -0.344  -7.677
  378    HA3  GLY  49           HA3      GLY  49 -13.516  -1.232  -8.978
  379    H    HIS  50           H        HIS  50 -10.468  -2.566  -8.965
  380    HA   HIS  50           HA       HIS  50 -11.360  -4.949  -7.626
  381    HB2  HIS  50           HB2      HIS  50  -9.815  -4.939  -9.565
  382    HB3  HIS  50           HB3      HIS  50  -8.592  -4.119  -8.581
  383    HD1  HIS  50           HD1      HIS  50 -10.670  -7.350  -7.762
  384    HD2  HIS  50           HD2      HIS  50  -6.776  -5.877  -8.312
  385    HE1  HIS  50           HE1      HIS  50  -9.094  -9.257  -7.156
  386    H    VAL  51           H        VAL  51 -10.522  -5.862  -5.565
  387    HA   VAL  51           HA       VAL  51  -9.284  -3.872  -3.754
  388    HB   VAL  51           HB       VAL  51 -11.591  -5.773  -3.139
  389   HG11  VAL  51          HG11      VAL  51 -10.450  -3.493  -1.473
  390   HG12  VAL  51          HG12      VAL  51 -11.856  -4.503  -1.053
  391   HG13  VAL  51          HG13      VAL  51 -10.259  -5.220  -1.121
  392   HG21  VAL  51          HG21      VAL  51 -11.704  -2.767  -3.549
  393   HG22  VAL  51          HG22      VAL  51 -12.451  -4.005  -4.584
  394   HG23  VAL  51          HG23      VAL  51 -13.029  -3.785  -2.943
  395    H    GLY  52           H        GLY  52  -7.973  -4.703  -2.144
  396    HA2  GLY  52           HA2      GLY  52  -7.711  -7.407  -1.357
  397    HA3  GLY  52           HA3      GLY  52  -6.578  -7.138  -2.683
  398    H    LEU  53           H        LEU  53  -5.275  -7.838  -0.558
  399    HA   LEU  53           HA       LEU  53  -4.552  -5.636   1.244
  400    HB2  LEU  53           HB2      LEU  53  -3.635  -8.487   0.759
  401    HB3  LEU  53           HB3      LEU  53  -2.627  -7.457   1.734
  402    HG   LEU  53           HG       LEU  53  -5.563  -7.960   2.362
  403   HD11  LEU  53          HD11      LEU  53  -4.868  -9.499   4.050
  404   HD12  LEU  53          HD12      LEU  53  -3.149  -9.181   3.731
  405   HD13  LEU  53          HD13      LEU  53  -4.138 -10.030   2.529
  406   HD21  LEU  53          HD21      LEU  53  -3.287  -6.797   4.023
  407   HD22  LEU  53          HD22      LEU  53  -4.953  -7.052   4.578
  408   HD23  LEU  53          HD23      LEU  53  -4.610  -5.841   3.350
  409    H    TYR  54           H        TYR  54  -2.820  -4.221   0.920
  410    HA   TYR  54           HA       TYR  54  -1.044  -4.779  -1.361
  411    HB2  TYR  54           HB2      TYR  54  -1.210  -2.654  -2.233
  412    HB3  TYR  54           HB3      TYR  54  -2.843  -3.146  -1.999
  413    HD1  TYR  54           HD1      TYR  54  -4.350  -1.804  -0.707
  414    HD2  TYR  54           HD2      TYR  54  -0.099  -1.113  -0.414
  415    HE1  TYR  54           HE1      TYR  54  -4.756   0.159   0.764
  416    HE2  TYR  54           HE2      TYR  54  -0.514   0.764   1.076
  417    HH   TYR  54           HH       TYR  54  -2.028   1.982   2.223
  418    HA   PRO  55           HA       PRO  55   1.811  -4.096   1.925
  419    HB2  PRO  55           HB2      PRO  55   4.157  -3.931   0.608
  420    HB3  PRO  55           HB3      PRO  55   3.195  -5.427   0.657
  421    HG2  PRO  55           HG2      PRO  55   3.301  -3.361  -1.567
  422    HG3  PRO  55           HG3      PRO  55   3.433  -5.143  -1.700
  423    HD2  PRO  55           HD2      PRO  55   1.065  -3.786  -2.066
  424    HD3  PRO  55           HD3      PRO  55   1.135  -5.434  -1.377
  425    H    ALA  56           H        ALA  56   1.378  -2.203   2.965
  426    HA   ALA  56           HA       ALA  56   1.288   0.354   1.838
  427    HB1  ALA  56           HB1      ALA  56   0.251  -0.421   4.023
  428    HB2  ALA  56           HB2      ALA  56   1.857  -0.236   4.758
  429    HB3  ALA  56           HB3      ALA  56   1.038   1.172   4.070
  430    H    ASN  57           H        ASN  57   4.095  -1.381   3.036
  431    HA   ASN  57           HA       ASN  57   5.801   0.876   3.415
  432    HB2  ASN  57           HB2      ASN  57   6.550  -1.890   2.376
  433    HB3  ASN  57           HB3      ASN  57   7.653  -0.680   3.023
  434   HD21  ASN  57          HD21      ASN  57   5.479  -3.361   3.898
  435   HD22  ASN  57          HD22      ASN  57   5.923  -3.196   5.593
  436    H    TYR  58           H        TYR  58   4.392  -0.288   0.490
  437    HA   TYR  58           HA       TYR  58   6.481   0.894  -1.224
  438    HB2  TYR  58           HB2      TYR  58   4.444  -1.257  -1.835
  439    HB3  TYR  58           HB3      TYR  58   5.566  -0.578  -3.007
  440    HD1  TYR  58           HD1      TYR  58   5.396  -2.306   0.300
  441    HD2  TYR  58           HD2      TYR  58   7.666  -1.814  -3.325
  442    HE1  TYR  58           HE1      TYR  58   7.050  -3.942   1.116
  443    HE2  TYR  58           HE2      TYR  58   9.323  -3.415  -2.515
  444    HH   TYR  58           HH       TYR  58   9.757  -5.149  -0.658
  445    H    VAL  59           H        VAL  59   3.903   2.095   0.273
  446    HA   VAL  59           HA       VAL  59   3.163   3.815  -1.986
  447    HB   VAL  59           HB       VAL  59   1.504   1.727  -1.328
  448   HG11  VAL  59          HG11      VAL  59  -0.382   2.598   0.029
  449   HG12  VAL  59          HG12      VAL  59   1.125   2.453   1.004
  450   HG13  VAL  59          HG13      VAL  59   0.511   4.015   0.441
  451   HG21  VAL  59          HG21      VAL  59   0.983   3.074  -3.198
  452   HG22  VAL  59          HG22      VAL  59  -0.428   2.919  -2.205
  453   HG23  VAL  59          HG23      VAL  59   0.492   4.439  -2.149
  454    H    GLU  60           H        GLU  60   2.013   5.837  -0.996
  455    HA   GLU  60           HA       GLU  60   2.244   6.240   1.791
  456    HB2  GLU  60           HB2      GLU  60   4.639   6.932   0.382
  457    HB3  GLU  60           HB3      GLU  60   3.831   8.452   0.815
  458    HG2  GLU  60           HG2      GLU  60   3.480   7.539   3.116
  459    HG3  GLU  60           HG3      GLU  60   4.437   6.118   2.700
  460    H    LYS  61           H        LYS  61   1.575   8.735   2.221
  461    HA   LYS  61           HA       LYS  61  -0.888   8.906   0.668
  462    HB2  LYS  61           HB2      LYS  61  -0.439   9.321   3.244
  463    HB3  LYS  61           HB3      LYS  61  -0.067  10.966   2.717
  464    HG2  LYS  61           HG2      LYS  61  -2.319  11.296   1.901
  465    HG3  LYS  61           HG3      LYS  61  -2.624   9.558   1.847
  466    HD2  LYS  61           HD2      LYS  61  -3.843  10.372   3.729
  467    HD3  LYS  61           HD3      LYS  61  -2.469   9.428   4.311
  468    HE2  LYS  61           HE2      LYS  61  -1.325  11.877   4.226
  469    HE3  LYS  61           HE3      LYS  61  -2.979  12.401   4.477
  470    HZ1  LYS  61           HZ1      LYS  61  -1.467  10.546   6.221
  471    HZ2  LYS  61           HZ2      LYS  61  -3.037  10.987   6.460
  472    HZ3  LYS  61           HZ3      LYS  61  -1.823  12.103   6.547
  473    H    VAL  62           H        VAL  62  -1.563  10.875  -0.425
  474    HA   VAL  62           HA       VAL  62   0.681  12.591  -1.353
  475    HB   VAL  62           HB       VAL  62   0.425  10.646  -2.853
  476   HG11  VAL  62          HG11      VAL  62  -1.520  10.498  -4.371
  477   HG12  VAL  62          HG12      VAL  62  -1.975  10.204  -2.695
  478   HG13  VAL  62          HG13      VAL  62  -2.341  11.769  -3.475
  479   HG21  VAL  62          HG21      VAL  62  -0.291  13.277  -4.195
  480   HG22  VAL  62          HG22      VAL  62   1.338  12.760  -3.707
  481   HG23  VAL  62          HG23      VAL  62   0.461  11.860  -4.952
  482    H    GLY  63           H        GLY  63  -2.776  12.318  -0.618
  483    HA2  GLY  63           HA2      GLY  63  -3.550  14.783  -1.822
  484    HA3  GLY  63           HA3      GLY  63  -4.386  13.952  -0.507
  485    H    LEU  64           H        LEU  64  -2.904  14.001   1.616
  486    HA   LEU  64           HA       LEU  64  -2.806  16.843   2.303
  487    HB2  LEU  64           HB2      LEU  64  -3.201  14.339   3.727
  488    HB3  LEU  64           HB3      LEU  64  -1.898  15.220   4.498
  489    HG   LEU  64           HG       LEU  64  -4.634  16.378   3.875
  490   HD11  LEU  64          HD11      LEU  64  -3.528  15.380   6.534
  491   HD12  LEU  64          HD12      LEU  64  -4.757  14.559   5.551
  492   HD13  LEU  64          HD13      LEU  64  -5.121  16.129   6.267
  493   HD21  LEU  64          HD21      LEU  64  -2.391  17.471   5.642
  494   HD22  LEU  64          HD22      LEU  64  -4.016  18.175   5.468
  495   HD23  LEU  64          HD23      LEU  64  -2.928  18.160   4.090
  496    H    ALA  65           H        ALA  65  -0.972  17.590   3.770
  497    HA   ALA  65           HA       ALA  65   1.705  16.601   3.193
  498    HB1  ALA  65           HB1      ALA  65   0.577  19.377   2.603
  499    HB2  ALA  65           HB2      ALA  65   2.312  18.937   2.498
  500    HB3  ALA  65           HB3      ALA  65   1.130  18.223   1.375
  501    H    ALA  66           H        ALA  66   3.155  18.045   4.519
  502    HA   ALA  66           HA       ALA  66   3.703  18.072   6.825
  503    HB1  ALA  66           HB1      ALA  66   3.974  20.505   7.163
  504    HB2  ALA  66           HB2      ALA  66   4.389  20.012   5.512
  505    HB3  ALA  66           HB3      ALA  66   2.834  20.817   5.848
  506    H    ALA  67           H        ALA  67   2.033  16.849   8.040
  507    HA   ALA  67           HA       ALA  67   0.511  18.621   9.813
  508    HB1  ALA  67           HB1      ALA  67  -1.131  17.751   8.115
  509    HB2  ALA  67           HB2      ALA  67  -0.717  16.097   8.656
  510    HB3  ALA  67           HB3      ALA  67  -1.452  17.223   9.786
  511    H1   THR 101           H        THR 101   2.269 -11.609  10.724
  512    HA   THR 101           HA       THR 101  -0.523 -12.418  11.255
  513    HB   THR 101           HB       THR 101  -0.183  -9.971  10.622
  514    HG1  THR 101           HG1      THR 101  -1.909 -10.034   9.232
  515   HG21  THR 101          HG21      THR 101   0.808 -11.191   7.984
  516   HG22  THR 101          HG22      THR 101   1.579  -9.971   9.012
  517   HG23  THR 101          HG23      THR 101   0.105  -9.619   8.094
  518    H    LYS 102           H        LYS 102  -1.550 -13.391   9.193
  519    HA   LYS 102           HA       LYS 102   0.276 -15.409   8.159
  520    HB2  LYS 102           HB2      LYS 102  -2.371 -15.554   8.448
  521    HB3  LYS 102           HB3      LYS 102  -2.374 -14.839   6.818
  522    HG2  LYS 102           HG2      LYS 102  -0.883 -16.682   6.022
  523    HG3  LYS 102           HG3      LYS 102  -0.864 -17.331   7.658
  524    HD2  LYS 102           HD2      LYS 102  -3.576 -17.259   7.190
  525    HD3  LYS 102           HD3      LYS 102  -2.976 -17.482   5.551
  526    HE2  LYS 102           HE2      LYS 102  -3.451 -19.639   6.593
  527    HE3  LYS 102           HE3      LYS 102  -1.716 -19.501   6.277
  528    HZ1  LYS 102           HZ1      LYS 102  -2.402 -20.364   8.554
  529    HZ2  LYS 102           HZ2      LYS 102  -2.925 -18.848   8.896
  530    HZ3  LYS 102           HZ3      LYS 102  -1.331 -19.118   8.577
  531    H    GLY 103           H        GLY 103   1.261 -15.385   6.093
  532    HA2  GLY 103           HA2      GLY 103   1.934 -14.468   4.050
  533    HA3  GLY 103           HA3      GLY 103   0.623 -13.297   4.176
  534    HA   PRO 104           HA       PRO 104   4.257 -11.409   6.782
  535    HB2  PRO 104           HB2      PRO 104   6.781 -12.449   6.368
  536    HB3  PRO 104           HB3      PRO 104   5.657 -13.016   7.644
  537    HG2  PRO 104           HG2      PRO 104   6.238 -14.257   4.945
  538    HG3  PRO 104           HG3      PRO 104   6.022 -15.056   6.536
  539    HD2  PRO 104           HD2      PRO 104   4.040 -14.893   4.637
  540    HD3  PRO 104           HD3      PRO 104   3.701 -14.951   6.386
  541    H    ALA 105           H        ALA 105   4.175  -9.653   5.563
  542    HA   ALA 105           HA       ALA 105   4.188  -9.094   3.003
  543    HB1  ALA 105           HB1      ALA 105   5.059  -6.753   3.830
  544    HB2  ALA 105           HB2      ALA 105   3.615  -7.441   4.584
  545    HB3  ALA 105           HB3      ALA 105   5.204  -7.540   5.386
  546    HA   PRO 106           HA       PRO 106   8.001  -9.211   0.866
  547    HB2  PRO 106           HB2      PRO 106   7.958  -6.727  -0.498
  548    HB3  PRO 106           HB3      PRO 106   7.165  -8.257  -0.945
  549    HG2  PRO 106           HG2      PRO 106   6.008  -5.847   0.389
  550    HG3  PRO 106           HG3      PRO 106   5.263  -6.905  -0.847
  551    HD2  PRO 106           HD2      PRO 106   4.692  -7.052   1.801
  552    HD3  PRO 106           HD3      PRO 106   4.686  -8.487   0.776
  553    H    ASN 107           H        ASN 107   7.506  -6.490   2.719
  554    HA   ASN 107           HA       ASN 107   9.776  -4.921   2.654
  555    HB2  ASN 107           HB2      ASN 107   9.096  -3.904   4.645
  556    HB3  ASN 107           HB3      ASN 107   7.619  -4.635   4.064
  557   HD21  ASN 107          HD21      ASN 107   6.508  -5.945   5.578
  558   HD22  ASN 107          HD22      ASN 107   7.283  -6.763   6.896
  559    HA   PRO 108           HA       PRO 108  11.152  -3.741   5.193
  560    HB2  PRO 108           HB2      PRO 108  13.895  -3.229   4.872
  561    HB3  PRO 108           HB3      PRO 108  13.054  -3.768   6.345
  562    HG2  PRO 108           HG2      PRO 108  14.526  -5.433   4.298
  563    HG3  PRO 108           HG3      PRO 108  14.564  -5.554   6.090
  564    HD2  PRO 108           HD2      PRO 108  13.072  -7.224   4.603
  565    HD3  PRO 108           HD3      PRO 108  12.442  -6.579   6.141
  566    HA   PRO 109           HA       PRO 109  10.974  -1.347   1.534
  567    HB2  PRO 109           HB2      PRO 109  12.332   1.019   2.008
  568    HB3  PRO 109           HB3      PRO 109  10.701   0.608   2.607
  569    HG2  PRO 109           HG2      PRO 109  13.351   0.308   4.044
  570    HG3  PRO 109           HG3      PRO 109  11.823   1.000   4.669
  571    HD2  PRO 109           HD2      PRO 109  12.528  -1.513   5.252
  572    HD3  PRO 109           HD3      PRO 109  10.830  -1.152   4.852
  573    HA   PRO 110           HA       PRO 110  14.545  -2.395  -0.874
  574    HB2  PRO 110           HB2      PRO 110  13.792  -1.456  -3.350
  575    HB3  PRO 110           HB3      PRO 110  13.109  -2.914  -2.578
  576    HG2  PRO 110           HG2      PRO 110  11.952  -0.114  -2.640
  577    HG3  PRO 110           HG3      PRO 110  11.121  -1.666  -2.954
  578    HD2  PRO 110           HD2      PRO 110  11.011  -0.408  -0.529
  579    HD3  PRO 110           HD3      PRO 110  11.036  -2.194  -0.662
  580    H    ILE 111           H        ILE 111  13.383   0.932  -1.770
  581    HA   ILE 111           HA       ILE 111  16.051   2.038  -1.210
  582    HB   ILE 111           HB       ILE 111  16.022   3.284  -3.331
  583   HG12  ILE 111          HG12      ILE 111  13.734   1.477  -4.247
  584   HG13  ILE 111          HG13      ILE 111  13.541   3.146  -3.724
  585   HG21  ILE 111          HG21      ILE 111  17.271   1.163  -3.108
  586   HG22  ILE 111          HG22      ILE 111  15.884   0.295  -3.809
  587   HG23  ILE 111          HG23      ILE 111  16.750   1.490  -4.766
  588   HD11  ILE 111          HD11      ILE 111  13.640   3.235  -6.090
  589   HD12  ILE 111          HD12      ILE 111  15.202   3.837  -5.520
  590   HD13  ILE 111          HD13      ILE 111  15.067   2.182  -6.156
  591    H    LEU 112           H        LEU 112  15.731   4.606  -1.809
  592    HA   LEU 112           HA       LEU 112  14.954   6.556  -1.094
  593    HB2  LEU 112           HB2      LEU 112  12.368   5.207  -1.816
  594    HB3  LEU 112           HB3      LEU 112  12.324   6.757  -1.027
  595    HG   LEU 112           HG       LEU 112  12.052   7.144  -3.283
  596   HD11  LEU 112          HD11      LEU 112  14.887   8.015  -2.737
  597   HD12  LEU 112          HD12      LEU 112  13.460   8.718  -1.932
  598   HD13  LEU 112          HD13      LEU 112  13.625   8.824  -3.692
  599   HD21  LEU 112          HD21      LEU 112  13.025   5.223  -4.340
  600   HD22  LEU 112          HD22      LEU 112  14.673   5.709  -3.845
  601   HD23  LEU 112          HD23      LEU 112  13.757   6.673  -5.016
  602    H    LYS 113           H        LYS 113  15.596   4.515   0.986
  603    HA   LYS 113           HA       LYS 113  13.779   4.836   3.152
  604    HB2  LYS 113           HB2      LYS 113  16.769   4.240   3.069
  605    HB3  LYS 113           HB3      LYS 113  15.859   4.324   4.563
  606    HG2  LYS 113           HG2      LYS 113  14.316   2.533   3.697
  607    HG3  LYS 113           HG3      LYS 113  15.313   2.390   2.254
  608    HD2  LYS 113           HD2      LYS 113  15.795   0.642   3.991
  609    HD3  LYS 113           HD3      LYS 113  17.202   1.601   3.527
  610    HE2  LYS 113           HE2      LYS 113  17.113   1.195   5.976
  611    HE3  LYS 113           HE3      LYS 113  17.110   2.899   5.559
  612    HZ1  LYS 113           HZ1      LYS 113  14.852   1.300   6.571
  613    HZ2  LYS 113           HZ2      LYS 113  14.607   2.779   5.824
  614    HZ3  LYS 113           HZ3      LYS 113  15.501   2.686   7.158
  615    H    VAL 114           H        VAL 114  14.142   5.977   5.148
  616    HA   VAL 114           HA       VAL 114  15.254   8.715   4.798
  617    HB   VAL 114           HB       VAL 114  12.899   7.783   6.496
  618   HG11  VAL 114          HG11      VAL 114  12.476  10.185   6.860
  619   HG12  VAL 114          HG12      VAL 114  14.079   9.748   7.465
  620   HG13  VAL 114          HG13      VAL 114  13.922  10.605   5.921
  621   HG21  VAL 114          HG21      VAL 114  12.283   7.743   4.110
  622   HG22  VAL 114          HG22      VAL 114  11.492   9.082   4.946
  623   HG23  VAL 114          HG23      VAL 114  12.911   9.399   3.924
  624    H    TRP 115           H        TRP 115  17.238   8.493   5.664
  625    HA   TRP 115           HA       TRP 115  18.947   7.773   6.961
  626    HB2  TRP 115           HB2      TRP 115  17.231   9.752   8.295
  627    HB3  TRP 115           HB3      TRP 115  18.256   8.907   9.422
  628    HD1  TRP 115           HD1      TRP 115  18.851  10.551   5.968
  629    HE1  TRP 115           HE1      TRP 115  21.131  11.772   6.025
  630    HE3  TRP 115           HE3      TRP 115  20.212   9.531  10.799
  631    HZ2  TRP 115           HZ2      TRP 115  23.293  12.123   7.872
  632    HZ3  TRP 115           HZ3      TRP 115  22.383  10.333  11.681
  633    HH2  TRP 115           HH2      TRP 115  23.943  11.606  10.224
  Start of MODEL    5
    1    H1   MET   1           H        MET   1 -19.649   2.418   8.162
    2    HA   MET   1           HA       MET   1 -18.402   3.385   9.940
    3    HB2  MET   1           HB2      MET   1 -16.470   2.098   7.953
    4    HB3  MET   1           HB3      MET   1 -16.162   2.376   9.664
    5    HG2  MET   1           HG2      MET   1 -16.815   0.113   9.534
    6    HG3  MET   1           HG3      MET   1 -18.182   0.976  10.211
    7    HE1  MET   1           HE1      MET   1 -16.884  -1.321   7.285
    8    HE2  MET   1           HE2      MET   1 -17.985  -0.896   5.959
    9    HE3  MET   1           HE3      MET   1 -16.807   0.295   6.550
   10    H    LYS   2           H        LYS   2 -17.522   5.269  10.589
   11    HA   LYS   2           HA       LYS   2 -17.172   7.434   8.818
   12    HB2  LYS   2           HB2      LYS   2 -16.401   6.955  11.706
   13    HB3  LYS   2           HB3      LYS   2 -16.194   8.522  10.963
   14    HG2  LYS   2           HG2      LYS   2 -18.944   7.236  10.867
   15    HG3  LYS   2           HG3      LYS   2 -18.337   7.907  12.369
   16    HD2  LYS   2           HD2      LYS   2 -19.528   9.676  11.483
   17    HD3  LYS   2           HD3      LYS   2 -17.858  10.076  11.089
   18    HE2  LYS   2           HE2      LYS   2 -18.327   9.028   8.769
   19    HE3  LYS   2           HE3      LYS   2 -20.033   8.970   9.260
   20    HZ1  LYS   2           HZ1      LYS   2 -19.813  11.441   9.631
   21    HZ2  LYS   2           HZ2      LYS   2 -19.633  11.010   8.072
   22    HZ3  LYS   2           HZ3      LYS   2 -18.322  11.364   8.962
   23    H    VAL   3           H        VAL   3 -14.971   4.988   8.820
   24    HA   VAL   3           HA       VAL   3 -12.638   6.774   8.497
   25    HB   VAL   3           HB       VAL   3 -12.233   5.191  10.145
   26   HG11  VAL   3          HG11      VAL   3 -13.115   2.931   8.326
   27   HG12  VAL   3          HG12      VAL   3 -12.328   2.762   9.901
   28   HG13  VAL   3          HG13      VAL   3 -13.922   3.496   9.809
   29   HG21  VAL   3          HG21      VAL   3 -10.399   5.622   8.537
   30   HG22  VAL   3          HG22      VAL   3 -10.278   4.060   9.359
   31   HG23  VAL   3          HG23      VAL   3 -10.834   4.127   7.678
   32    HA   PRO   4           HA       PRO   4 -13.863   5.728   4.162
   33    HB2  PRO   4           HB2      PRO   4 -13.146   8.041   2.934
   34    HB3  PRO   4           HB3      PRO   4 -14.625   7.940   3.939
   35    HG2  PRO   4           HG2      PRO   4 -11.869   8.906   4.798
   36    HG3  PRO   4           HG3      PRO   4 -13.418   9.781   4.959
   37    HD2  PRO   4           HD2      PRO   4 -12.421   8.306   7.009
   38    HD3  PRO   4           HD3      PRO   4 -14.175   8.315   6.647
   39    H    GLY   5           H        GLY   5 -12.331   5.830   2.040
   40    HA2  GLY   5           HA2      GLY   5  -9.880   4.669   2.869
   41    HA3  GLY   5           HA3      GLY   5 -10.384   4.974   1.205
   42    H    VAL   6           H        VAL   6  -7.693   5.347   2.137
   43    HA   VAL   6           HA       VAL   6  -7.393   8.337   2.079
   44    HB   VAL   6           HB       VAL   6  -5.077   7.835   2.869
   45   HG11  VAL   6          HG11      VAL   6  -6.881   8.867   4.250
   46   HG12  VAL   6          HG12      VAL   6  -7.342   7.238   4.808
   47   HG13  VAL   6          HG13      VAL   6  -5.747   7.897   5.220
   48   HG21  VAL   6          HG21      VAL   6  -4.983   5.394   2.622
   49   HG22  VAL   6          HG22      VAL   6  -4.706   5.880   4.294
   50   HG23  VAL   6          HG23      VAL   6  -6.291   5.226   3.828
   51    H    ARG   7           H        ARG   7  -6.436   9.150   0.273
   52    HA   ARG   7           HA       ARG   7  -5.786   7.193  -1.822
   53    HB2  ARG   7           HB2      ARG   7  -5.938   8.866  -3.346
   54    HB3  ARG   7           HB3      ARG   7  -7.138   9.361  -2.184
   55    HG2  ARG   7           HG2      ARG   7  -4.338  10.542  -2.504
   56    HG3  ARG   7           HG3      ARG   7  -5.821  11.227  -3.093
   57    HD2  ARG   7           HD2      ARG   7  -5.024  10.919  -0.203
   58    HD3  ARG   7           HD3      ARG   7  -5.097  12.409  -1.147
   59    HE   ARG   7           HE       ARG   7  -7.606  11.645  -1.439
   60   HH11  ARG   7          HH11      ARG   7  -5.634  11.668   1.481
   61   HH12  ARG   7          HH12      ARG   7  -6.924  11.849   2.616
   62   HH21  ARG   7          HH21      ARG   7  -9.348  12.163  -0.019
   63   HH22  ARG   7          HH22      ARG   7  -9.137  12.220   1.693
   64    H    VAL   8           H        VAL   8  -3.750   6.512  -2.220
   65    HA   VAL   8           HA       VAL   8  -1.478   8.085  -1.204
   66    HB   VAL   8           HB       VAL   8  -0.382   6.192  -0.224
   67   HG11  VAL   8          HG11      VAL   8  -1.961   7.388   1.277
   68   HG12  VAL   8          HG12      VAL   8  -3.251   6.261   0.841
   69   HG13  VAL   8          HG13      VAL   8  -1.820   5.689   1.700
   70   HG21  VAL   8          HG21      VAL   8  -1.029   4.397  -1.635
   71   HG22  VAL   8          HG22      VAL   8  -1.578   3.988  -0.006
   72   HG23  VAL   8          HG23      VAL   8  -2.743   4.577  -1.227
   73    H    ARG   9           H        ARG   9   0.519   7.536  -2.430
   74    HA   ARG   9           HA       ARG   9  -0.163   6.455  -5.132
   75    HB2  ARG   9           HB2      ARG   9   0.058   8.996  -4.785
   76    HB3  ARG   9           HB3      ARG   9   1.785   8.732  -4.580
   77    HG2  ARG   9           HG2      ARG   9   0.219   7.717  -7.000
   78    HG3  ARG   9           HG3      ARG   9   0.785   9.366  -6.905
   79    HD2  ARG   9           HD2      ARG   9   2.924   7.458  -6.254
   80    HD3  ARG   9           HD3      ARG   9   2.202   7.144  -7.836
   81    HE   ARG   9           HE       ARG   9   2.608   9.865  -7.838
   82   HH11  ARG   9          HH11      ARG   9   4.698   7.017  -7.398
   83   HH12  ARG   9          HH12      ARG   9   6.122   7.742  -8.021
   84   HH21  ARG   9          HH21      ARG   9   4.548  10.905  -8.730
   85   HH22  ARG   9          HH22      ARG   9   6.011   9.994  -8.812
   86    H    ALA  10           H        ALA  10   1.214   5.044  -6.004
   87    HA   ALA  10           HA       ALA  10   3.063   3.694  -4.233
   88    HB1  ALA  10           HB1      ALA  10   3.373   2.257  -6.223
   89    HB2  ALA  10           HB2      ALA  10   1.660   2.466  -5.796
   90    HB3  ALA  10           HB3      ALA  10   2.351   3.355  -7.177
   91    H    LEU  11           H        LEU  11   5.116   4.252  -3.941
   92    HA   LEU  11           HA       LEU  11   6.438   6.193  -5.715
   93    HB2  LEU  11           HB2      LEU  11   7.412   4.799  -3.198
   94    HB3  LEU  11           HB3      LEU  11   8.239   6.102  -4.041
   95    HG   LEU  11           HG       LEU  11   5.573   6.302  -2.574
   96   HD11  LEU  11          HD11      LEU  11   8.372   7.380  -2.004
   97   HD12  LEU  11          HD12      LEU  11   7.502   6.124  -1.101
   98   HD13  LEU  11          HD13      LEU  11   6.926   7.796  -1.082
   99   HD21  LEU  11          HD21      LEU  11   7.129   8.444  -4.098
  100   HD22  LEU  11          HD22      LEU  11   5.781   8.758  -2.982
  101   HD23  LEU  11          HD23      LEU  11   5.493   7.850  -4.467
  102    H    TYR  12           H        TYR  12   6.178   2.788  -5.600
  103    HA   TYR  12           HA       TYR  12   8.334   2.430  -7.500
  104    HB2  TYR  12           HB2      TYR  12   8.507   0.262  -5.552
  105    HB3  TYR  12           HB3      TYR  12   9.750   1.209  -6.313
  106    HD1  TYR  12           HD1      TYR  12   7.225   1.354  -3.608
  107    HD2  TYR  12           HD2      TYR  12  11.099   2.647  -4.922
  108    HE1  TYR  12           HE1      TYR  12   7.611   2.485  -1.378
  109    HE2  TYR  12           HE2      TYR  12  11.529   3.621  -2.674
  110    HH   TYR  12           HH       TYR  12  10.762   3.658  -0.418
  111    H    ASP  13           H        ASP  13   8.212  -0.033  -8.141
  112    HA   ASP  13           HA       ASP  13   5.367  -0.718  -8.650
  113    HB2  ASP  13           HB2      ASP  13   6.242  -1.768 -10.669
  114    HB3  ASP  13           HB3      ASP  13   6.707  -0.073 -10.547
  115    H    TYR  14           H        TYR  14   4.726  -2.226  -7.033
  116    HA   TYR  14           HA       TYR  14   6.086  -4.852  -7.084
  117    HB2  TYR  14           HB2      TYR  14   5.728  -3.074  -4.662
  118    HB3  TYR  14           HB3      TYR  14   5.458  -4.766  -4.485
  119    HD1  TYR  14           HD1      TYR  14   7.278  -6.122  -3.806
  120    HD2  TYR  14           HD2      TYR  14   8.064  -2.426  -5.896
  121    HE1  TYR  14           HE1      TYR  14   9.697  -6.554  -3.679
  122    HE2  TYR  14           HE2      TYR  14  10.480  -2.904  -5.863
  123    HH   TYR  14           HH       TYR  14  12.122  -4.624  -5.420
  124    H    THR  15           H        THR  15   4.638  -6.618  -6.312
  125    HA   THR  15           HA       THR  15   1.772  -5.830  -6.070
  126    HB   THR  15           HB       THR  15   1.998  -6.262  -8.394
  127    HG1  THR  15           HG1      THR  15   0.635  -8.198  -6.893
  128   HG21  THR  15          HG21      THR  15   3.291  -8.961  -7.890
  129   HG22  THR  15          HG22      THR  15   4.129  -7.516  -8.468
  130   HG23  THR  15          HG23      THR  15   2.832  -8.234  -9.436
  131    H    GLY  16           H        GLY  16   2.271  -6.126  -3.955
  132    HA2  GLY  16           HA2      GLY  16   2.560  -7.280  -1.969
  133    HA3  GLY  16           HA3      GLY  16   1.453  -8.389  -2.743
  134    H    GLN  17           H        GLN  17   2.384 -10.148  -1.660
  135    HA   GLN  17           HA       GLN  17   4.934 -11.109  -2.708
  136    HB2  GLN  17           HB2      GLN  17   5.181 -10.020  -0.376
  137    HB3  GLN  17           HB3      GLN  17   4.222 -11.366   0.208
  138    HG2  GLN  17           HG2      GLN  17   6.668 -11.682   0.528
  139    HG3  GLN  17           HG3      GLN  17   6.003 -12.950  -0.501
  140   HE21  GLN  17          HE21      GLN  17   6.825 -13.111  -2.714
  141   HE22  GLN  17          HE22      GLN  17   8.081 -12.041  -3.262
  142    H    GLU  18           H        GLU  18   1.732 -11.624  -2.888
  143    HA   GLU  18           HA       GLU  18   1.998 -14.570  -2.834
  144    HB2  GLU  18           HB2      GLU  18   1.126 -13.473  -0.648
  145    HB3  GLU  18           HB3      GLU  18  -0.270 -12.955  -1.559
  146    HG2  GLU  18           HG2      GLU  18  -0.968 -15.297  -1.880
  147    HG3  GLU  18           HG3      GLU  18   0.526 -15.857  -1.124
  148    H    ALA  19           H        ALA  19  -0.426 -15.275  -3.516
  149    HA   ALA  19           HA       ALA  19  -0.961 -14.150  -6.186
  150    HB1  ALA  19           HB1      ALA  19  -0.627 -16.604  -5.875
  151    HB2  ALA  19           HB2      ALA  19  -1.987 -16.651  -4.728
  152    HB3  ALA  19           HB3      ALA  19  -2.264 -16.229  -6.425
  153    H    ASP  20           H        ASP  20  -1.969 -13.529  -3.058
  154    HA   ASP  20           HA       ASP  20  -4.777 -12.837  -3.769
  155    HB2  ASP  20           HB2      ASP  20  -3.678 -14.187  -1.299
  156    HB3  ASP  20           HB3      ASP  20  -5.145 -13.233  -1.186
  157    H    GLU  21           H        GLU  21  -2.535 -11.074  -4.077
  158    HA   GLU  21           HA       GLU  21  -3.080  -8.958  -2.056
  159    HB2  GLU  21           HB2      GLU  21  -0.720  -8.217  -2.823
  160    HB3  GLU  21           HB3      GLU  21  -0.886  -9.543  -1.680
  161    HG2  GLU  21           HG2      GLU  21   0.794 -10.106  -3.450
  162    HG3  GLU  21           HG3      GLU  21  -0.546 -11.188  -3.353
  163    H    LEU  22           H        LEU  22  -2.434  -6.750  -3.122
  164    HA   LEU  22           HA       LEU  22  -3.912  -6.449  -5.687
  165    HB2  LEU  22           HB2      LEU  22  -3.133  -4.576  -3.420
  166    HB3  LEU  22           HB3      LEU  22  -3.601  -3.945  -4.998
  167    HG   LEU  22           HG       LEU  22  -5.307  -5.774  -3.316
  168   HD11  LEU  22          HD11      LEU  22  -5.447  -2.765  -3.611
  169   HD12  LEU  22          HD12      LEU  22  -5.063  -3.684  -2.158
  170   HD13  LEU  22          HD13      LEU  22  -6.685  -3.772  -2.858
  171   HD21  LEU  22          HD21      LEU  22  -5.703  -4.539  -6.021
  172   HD22  LEU  22          HD22      LEU  22  -7.104  -4.749  -4.958
  173   HD23  LEU  22          HD23      LEU  22  -6.127  -6.144  -5.430
  174    H    SER  23           H        SER  23  -2.904  -5.386  -7.423
  175    HA   SER  23           HA       SER  23   0.036  -5.292  -7.276
  176    HB2  SER  23           HB2      SER  23  -0.263  -5.587  -9.749
  177    HB3  SER  23           HB3      SER  23  -0.939  -6.914  -8.795
  178    HG   SER  23           HG       SER  23  -2.268  -6.301 -10.464
  179    H    PHE  24           H        PHE  24   1.050  -3.224  -7.513
  180    HA   PHE  24           HA       PHE  24  -0.661  -1.172  -8.790
  181    HB2  PHE  24           HB2      PHE  24  -0.150   0.473  -7.141
  182    HB3  PHE  24           HB3      PHE  24  -1.141  -0.836  -6.527
  183    HD1  PHE  24           HD1      PHE  24   2.396   0.322  -6.720
  184    HD2  PHE  24           HD2      PHE  24  -0.522  -1.910  -4.442
  185    HE1  PHE  24           HE1      PHE  24   3.872   0.389  -4.757
  186    HE2  PHE  24           HE2      PHE  24   1.033  -1.879  -2.505
  187    HZ   PHE  24           HZ       PHE  24   3.197  -0.723  -2.660
  188    H    LYS  25           H        LYS  25   0.441   0.106 -10.151
  189    HA   LYS  25           HA       LYS  25   3.283  -0.640 -10.629
  190    HB2  LYS  25           HB2      LYS  25   0.987   0.277 -12.278
  191    HB3  LYS  25           HB3      LYS  25   2.453   1.172 -12.614
  192    HG2  LYS  25           HG2      LYS  25   2.510  -0.699 -14.084
  193    HG3  LYS  25           HG3      LYS  25   3.686  -1.022 -12.816
  194    HD2  LYS  25           HD2      LYS  25   1.684  -2.375 -11.690
  195    HD3  LYS  25           HD3      LYS  25   1.029  -2.334 -13.342
  196    HE2  LYS  25           HE2      LYS  25   3.495  -3.105 -13.979
  197    HE3  LYS  25           HE3      LYS  25   3.584  -3.586 -12.278
  198    HZ1  LYS  25           HZ1      LYS  25   1.466  -4.874 -12.825
  199    HZ2  LYS  25           HZ2      LYS  25   2.895  -5.448 -13.485
  200    HZ3  LYS  25           HZ3      LYS  25   1.829  -4.571 -14.394
  201    H    ALA  26           H        ALA  26   4.923   1.064 -11.075
  202    HA   ALA  26           HA       ALA  26   4.956   3.004  -8.961
  203    HB1  ALA  26           HB1      ALA  26   7.059   2.150  -9.930
  204    HB2  ALA  26           HB2      ALA  26   6.641   2.851 -11.510
  205    HB3  ALA  26           HB3      ALA  26   6.965   3.906 -10.123
  206    H    GLY  27           H        GLY  27   3.759   4.837  -8.883
  207    HA2  GLY  27           HA2      GLY  27   3.235   7.025  -9.777
  208    HA3  GLY  27           HA3      GLY  27   3.109   6.337 -11.388
  209    H    GLU  28           H        GLU  28   1.663   3.958  -9.750
  210    HA   GLU  28           HA       GLU  28  -0.989   4.863 -10.399
  211    HB2  GLU  28           HB2      GLU  28  -0.093   2.581 -10.802
  212    HB3  GLU  28           HB3      GLU  28  -0.036   2.294  -9.055
  213    HG2  GLU  28           HG2      GLU  28  -2.333   2.142  -8.854
  214    HG3  GLU  28           HG3      GLU  28  -2.649   3.167 -10.259
  215    H    GLU  29           H        GLU  29  -2.773   4.675  -8.874
  216    HA   GLU  29           HA       GLU  29  -2.097   5.569  -6.121
  217    HB2  GLU  29           HB2      GLU  29  -4.383   6.289  -7.974
  218    HB3  GLU  29           HB3      GLU  29  -4.379   6.643  -6.241
  219    HG2  GLU  29           HG2      GLU  29  -2.279   7.995  -6.587
  220    HG3  GLU  29           HG3      GLU  29  -2.525   7.812  -8.341
  221    H    LEU  30           H        LEU  30  -3.790   4.962  -4.543
  222    HA   LEU  30           HA       LEU  30  -5.596   2.795  -5.171
  223    HB2  LEU  30           HB2      LEU  30  -4.523   1.398  -3.279
  224    HB3  LEU  30           HB3      LEU  30  -3.774   1.297  -4.892
  225    HG   LEU  30           HG       LEU  30  -2.601   3.412  -3.162
  226   HD11  LEU  30          HD11      LEU  30  -3.163   1.837  -1.387
  227   HD12  LEU  30          HD12      LEU  30  -1.414   1.901  -1.662
  228   HD13  LEU  30          HD13      LEU  30  -2.342   0.526  -2.261
  229   HD21  LEU  30          HD21      LEU  30  -0.518   2.544  -3.974
  230   HD22  LEU  30          HD22      LEU  30  -1.632   2.555  -5.334
  231   HD23  LEU  30          HD23      LEU  30  -1.271   1.029  -4.514
  232    H    MET  31           H        MET  31  -6.966   2.336  -3.270
  233    HA   MET  31           HA       MET  31  -6.830   4.472  -1.204
  234    HB2  MET  31           HB2      MET  31  -9.492   3.305  -2.030
  235    HB3  MET  31           HB3      MET  31  -9.090   4.806  -1.209
  236    HG2  MET  31           HG2      MET  31  -7.858   5.438  -3.409
  237    HG3  MET  31           HG3      MET  31  -8.794   4.146  -4.144
  238    HE1  MET  31           HE1      MET  31 -10.063   8.358  -2.978
  239    HE2  MET  31           HE2      MET  31  -9.004   7.377  -1.938
  240    HE3  MET  31           HE3      MET  31  -8.504   7.776  -3.599
  241    H    LYS  32           H        LYS  32  -6.209   3.558   0.666
  242    HA   LYS  32           HA       LYS  32  -6.519   0.741   1.213
  243    HB2  LYS  32           HB2      LYS  32  -4.809   1.917   2.263
  244    HB3  LYS  32           HB3      LYS  32  -5.882   3.195   2.866
  245    HG2  LYS  32           HG2      LYS  32  -6.959   1.565   4.411
  246    HG3  LYS  32           HG3      LYS  32  -5.896   0.323   3.753
  247    HD2  LYS  32           HD2      LYS  32  -4.786   0.985   5.769
  248    HD3  LYS  32           HD3      LYS  32  -3.915   1.770   4.460
  249    HE2  LYS  32           HE2      LYS  32  -5.510   3.780   4.888
  250    HE3  LYS  32           HE3      LYS  32  -5.915   2.979   6.406
  251    HZ1  LYS  32           HZ1      LYS  32  -3.690   3.119   7.113
  252    HZ2  LYS  32           HZ2      LYS  32  -4.075   4.615   6.596
  253    HZ3  LYS  32           HZ3      LYS  32  -3.117   3.639   5.660
  254    H    ILE  33           H        ILE  33  -8.125  -0.323   2.429
  255    HA   ILE  33           HA       ILE  33 -10.311   1.370   3.436
  256    HB   ILE  33           HB       ILE  33 -11.946  -0.087   2.543
  257   HG12  ILE  33          HG12      ILE  33 -10.462  -1.587   0.530
  258   HG13  ILE  33          HG13      ILE  33  -9.826  -1.981   2.124
  259   HG21  ILE  33          HG21      ILE  33 -11.821   0.468   0.156
  260   HG22  ILE  33          HG22      ILE  33 -11.284   1.834   1.149
  261   HG23  ILE  33          HG23      ILE  33 -10.113   0.826   0.288
  262   HD11  ILE  33          HD11      ILE  33 -12.068  -2.615   2.888
  263   HD12  ILE  33          HD12      ILE  33 -12.742  -2.173   1.295
  264   HD13  ILE  33          HD13      ILE  33 -11.581  -3.513   1.432
  265    H    SER  34           H        SER  34  -8.013  -0.463   4.525
  266    HA   SER  34           HA       SER  34  -9.537  -1.513   6.771
  267    HB2  SER  34           HB2      SER  34  -9.170  -3.341   4.984
  268    HB3  SER  34           HB3      SER  34  -7.436  -3.203   5.368
  269    HG   SER  34           HG       SER  34  -9.580  -3.834   7.134
  270    H    GLU  35           H        GLU  35  -7.460  -2.445   8.238
  271    HA   GLU  35           HA       GLU  35  -5.822  -0.005   8.611
  272    HB2  GLU  35           HB2      GLU  35  -5.566  -0.823  10.877
  273    HB3  GLU  35           HB3      GLU  35  -7.275  -0.967  10.450
  274    HG2  GLU  35           HG2      GLU  35  -6.649  -3.411   9.704
  275    HG3  GLU  35           HG3      GLU  35  -5.174  -3.158  10.640
  276    H    GLU  36           H        GLU  36  -3.579  -0.347   9.368
  277    HA   GLU  36           HA       GLU  36  -2.116  -2.109   7.627
  278    HB2  GLU  36           HB2      GLU  36  -1.554   0.319   8.152
  279    HB3  GLU  36           HB3      GLU  36  -1.162  -0.206   9.793
  280    HG2  GLU  36           HG2      GLU  36   0.484  -1.854   8.760
  281    HG3  GLU  36           HG3      GLU  36   0.175  -1.102   7.194
  282    H    ASP  37           H        ASP  37  -1.151  -3.997   8.340
  283    HA   ASP  37           HA       ASP  37  -1.545  -4.856  11.168
  284    HB2  ASP  37           HB2      ASP  37  -2.821  -6.051   9.526
  285    HB3  ASP  37           HB3      ASP  37  -1.397  -6.472   8.627
  286    H    GLU  38           H        GLU  38   0.287  -6.681  11.661
  287    HA   GLU  38           HA       GLU  38   2.537  -5.270  12.274
  288    HB2  GLU  38           HB2      GLU  38   1.479  -7.500  13.150
  289    HB3  GLU  38           HB3      GLU  38   2.667  -8.279  12.110
  290    HG2  GLU  38           HG2      GLU  38   4.494  -7.411  13.354
  291    HG3  GLU  38           HG3      GLU  38   3.527  -6.071  13.999
  292    H    GLN  39           H        GLN  39   2.211  -6.716   9.148
  293    HA   GLN  39           HA       GLN  39   5.148  -6.464   8.690
  294    HB2  GLN  39           HB2      GLN  39   3.163  -8.444   7.848
  295    HB3  GLN  39           HB3      GLN  39   3.855  -7.684   6.454
  296    HG2  GLN  39           HG2      GLN  39   5.180  -9.431   8.512
  297    HG3  GLN  39           HG3      GLN  39   5.150  -9.581   6.774
  298   HE21  GLN  39          HE21      GLN  39   7.046  -8.397   9.423
  299   HE22  GLN  39          HE22      GLN  39   8.172  -7.465   8.463
  300    H    GLY  40           H        GLY  40   2.704  -4.443   8.766
  301    HA2  GLY  40           HA2      GLY  40   2.379  -2.418   7.728
  302    HA3  GLY  40           HA3      GLY  40   3.707  -2.782   6.609
  303    H    TRP  41           H        TRP  41   0.936  -5.007   7.104
  304    HA   TRP  41           HA       TRP  41   0.402  -4.812   4.196
  305    HB2  TRP  41           HB2      TRP  41  -0.613  -6.634   6.402
  306    HB3  TRP  41           HB3      TRP  41  -1.448  -6.496   4.949
  307    HD1  TRP  41           HD1      TRP  41   0.956  -8.880   6.129
  308    HE1  TRP  41           HE1      TRP  41   1.973 -10.098   4.221
  309    HE3  TRP  41           HE3      TRP  41  -0.467  -5.755   2.379
  310    HZ2  TRP  41           HZ2      TRP  41   2.117  -9.875   1.376
  311    HZ3  TRP  41           HZ3      TRP  41  -0.054  -6.399   0.048
  312    HH2  TRP  41           HH2      TRP  41   1.128  -8.426  -0.511
  313    H    CYS  42           H        CYS  42  -1.315  -3.687   3.310
  314    HA   CYS  42           HA       CYS  42  -3.480  -2.820   5.211
  315    HB2  CYS  42           HB2      CYS  42  -1.893  -1.269   3.152
  316    HB3  CYS  42           HB3      CYS  42  -3.573  -0.832   3.513
  317    HG   CYS  42           HG       CYS  42  -1.901   0.755   4.828
  318    H    LYS  43           H        LYS  43  -5.464  -3.497   4.531
  319    HA   LYS  43           HA       LYS  43  -5.668  -4.684   1.833
  320    HB2  LYS  43           HB2      LYS  43  -6.809  -5.330   4.309
  321    HB3  LYS  43           HB3      LYS  43  -8.142  -4.567   3.443
  322    HG2  LYS  43           HG2      LYS  43  -6.478  -6.693   2.057
  323    HG3  LYS  43           HG3      LYS  43  -7.640  -7.152   3.294
  324    HD2  LYS  43           HD2      LYS  43  -9.454  -5.995   2.027
  325    HD3  LYS  43           HD3      LYS  43  -8.294  -5.628   0.727
  326    HE2  LYS  43           HE2      LYS  43  -7.782  -8.013   0.465
  327    HE3  LYS  43           HE3      LYS  43  -8.734  -8.419   1.875
  328    HZ1  LYS  43           HZ1      LYS  43  -9.867  -8.910  -0.171
  329    HZ2  LYS  43           HZ2      LYS  43  -9.954  -7.318  -0.576
  330    HZ3  LYS  43           HZ3      LYS  43 -10.726  -7.909   0.771
  331    H    GLY  44           H        GLY  44  -6.672  -3.600   0.103
  332    HA2  GLY  44           HA2      GLY  44  -8.206  -1.163   0.723
  333    HA3  GLY  44           HA3      GLY  44  -6.755  -0.922  -0.187
  334    H    ARG  45           H        ARG  45  -8.420  -0.052  -1.659
  335    HA   ARG  45           HA       ARG  45  -9.450  -2.089  -3.481
  336    HB2  ARG  45           HB2      ARG  45 -11.213  -1.185  -1.835
  337    HB3  ARG  45           HB3      ARG  45 -11.110   0.343  -2.691
  338    HG2  ARG  45           HG2      ARG  45 -11.504  -2.101  -4.392
  339    HG3  ARG  45           HG3      ARG  45 -12.795  -1.789  -3.249
  340    HD2  ARG  45           HD2      ARG  45 -11.822   0.141  -5.372
  341    HD3  ARG  45           HD3      ARG  45 -13.260  -0.869  -5.458
  342    HE   ARG  45           HE       ARG  45 -12.940   1.622  -4.031
  343   HH11  ARG  45          HH11      ARG  45 -14.941  -1.356  -4.249
  344   HH12  ARG  45          HH12      ARG  45 -16.331  -0.547  -3.602
  345   HH21  ARG  45          HH21      ARG  45 -14.817   2.585  -3.193
  346   HH22  ARG  45          HH22      ARG  45 -16.209   1.625  -2.812
  347    H    LEU  46           H        LEU  46  -8.622  -1.712  -5.391
  348    HA   LEU  46           HA       LEU  46  -6.984   0.580  -6.056
  349    HB2  LEU  46           HB2      LEU  46  -7.793  -2.050  -7.211
  350    HB3  LEU  46           HB3      LEU  46  -7.653  -0.797  -8.417
  351    HG   LEU  46           HG       LEU  46  -5.316  -0.382  -7.822
  352   HD11  LEU  46          HD11      LEU  46  -5.230  -0.746  -5.485
  353   HD12  LEU  46          HD12      LEU  46  -4.219  -2.003  -6.247
  354   HD13  LEU  46          HD13      LEU  46  -5.864  -2.392  -5.669
  355   HD21  LEU  46          HD21      LEU  46  -5.890  -2.162  -9.449
  356   HD22  LEU  46          HD22      LEU  46  -5.911  -3.359  -8.136
  357   HD23  LEU  46          HD23      LEU  46  -4.414  -2.515  -8.572
  358    H    LEU  47           H        LEU  47  -7.389   1.915  -8.083
  359    HA   LEU  47           HA       LEU  47  -9.978   3.173  -7.924
  360    HB2  LEU  47           HB2      LEU  47  -9.245   4.497  -9.870
  361    HB3  LEU  47           HB3      LEU  47  -8.139   4.564  -8.519
  362    HG   LEU  47           HG       LEU  47  -7.471   2.386 -10.391
  363   HD11  LEU  47          HD11      LEU  47  -7.436   5.215 -11.469
  364   HD12  LEU  47          HD12      LEU  47  -8.344   3.799 -12.094
  365   HD13  LEU  47          HD13      LEU  47  -6.579   3.826 -12.192
  366   HD21  LEU  47          HD21      LEU  47  -5.225   3.317 -10.186
  367   HD22  LEU  47          HD22      LEU  47  -5.989   3.166  -8.600
  368   HD23  LEU  47          HD23      LEU  47  -5.887   4.755  -9.370
  369    H    THR  48           H        THR  48  -8.882   0.401  -9.668
  370    HA   THR  48           HA       THR  48 -10.998   0.611 -11.703
  371    HB   THR  48           HB       THR  48  -8.839  -0.142 -12.456
  372    HG1  THR  48           HG1      THR  48 -10.746  -1.150 -13.275
  373   HG21  THR  48          HG21      THR  48  -9.048  -2.430 -10.453
  374   HG22  THR  48          HG22      THR  48  -7.815  -1.141 -10.515
  375   HG23  THR  48          HG23      THR  48  -7.894  -2.332 -11.797
  376    H    GLY  49           H        GLY  49 -10.785  -0.392  -8.461
  377    HA2  GLY  49           HA2      GLY  49 -12.808  -1.030  -7.384
  378    HA3  GLY  49           HA3      GLY  49 -13.257  -2.011  -8.757
  379    H    HIS  50           H        HIS  50 -10.187  -2.919  -8.658
  380    HA   HIS  50           HA       HIS  50 -10.595  -5.475  -7.637
  381    HB2  HIS  50           HB2      HIS  50  -8.315  -3.747  -8.521
  382    HB3  HIS  50           HB3      HIS  50  -7.872  -5.000  -7.391
  383    HD1  HIS  50           HD1      HIS  50  -9.989  -5.142 -10.760
  384    HD2  HIS  50           HD2      HIS  50  -6.728  -6.754  -8.608
  385    HE1  HIS  50           HE1      HIS  50  -8.971  -6.877 -12.234
  386    H    VAL  51           H        VAL  51 -10.095  -6.466  -5.630
  387    HA   VAL  51           HA       VAL  51  -9.195  -4.649  -3.456
  388    HB   VAL  51           HB       VAL  51 -10.657  -5.994  -1.906
  389   HG11  VAL  51          HG11      VAL  51 -12.127  -4.430  -4.056
  390   HG12  VAL  51          HG12      VAL  51 -12.725  -4.795  -2.428
  391   HG13  VAL  51          HG13      VAL  51 -11.302  -3.764  -2.620
  392   HG21  VAL  51          HG21      VAL  51 -11.082  -7.988  -3.349
  393   HG22  VAL  51          HG22      VAL  51 -12.564  -7.235  -2.775
  394   HG23  VAL  51          HG23      VAL  51 -12.041  -6.972  -4.441
  395    H    GLY  52           H        GLY  52  -7.723  -5.539  -1.869
  396    HA2  GLY  52           HA2      GLY  52  -7.179  -8.213  -1.357
  397    HA3  GLY  52           HA3      GLY  52  -6.134  -7.736  -2.695
  398    H    LEU  53           H        LEU  53  -4.559  -8.212  -0.763
  399    HA   LEU  53           HA       LEU  53  -4.197  -5.985   1.156
  400    HB2  LEU  53           HB2      LEU  53  -2.865  -8.667   0.604
  401    HB3  LEU  53           HB3      LEU  53  -2.197  -7.531   1.749
  402    HG   LEU  53           HG       LEU  53  -5.047  -8.459   2.047
  403   HD11  LEU  53          HD11      LEU  53  -4.217 -10.208   3.533
  404   HD12  LEU  53          HD12      LEU  53  -2.517  -9.735   3.229
  405   HD13  LEU  53          HD13      LEU  53  -3.522 -10.431   1.937
  406   HD21  LEU  53          HD21      LEU  53  -4.838  -7.825   4.326
  407   HD22  LEU  53          HD22      LEU  53  -4.252  -6.459   3.371
  408   HD23  LEU  53          HD23      LEU  53  -3.097  -7.548   4.160
  409    H    TYR  54           H        TYR  54  -2.504  -4.436   0.884
  410    HA   TYR  54           HA       TYR  54  -0.685  -4.776  -1.420
  411    HB2  TYR  54           HB2      TYR  54  -0.916  -2.606  -2.127
  412    HB3  TYR  54           HB3      TYR  54  -2.549  -3.099  -1.909
  413    HD1  TYR  54           HD1      TYR  54  -3.938  -2.084  -0.129
  414    HD2  TYR  54           HD2      TYR  54   0.204  -0.981  -0.594
  415    HE1  TYR  54           HE1      TYR  54  -4.309  -0.098   1.303
  416    HE2  TYR  54           HE2      TYR  54  -0.150   0.957   0.850
  417    HH   TYR  54           HH       TYR  54  -1.610   2.010   2.374
  418    HA   PRO  55           HA       PRO  55   1.990  -4.154   2.060
  419    HB2  PRO  55           HB2      PRO  55   4.422  -3.833   0.916
  420    HB3  PRO  55           HB3      PRO  55   3.534  -5.376   0.916
  421    HG2  PRO  55           HG2      PRO  55   3.741  -3.366  -1.325
  422    HG3  PRO  55           HG3      PRO  55   3.882  -5.147  -1.413
  423    HD2  PRO  55           HD2      PRO  55   1.525  -3.834  -2.000
  424    HD3  PRO  55           HD3      PRO  55   1.584  -5.456  -1.288
  425    H    ALA  56           H        ALA  56   1.500  -2.323   3.162
  426    HA   ALA  56           HA       ALA  56   1.304   0.279   2.082
  427    HB1  ALA  56           HB1      ALA  56   0.937   1.004   4.327
  428    HB2  ALA  56           HB2      ALA  56   0.238  -0.621   4.232
  429    HB3  ALA  56           HB3      ALA  56   1.806  -0.372   5.013
  430    H    ASN  57           H        ASN  57   4.016  -1.508   3.375
  431    HA   ASN  57           HA       ASN  57   5.787   0.659   3.878
  432    HB2  ASN  57           HB2      ASN  57   6.316  -2.223   3.034
  433    HB3  ASN  57           HB3      ASN  57   7.532  -1.123   3.641
  434   HD21  ASN  57          HD21      ASN  57   6.903  -3.658   4.797
  435   HD22  ASN  57          HD22      ASN  57   6.279  -3.375   6.406
  436    H    TYR  58           H        TYR  58   4.498  -0.348   0.850
  437    HA   TYR  58           HA       TYR  58   6.840   0.626  -0.665
  438    HB2  TYR  58           HB2      TYR  58   4.714  -1.396  -1.271
  439    HB3  TYR  58           HB3      TYR  58   5.644  -0.641  -2.544
  440    HD1  TYR  58           HD1      TYR  58   6.080  -2.505   0.671
  441    HD2  TYR  58           HD2      TYR  58   7.734  -1.581  -3.196
  442    HE1  TYR  58           HE1      TYR  58   7.986  -3.962   1.146
  443    HE2  TYR  58           HE2      TYR  58   9.670  -2.995  -2.712
  444    HH   TYR  58           HH       TYR  58  10.789  -4.329  -1.091
  445    H    VAL  59           H        VAL  59   4.291   2.192   0.571
  446    HA   VAL  59           HA       VAL  59   4.048   3.910  -1.831
  447    HB   VAL  59           HB       VAL  59   1.674   4.042  -1.788
  448   HG11  VAL  59          HG11      VAL  59   2.514   1.999  -2.950
  449   HG12  VAL  59          HG12      VAL  59   2.216   1.066  -1.461
  450   HG13  VAL  59          HG13      VAL  59   0.876   1.823  -2.327
  451   HG21  VAL  59          HG21      VAL  59   0.260   2.752  -0.225
  452   HG22  VAL  59          HG22      VAL  59   1.709   2.305   0.708
  453   HG23  VAL  59          HG23      VAL  59   1.189   4.000   0.587
  454    H    GLU  60           H        GLU  60   2.885   6.069  -1.233
  455    HA   GLU  60           HA       GLU  60   3.131   6.721   1.622
  456    HB2  GLU  60           HB2      GLU  60   5.351   7.139   0.678
  457    HB3  GLU  60           HB3      GLU  60   4.663   8.222  -0.545
  458    HG2  GLU  60           HG2      GLU  60   4.205   9.903   1.021
  459    HG3  GLU  60           HG3      GLU  60   4.025   8.762   2.356
  460    H    LYS  61           H        LYS  61   1.919   8.597   2.176
  461    HA   LYS  61           HA       LYS  61  -0.493   8.883   0.697
  462    HB2  LYS  61           HB2      LYS  61  -0.059   9.089   3.207
  463    HB3  LYS  61           HB3      LYS  61   0.519  10.726   2.909
  464    HG2  LYS  61           HG2      LYS  61  -1.666  11.468   2.277
  465    HG3  LYS  61           HG3      LYS  61  -2.244   9.813   1.981
  466    HD2  LYS  61           HD2      LYS  61  -2.077   9.278   4.357
  467    HD3  LYS  61           HD3      LYS  61  -1.441  10.907   4.713
  468    HE2  LYS  61           HE2      LYS  61  -3.644  11.836   3.887
  469    HE3  LYS  61           HE3      LYS  61  -4.208  10.155   3.684
  470    HZ1  LYS  61           HZ1      LYS  61  -3.579   9.894   6.103
  471    HZ2  LYS  61           HZ2      LYS  61  -4.913  10.824   5.829
  472    HZ3  LYS  61           HZ3      LYS  61  -3.443  11.495   6.192
  473    H    VAL  62           H        VAL  62  -1.392  10.863  -0.193
  474    HA   VAL  62           HA       VAL  62   0.532  12.886  -1.129
  475    HB   VAL  62           HB       VAL  62   0.488  10.907  -2.666
  476   HG11  VAL  62          HG11      VAL  62  -2.357  11.764  -3.307
  477   HG12  VAL  62          HG12      VAL  62  -1.406  10.592  -4.202
  478   HG13  VAL  62          HG13      VAL  62  -1.858  10.245  -2.530
  479   HG21  VAL  62          HG21      VAL  62  -0.464  13.464  -3.965
  480   HG22  VAL  62          HG22      VAL  62   1.207  13.105  -3.443
  481   HG23  VAL  62          HG23      VAL  62   0.444  12.122  -4.715
  482    H    GLY  63           H        GLY  63  -1.623  12.768   0.822
  483    HA2  GLY  63           HA2      GLY  63  -3.931  14.229  -0.302
  484    HA3  GLY  63           HA3      GLY  63  -3.756  13.641   1.340
  485    H    LEU  64           H        LEU  64  -1.775  14.789   2.569
  486    HA   LEU  64           HA       LEU  64  -1.892  17.720   2.063
  487    HB2  LEU  64           HB2      LEU  64  -2.235  16.136   4.632
  488    HB3  LEU  64           HB3      LEU  64  -2.025  17.887   4.585
  489    HG   LEU  64           HG       LEU  64  -4.377  16.458   3.265
  490   HD11  LEU  64          HD11      LEU  64  -4.186  17.733   6.023
  491   HD12  LEU  64          HD12      LEU  64  -4.343  16.002   5.684
  492   HD13  LEU  64          HD13      LEU  64  -5.663  17.104   5.259
  493   HD21  LEU  64          HD21      LEU  64  -3.893  19.379   4.036
  494   HD22  LEU  64          HD22      LEU  64  -5.364  18.717   3.308
  495   HD23  LEU  64          HD23      LEU  64  -3.871  18.722   2.381
  496    H    ALA  65           H        ALA  65  -0.187  18.884   2.935
  497    HA   ALA  65           HA       ALA  65   2.346  17.411   3.318
  498    HB1  ALA  65           HB1      ALA  65   2.370  19.405   1.853
  499    HB2  ALA  65           HB2      ALA  65   1.714  20.408   3.174
  500    HB3  ALA  65           HB3      ALA  65   3.336  19.692   3.310
  501    H    ALA  66           H        ALA  66   1.422  16.378   5.174
  502    HA   ALA  66           HA       ALA  66   1.531  17.951   7.685
  503    HB1  ALA  66           HB1      ALA  66  -0.471  16.688   8.515
  504    HB2  ALA  66           HB2      ALA  66  -0.860  17.814   7.211
  505    HB3  ALA  66           HB3      ALA  66  -0.758  16.087   6.866
  506    H    ALA  67           H        ALA  67   0.449  14.600   7.177
  507    HA   ALA  67           HA       ALA  67   2.913  13.247   7.610
  508    HB1  ALA  67           HB1      ALA  67   2.424  14.042   9.931
  509    HB2  ALA  67           HB2      ALA  67   0.774  13.394   9.801
  510    HB3  ALA  67           HB3      ALA  67   2.177  12.293   9.802
  511    H1   THR 101           H        THR 101  -1.641 -12.185  11.052
  512    HA   THR 101           HA       THR 101  -0.802 -10.537   9.404
  513    HB   THR 101           HB       THR 101   1.636 -12.343   9.462
  514    HG1  THR 101           HG1      THR 101   2.602 -10.439  10.360
  515   HG21  THR 101          HG21      THR 101   2.594 -10.844   7.869
  516   HG22  THR 101          HG22      THR 101   1.314  -9.646   8.143
  517   HG23  THR 101          HG23      THR 101   0.948 -11.103   7.254
  518    H    LYS 102           H        LYS 102  -1.488 -10.892   7.376
  519    HA   LYS 102           HA       LYS 102  -2.822 -13.402   6.760
  520    HB2  LYS 102           HB2      LYS 102  -2.429 -10.792   5.232
  521    HB3  LYS 102           HB3      LYS 102  -3.388 -12.133   4.644
  522    HG2  LYS 102           HG2      LYS 102  -5.062 -10.952   5.444
  523    HG3  LYS 102           HG3      LYS 102  -4.727 -11.857   6.902
  524    HD2  LYS 102           HD2      LYS 102  -3.696  -9.913   7.919
  525    HD3  LYS 102           HD3      LYS 102  -3.581  -9.082   6.340
  526    HE2  LYS 102           HE2      LYS 102  -6.031  -9.014   6.171
  527    HE3  LYS 102           HE3      LYS 102  -6.184  -9.818   7.736
  528    HZ1  LYS 102           HZ1      LYS 102  -4.825  -7.180   7.448
  529    HZ2  LYS 102           HZ2      LYS 102  -5.406  -7.924   8.820
  530    HZ3  LYS 102           HZ3      LYS 102  -6.421  -7.353   7.675
  531    H    GLY 103           H        GLY 103   0.428 -12.530   6.290
  532    HA2  GLY 103           HA2      GLY 103   1.417 -14.610   4.980
  533    HA3  GLY 103           HA3      GLY 103   0.878 -13.575   3.640
  534    HA   PRO 104           HA       PRO 104   4.780 -11.726   5.809
  535    HB2  PRO 104           HB2      PRO 104   6.855 -12.677   4.269
  536    HB3  PRO 104           HB3      PRO 104   6.244 -13.528   5.720
  537    HG2  PRO 104           HG2      PRO 104   5.561 -14.062   2.813
  538    HG3  PRO 104           HG3      PRO 104   6.025 -15.256   4.062
  539    HD2  PRO 104           HD2      PRO 104   3.422 -14.782   3.415
  540    HD3  PRO 104           HD3      PRO 104   3.906 -15.118   5.098
  541    H    ALA 105           H        ALA 105   4.922  -9.628   4.967
  542    HA   ALA 105           HA       ALA 105   4.224  -9.039   2.207
  543    HB1  ALA 105           HB1      ALA 105   3.632  -7.550   4.196
  544    HB2  ALA 105           HB2      ALA 105   5.361  -7.214   4.383
  545    HB3  ALA 105           HB3      ALA 105   4.499  -6.700   2.930
  546    HA   PRO 106           HA       PRO 106   8.408  -8.983   0.673
  547    HB2  PRO 106           HB2      PRO 106   8.434  -6.261  -0.417
  548    HB3  PRO 106           HB3      PRO 106   8.375  -7.790  -1.287
  549    HG2  PRO 106           HG2      PRO 106   6.238  -6.001  -1.142
  550    HG3  PRO 106           HG3      PRO 106   6.045  -7.781  -1.363
  551    HD2  PRO 106           HD2      PRO 106   5.834  -6.161   1.163
  552    HD3  PRO 106           HD3      PRO 106   4.782  -7.484   0.599
  553    H    ASN 107           H        ASN 107   9.952  -8.863   2.291
  554    HA   ASN 107           HA       ASN 107  10.536  -6.232   3.507
  555    HB2  ASN 107           HB2      ASN 107  10.377  -6.956   5.758
  556    HB3  ASN 107           HB3      ASN 107   8.892  -7.444   4.962
  557   HD21  ASN 107          HD21      ASN 107  11.098  -8.610   7.262
  558   HD22  ASN 107          HD22      ASN 107  10.970 -10.287   6.830
  559    HA   PRO 108           HA       PRO 108  12.166  -5.602   5.378
  560    HB2  PRO 108           HB2      PRO 108  14.551  -4.244   5.011
  561    HB3  PRO 108           HB3      PRO 108  14.296  -5.584   6.167
  562    HG2  PRO 108           HG2      PRO 108  15.494  -5.693   3.406
  563    HG3  PRO 108           HG3      PRO 108  16.110  -6.443   4.915
  564    HD2  PRO 108           HD2      PRO 108  14.668  -7.805   3.064
  565    HD3  PRO 108           HD3      PRO 108  14.528  -8.163   4.804
  566    HA   PRO 109           HA       PRO 109  10.677  -2.700   2.467
  567    HB2  PRO 109           HB2      PRO 109  11.417  -0.163   3.379
  568    HB3  PRO 109           HB3      PRO 109  10.138  -1.196   4.078
  569    HG2  PRO 109           HG2      PRO 109  13.019  -0.923   4.952
  570    HG3  PRO 109           HG3      PRO 109  11.537  -0.841   5.962
  571    HD2  PRO 109           HD2      PRO 109  12.946  -3.110   5.800
  572    HD3  PRO 109           HD3      PRO 109  11.165  -3.178   5.749
  573    HA   PRO 110           HA       PRO 110  13.566  -1.457  -0.656
  574    HB2  PRO 110           HB2      PRO 110  12.110   0.154  -2.246
  575    HB3  PRO 110           HB3      PRO 110  11.524  -1.486  -1.867
  576    HG2  PRO 110           HG2      PRO 110  10.780   1.109  -0.471
  577    HG3  PRO 110           HG3      PRO 110   9.665  -0.104  -1.177
  578    HD2  PRO 110           HD2      PRO 110  10.403  -0.035   1.468
  579    HD3  PRO 110           HD3      PRO 110   9.999  -1.559   0.628
  580    H    ILE 111           H        ILE 111  13.740   1.137  -1.902
  581    HA   ILE 111           HA       ILE 111  15.403   2.535   0.045
  582    HB   ILE 111           HB       ILE 111  15.889   4.060  -1.776
  583   HG12  ILE 111          HG12      ILE 111  13.652   3.791  -2.993
  584   HG13  ILE 111          HG13      ILE 111  15.114   4.061  -3.908
  585   HG21  ILE 111          HG21      ILE 111  17.302   2.142  -1.468
  586   HG22  ILE 111          HG22      ILE 111  16.242   1.109  -2.447
  587   HG23  ILE 111          HG23      ILE 111  17.123   2.452  -3.199
  588   HD11  ILE 111          HD11      ILE 111  13.607   2.456  -4.974
  589   HD12  ILE 111          HD12      ILE 111  15.183   1.744  -4.620
  590   HD13  ILE 111          HD13      ILE 111  13.768   1.345  -3.610
  591    H    LEU 112           H        LEU 112  15.011   5.095   0.070
  592    HA   LEU 112           HA       LEU 112  13.797   6.807   0.903
  593    HB2  LEU 112           HB2      LEU 112  11.415   5.649  -0.599
  594    HB3  LEU 112           HB3      LEU 112  11.408   7.122   0.326
  595    HG   LEU 112           HG       LEU 112  11.531   7.761  -1.883
  596   HD11  LEU 112          HD11      LEU 112  14.402   8.000  -0.902
  597   HD12  LEU 112          HD12      LEU 112  13.044   9.014  -0.352
  598   HD13  LEU 112          HD13      LEU 112  13.548   9.039  -2.048
  599   HD21  LEU 112          HD21      LEU 112  12.278   5.657  -2.911
  600   HD22  LEU 112          HD22      LEU 112  13.946   5.984  -2.347
  601   HD23  LEU 112          HD23      LEU 112  13.174   7.044  -3.518
  602    H    LYS 113           H        LYS 113  14.245   6.037   2.946
  603    HA   LYS 113           HA       LYS 113  11.975   4.698   4.372
  604    HB2  LYS 113           HB2      LYS 113  14.967   4.507   4.864
  605    HB3  LYS 113           HB3      LYS 113  13.730   3.854   5.935
  606    HG2  LYS 113           HG2      LYS 113  12.836   2.499   3.963
  607    HG3  LYS 113           HG3      LYS 113  14.233   3.036   3.030
  608    HD2  LYS 113           HD2      LYS 113  14.285   1.360   5.573
  609    HD3  LYS 113           HD3      LYS 113  14.581   0.803   3.914
  610    HE2  LYS 113           HE2      LYS 113  16.459   2.539   3.798
  611    HE3  LYS 113           HE3      LYS 113  16.245   2.754   5.550
  612    HZ1  LYS 113           HZ1      LYS 113  17.121   0.337   4.122
  613    HZ2  LYS 113           HZ2      LYS 113  16.616   0.270   5.667
  614    HZ3  LYS 113           HZ3      LYS 113  17.940   1.197   5.245
  615    H    VAL 114           H        VAL 114  14.607   7.067   4.702
  616    HA   VAL 114           HA       VAL 114  12.849   8.608   6.538
  617    HB   VAL 114           HB       VAL 114  14.727   9.229   7.913
  618   HG11  VAL 114          HG11      VAL 114  14.484   6.191   7.800
  619   HG12  VAL 114          HG12      VAL 114  14.934   7.190   9.197
  620   HG13  VAL 114          HG13      VAL 114  13.303   7.296   8.536
  621   HG21  VAL 114          HG21      VAL 114  16.848   7.870   7.904
  622   HG22  VAL 114          HG22      VAL 114  16.395   7.218   6.313
  623   HG23  VAL 114          HG23      VAL 114  16.711   8.960   6.547
  624    H    TRP 115           H        TRP 115  15.937   8.791   4.700
  625    HA   TRP 115           HA       TRP 115  15.343  11.465   3.687
  626    HB2  TRP 115           HB2      TRP 115  17.458   9.335   3.101
  627    HB3  TRP 115           HB3      TRP 115  17.313  10.802   2.146
  628    HD1  TRP 115           HD1      TRP 115  19.653   9.640   4.284
  629    HE1  TRP 115           HE1      TRP 115  20.913  11.562   5.495
  630    HE3  TRP 115           HE3      TRP 115  16.290  13.448   3.597
  631    HZ2  TRP 115           HZ2      TRP 115  20.509  14.283   6.095
  632    HZ3  TRP 115           HZ3      TRP 115  16.851  15.728   4.327
  633    HH2  TRP 115           HH2      TRP 115  19.003  16.179   5.499
  Start of MODEL    6
    1    H1   MET   1           H        MET   1 -17.492   8.529   4.547
    2    HA   MET   1           HA       MET   1 -19.661   9.062   5.510
    3    HB2  MET   1           HB2      MET   1 -21.411   7.433   5.671
    4    HB3  MET   1           HB3      MET   1 -21.035   7.783   3.986
    5    HG2  MET   1           HG2      MET   1 -19.786   5.672   3.802
    6    HG3  MET   1           HG3      MET   1 -20.100   5.308   5.503
    7    HE1  MET   1           HE1      MET   1 -20.665   3.025   3.873
    8    HE2  MET   1           HE2      MET   1 -22.193   2.897   2.968
    9    HE3  MET   1           HE3      MET   1 -20.869   3.913   2.354
   10    H    LYS   2           H        LYS   2 -17.577   6.129   5.845
   11    HA   LYS   2           HA       LYS   2 -17.515   6.690   8.751
   12    HB2  LYS   2           HB2      LYS   2 -19.202   4.881   8.311
   13    HB3  LYS   2           HB3      LYS   2 -17.949   3.899   7.573
   14    HG2  LYS   2           HG2      LYS   2 -16.637   4.097   9.742
   15    HG3  LYS   2           HG3      LYS   2 -18.015   4.927  10.452
   16    HD2  LYS   2           HD2      LYS   2 -18.109   2.128   9.231
   17    HD3  LYS   2           HD3      LYS   2 -17.820   2.447  10.930
   18    HE2  LYS   2           HE2      LYS   2 -20.328   3.289   9.429
   19    HE3  LYS   2           HE3      LYS   2 -20.178   1.821  10.391
   20    HZ1  LYS   2           HZ1      LYS   2 -19.755   3.231  12.331
   21    HZ2  LYS   2           HZ2      LYS   2 -21.226   3.559  11.653
   22    HZ3  LYS   2           HZ3      LYS   2 -19.986   4.586  11.434
   23    H    VAL   3           H        VAL   3 -16.275   4.183   6.489
   24    HA   VAL   3           HA       VAL   3 -13.501   4.979   7.204
   25    HB   VAL   3           HB       VAL   3 -14.526   2.251   6.329
   26   HG11  VAL   3          HG11      VAL   3 -11.800   3.107   7.408
   27   HG12  VAL   3          HG12      VAL   3 -12.277   1.484   6.877
   28   HG13  VAL   3          HG13      VAL   3 -12.148   2.782   5.696
   29   HG21  VAL   3          HG21      VAL   3 -13.909   1.572   8.675
   30   HG22  VAL   3          HG22      VAL   3 -13.778   3.290   9.097
   31   HG23  VAL   3          HG23      VAL   3 -15.333   2.592   8.572
   32    HA   PRO   4           HA       PRO   4 -14.362   5.939   2.769
   33    HB2  PRO   4           HB2      PRO   4 -12.952   8.228   2.498
   34    HB3  PRO   4           HB3      PRO   4 -14.514   8.222   3.372
   35    HG2  PRO   4           HG2      PRO   4 -11.716   8.020   4.558
   36    HG3  PRO   4           HG3      PRO   4 -13.036   9.135   5.021
   37    HD2  PRO   4           HD2      PRO   4 -12.566   6.782   6.342
   38    HD3  PRO   4           HD3      PRO   4 -14.215   7.456   6.136
   39    H    GLY   5           H        GLY   5 -12.453   6.350   0.954
   40    HA2  GLY   5           HA2      GLY   5 -10.476   4.304   1.364
   41    HA3  GLY   5           HA3      GLY   5 -10.592   5.540   0.070
   42    H    VAL   6           H        VAL   6  -8.315   4.683   2.235
   43    HA   VAL   6           HA       VAL   6  -7.890   7.493   3.230
   44    HB   VAL   6           HB       VAL   6  -6.202   5.113   4.010
   45   HG11  VAL   6          HG11      VAL   6  -5.634   6.536   5.914
   46   HG12  VAL   6          HG12      VAL   6  -5.254   7.352   4.395
   47   HG13  VAL   6          HG13      VAL   6  -6.709   7.815   5.311
   48   HG21  VAL   6          HG21      VAL   6  -8.477   4.523   4.711
   49   HG22  VAL   6          HG22      VAL   6  -7.581   5.083   6.129
   50   HG23  VAL   6          HG23      VAL   6  -8.743   6.162   5.335
   51    H    ARG   7           H        ARG   7  -6.820   8.695   1.940
   52    HA   ARG   7           HA       ARG   7  -5.669   7.836  -0.519
   53    HB2  ARG   7           HB2      ARG   7  -5.054  10.186  -0.789
   54    HB3  ARG   7           HB3      ARG   7  -6.725   9.953  -0.323
   55    HG2  ARG   7           HG2      ARG   7  -5.514  10.369   2.147
   56    HG3  ARG   7           HG3      ARG   7  -4.457  11.301   1.090
   57    HD2  ARG   7           HD2      ARG   7  -7.281  11.763   0.455
   58    HD3  ARG   7           HD3      ARG   7  -6.975  11.958   2.181
   59    HE   ARG   7           HE       ARG   7  -6.083  13.961   1.760
   60   HH11  ARG   7          HH11      ARG   7  -5.554  12.055  -1.242
   61   HH12  ARG   7          HH12      ARG   7  -4.730  13.312  -2.050
   62   HH21  ARG   7          HH21      ARG   7  -5.171  15.676   0.588
   63   HH22  ARG   7          HH22      ARG   7  -4.725  15.505  -1.087
   64    H    VAL   8           H        VAL   8  -3.889   6.947  -0.828
   65    HA   VAL   8           HA       VAL   8  -1.469   7.859   0.639
   66    HB   VAL   8           HB       VAL   8  -0.670   5.556   0.973
   67   HG11  VAL   8          HG11      VAL   8  -1.780   6.751   2.840
   68   HG12  VAL   8          HG12      VAL   8  -3.336   6.041   2.370
   69   HG13  VAL   8          HG13      VAL   8  -2.012   5.005   2.935
   70   HG21  VAL   8          HG21      VAL   8  -2.096   4.418  -0.712
   71   HG22  VAL   8          HG22      VAL   8  -2.145   3.637   0.885
   72   HG23  VAL   8          HG23      VAL   8  -3.503   4.651   0.357
   73    H    ARG   9           H        ARG   9   0.553   7.193  -0.414
   74    HA   ARG   9           HA       ARG   9   0.329   6.703  -3.320
   75    HB2  ARG   9           HB2      ARG   9   0.524   9.222  -2.765
   76    HB3  ARG   9           HB3      ARG   9   2.128   8.847  -2.117
   77    HG2  ARG   9           HG2      ARG   9   2.658   7.810  -4.420
   78    HG3  ARG   9           HG3      ARG   9   1.099   8.452  -4.955
   79    HD2  ARG   9           HD2      ARG   9   2.639  10.072  -5.643
   80    HD3  ARG   9           HD3      ARG   9   1.950  10.751  -4.172
   81    HE   ARG   9           HE       ARG   9   3.959  10.025  -2.946
   82   HH11  ARG   9          HH11      ARG   9   4.384  10.351  -6.506
   83   HH12  ARG   9          HH12      ARG   9   6.103  10.436  -6.358
   84   HH21  ARG   9          HH21      ARG   9   6.079  10.218  -2.802
   85   HH22  ARG   9          HH22      ARG   9   7.124  10.461  -4.163
   86    H    ALA  10           H        ALA  10   2.005   5.371  -3.992
   87    HA   ALA  10           HA       ALA  10   3.498   4.068  -1.815
   88    HB1  ALA  10           HB1      ALA  10   3.671   3.560  -4.790
   89    HB2  ALA  10           HB2      ALA  10   4.398   2.584  -3.512
   90    HB3  ALA  10           HB3      ALA  10   2.629   2.681  -3.621
   91    H    LEU  11           H        LEU  11   5.567   4.201  -1.341
   92    HA   LEU  11           HA       LEU  11   7.087   6.471  -2.429
   93    HB2  LEU  11           HB2      LEU  11   7.741   4.398  -0.292
   94    HB3  LEU  11           HB3      LEU  11   8.687   5.849  -0.642
   95    HG   LEU  11           HG       LEU  11   5.818   5.811   0.424
   96   HD11  LEU  11          HD11      LEU  11   6.895   6.638   2.515
   97   HD12  LEU  11          HD12      LEU  11   8.480   6.368   1.760
   98   HD13  LEU  11          HD13      LEU  11   7.399   4.994   2.077
   99   HD21  LEU  11          HD21      LEU  11   7.731   8.152   0.005
  100   HD22  LEU  11          HD22      LEU  11   6.158   8.231   0.822
  101   HD23  LEU  11          HD23      LEU  11   6.229   7.852  -0.895
  102    H    TYR  12           H        TYR  12   7.037   2.906  -2.710
  103    HA   TYR  12           HA       TYR  12   9.248   3.125  -4.664
  104    HB2  TYR  12           HB2      TYR  12   9.093   0.821  -2.721
  105    HB3  TYR  12           HB3      TYR  12  10.440   1.329  -3.710
  106    HD1  TYR  12           HD1      TYR  12   8.773   1.626  -0.505
  107    HD2  TYR  12           HD2      TYR  12  11.702   3.558  -3.034
  108    HE1  TYR  12           HE1      TYR  12   9.597   2.889   1.425
  109    HE2  TYR  12           HE2      TYR  12  12.461   4.889  -1.120
  110    HH   TYR  12           HH       TYR  12  11.035   4.547   2.155
  111    H    ASP  13           H        ASP  13   9.393   1.226  -6.090
  112    HA   ASP  13           HA       ASP  13   6.747   0.316  -7.003
  113    HB2  ASP  13           HB2      ASP  13   8.262   1.139  -8.658
  114    HB3  ASP  13           HB3      ASP  13   9.573   0.108  -8.098
  115    H    TYR  14           H        TYR  14   5.922  -1.477  -5.959
  116    HA   TYR  14           HA       TYR  14   7.522  -3.945  -5.878
  117    HB2  TYR  14           HB2      TYR  14   6.502  -2.371  -3.560
  118    HB3  TYR  14           HB3      TYR  14   6.107  -4.042  -3.513
  119    HD1  TYR  14           HD1      TYR  14   7.623  -5.773  -2.886
  120    HD2  TYR  14           HD2      TYR  14   9.138  -1.853  -3.941
  121    HE1  TYR  14           HE1      TYR  14   9.858  -6.437  -2.189
  122    HE2  TYR  14           HE2      TYR  14  11.425  -2.574  -3.309
  123    HH   TYR  14           HH       TYR  14  12.024  -5.824  -1.884
  124    H    THR  15           H        THR  15   6.017  -5.888  -5.849
  125    HA   THR  15           HA       THR  15   3.181  -5.161  -6.479
  126    HB   THR  15           HB       THR  15   4.335  -5.298  -8.528
  127    HG1  THR  15           HG1      THR  15   3.163  -7.836  -8.414
  128   HG21  THR  15          HG21      THR  15   6.374  -6.510  -8.054
  129   HG22  THR  15          HG22      THR  15   5.516  -7.236  -9.412
  130   HG23  THR  15          HG23      THR  15   5.470  -8.021  -7.826
  131    H    GLY  16           H        GLY  16   2.782  -5.734  -4.250
  132    HA2  GLY  16           HA2      GLY  16   2.182  -7.148  -2.545
  133    HA3  GLY  16           HA3      GLY  16   1.749  -8.284  -3.841
  134    H    GLN  17           H        GLN  17   2.370 -10.054  -2.334
  135    HA   GLN  17           HA       GLN  17   5.274 -10.547  -2.369
  136    HB2  GLN  17           HB2      GLN  17   4.010  -9.937  -0.049
  137    HB3  GLN  17           HB3      GLN  17   3.655 -11.642  -0.087
  138    HG2  GLN  17           HG2      GLN  17   6.477 -10.504  -0.369
  139    HG3  GLN  17           HG3      GLN  17   5.751 -10.912   1.176
  140   HE21  GLN  17          HE21      GLN  17   7.786 -12.169  -1.239
  141   HE22  GLN  17          HE22      GLN  17   7.489 -13.878  -0.881
  142    H    GLU  18           H        GLU  18   1.931 -11.679  -2.628
  143    HA   GLU  18           HA       GLU  18   2.873 -14.083  -4.049
  144    HB2  GLU  18           HB2      GLU  18   1.926 -14.106  -1.407
  145    HB3  GLU  18           HB3      GLU  18   0.462 -14.348  -2.353
  146    HG2  GLU  18           HG2      GLU  18   1.110 -16.512  -2.141
  147    HG3  GLU  18           HG3      GLU  18   1.925 -16.145  -3.638
  148    H    ALA  19           H        ALA  19   0.650 -15.123  -4.943
  149    HA   ALA  19           HA       ALA  19  -0.300 -13.329  -6.916
  150    HB1  ALA  19           HB1      ALA  19  -1.756 -15.216  -7.542
  151    HB2  ALA  19           HB2      ALA  19  -0.084 -15.738  -7.268
  152    HB3  ALA  19           HB3      ALA  19  -1.336 -16.056  -6.037
  153    H    ASP  20           H        ASP  20  -1.882 -14.325  -3.850
  154    HA   ASP  20           HA       ASP  20  -4.436 -13.166  -4.670
  155    HB2  ASP  20           HB2      ASP  20  -3.579 -14.077  -1.917
  156    HB3  ASP  20           HB3      ASP  20  -5.220 -13.697  -2.431
  157    H    GLU  21           H        GLU  21  -1.931 -11.381  -4.333
  158    HA   GLU  21           HA       GLU  21  -3.127  -9.356  -2.478
  159    HB2  GLU  21           HB2      GLU  21  -0.257  -9.992  -3.129
  160    HB3  GLU  21           HB3      GLU  21  -0.745  -8.506  -2.326
  161    HG2  GLU  21           HG2      GLU  21  -1.038  -9.516  -0.340
  162    HG3  GLU  21           HG3      GLU  21  -2.089 -10.744  -1.007
  163    H    LEU  22           H        LEU  22  -2.316  -7.156  -3.071
  164    HA   LEU  22           HA       LEU  22  -3.286  -6.481  -5.742
  165    HB2  LEU  22           HB2      LEU  22  -3.818  -5.507  -3.294
  166    HB3  LEU  22           HB3      LEU  22  -2.366  -4.568  -3.569
  167    HG   LEU  22           HG       LEU  22  -3.402  -3.463  -5.443
  168   HD11  LEU  22          HD11      LEU  22  -5.939  -3.945  -5.865
  169   HD12  LEU  22          HD12      LEU  22  -5.590  -5.537  -5.156
  170   HD13  LEU  22          HD13      LEU  22  -4.748  -5.018  -6.596
  171   HD21  LEU  22          HD21      LEU  22  -5.353  -2.387  -4.247
  172   HD22  LEU  22          HD22      LEU  22  -3.869  -2.503  -3.290
  173   HD23  LEU  22          HD23      LEU  22  -5.208  -3.630  -3.008
  174    H    SER  23           H        SER  23  -2.012  -4.499  -6.772
  175    HA   SER  23           HA       SER  23   0.917  -4.678  -6.394
  176    HB2  SER  23           HB2      SER  23   0.905  -4.829  -9.028
  177    HB3  SER  23           HB3      SER  23   0.699  -6.301  -8.058
  178    HG   SER  23           HG       SER  23  -1.217  -6.568  -8.705
  179    H    PHE  24           H        PHE  24   1.792  -2.554  -6.535
  180    HA   PHE  24           HA       PHE  24   0.179  -0.543  -8.017
  181    HB2  PHE  24           HB2      PHE  24   0.360   1.002  -6.190
  182    HB3  PHE  24           HB3      PHE  24  -0.556  -0.394  -5.741
  183    HD1  PHE  24           HD1      PHE  24   3.044   0.800  -5.550
  184    HD2  PHE  24           HD2      PHE  24  -0.184  -1.328  -3.637
  185    HE1  PHE  24           HE1      PHE  24   4.529   0.244  -3.642
  186    HE2  PHE  24           HE2      PHE  24   1.261  -1.699  -1.663
  187    HZ   PHE  24           HZ       PHE  24   3.619  -0.978  -1.677
  188    H    LYS  25           H        LYS  25   1.599   1.442  -8.500
  189    HA   LYS  25           HA       LYS  25   4.433   0.538  -8.913
  190    HB2  LYS  25           HB2      LYS  25   2.545   2.258 -10.533
  191    HB3  LYS  25           HB3      LYS  25   4.275   2.499 -10.661
  192    HG2  LYS  25           HG2      LYS  25   3.572   1.045 -12.409
  193    HG3  LYS  25           HG3      LYS  25   4.612   0.162 -11.280
  194    HD2  LYS  25           HD2      LYS  25   2.588  -0.903 -10.308
  195    HD3  LYS  25           HD3      LYS  25   1.591  -0.110 -11.541
  196    HE2  LYS  25           HE2      LYS  25   2.758  -1.291 -13.302
  197    HE3  LYS  25           HE3      LYS  25   4.039  -1.805 -12.189
  198    HZ1  LYS  25           HZ1      LYS  25   2.431  -3.192 -11.038
  199    HZ2  LYS  25           HZ2      LYS  25   2.571  -3.597 -12.604
  200    HZ3  LYS  25           HZ3      LYS  25   1.252  -2.751 -12.137
  201    H    ALA  26           H        ALA  26   6.096   2.292  -8.953
  202    HA   ALA  26           HA       ALA  26   6.051   3.666  -6.440
  203    HB1  ALA  26           HB1      ALA  26   8.104   4.749  -7.202
  204    HB2  ALA  26           HB2      ALA  26   8.176   3.024  -7.533
  205    HB3  ALA  26           HB3      ALA  26   7.848   4.157  -8.866
  206    H    GLY  27           H        GLY  27   4.971   5.527  -5.934
  207    HA2  GLY  27           HA2      GLY  27   4.350   7.726  -6.177
  208    HA3  GLY  27           HA3      GLY  27   4.744   7.691  -7.890
  209    H    GLU  28           H        GLU  28   2.883   4.974  -7.694
  210    HA   GLU  28           HA       GLU  28   0.531   6.343  -8.715
  211    HB2  GLU  28           HB2      GLU  28   1.313   3.470  -8.218
  212    HB3  GLU  28           HB3      GLU  28  -0.403   3.818  -8.220
  213    HG2  GLU  28           HG2      GLU  28   1.487   4.550 -10.491
  214    HG3  GLU  28           HG3      GLU  28   0.526   3.066 -10.388
  215    H    GLU  29           H        GLU  29  -1.615   6.124  -7.760
  216    HA   GLU  29           HA       GLU  29  -1.525   6.381  -4.768
  217    HB2  GLU  29           HB2      GLU  29  -3.426   7.545  -6.846
  218    HB3  GLU  29           HB3      GLU  29  -3.687   7.609  -5.097
  219    HG2  GLU  29           HG2      GLU  29  -1.527   8.838  -4.839
  220    HG3  GLU  29           HG3      GLU  29  -1.390   8.919  -6.598
  221    H    LEU  30           H        LEU  30  -3.033   5.278  -3.533
  222    HA   LEU  30           HA       LEU  30  -5.055   3.596  -4.793
  223    HB2  LEU  30           HB2      LEU  30  -4.410   1.770  -3.106
  224    HB3  LEU  30           HB3      LEU  30  -3.583   1.829  -4.682
  225    HG   LEU  30           HG       LEU  30  -2.396   2.760  -2.038
  226   HD11  LEU  30          HD11      LEU  30  -1.155   0.633  -2.109
  227   HD12  LEU  30          HD12      LEU  30  -2.017   0.173  -3.597
  228   HD13  LEU  30          HD13      LEU  30  -2.894   0.336  -2.064
  229   HD21  LEU  30          HD21      LEU  30  -0.201   2.408  -3.311
  230   HD22  LEU  30          HD22      LEU  30  -1.108   3.837  -3.757
  231   HD23  LEU  30          HD23      LEU  30  -1.170   2.397  -4.793
  232    H    MET  31           H        MET  31  -6.742   3.114  -3.253
  233    HA   MET  31           HA       MET  31  -6.796   4.964  -0.914
  234    HB2  MET  31           HB2      MET  31  -9.041   3.724  -2.579
  235    HB3  MET  31           HB3      MET  31  -9.254   4.503  -1.033
  236    HG2  MET  31           HG2      MET  31  -7.937   5.858  -3.368
  237    HG3  MET  31           HG3      MET  31  -9.672   5.968  -3.045
  238    HE1  MET  31           HE1      MET  31  -7.036   8.203  -3.088
  239    HE2  MET  31           HE2      MET  31  -8.770   8.492  -3.404
  240    HE3  MET  31           HE3      MET  31  -7.926   9.422  -2.144
  241    H    LYS  32           H        LYS  32  -6.326   3.916   0.935
  242    HA   LYS  32           HA       LYS  32  -6.412   1.040   1.115
  243    HB2  LYS  32           HB2      LYS  32  -4.949   2.490   2.397
  244    HB3  LYS  32           HB3      LYS  32  -6.352   3.189   3.244
  245    HG2  LYS  32           HG2      LYS  32  -6.991   0.924   4.085
  246    HG3  LYS  32           HG3      LYS  32  -5.496   0.280   3.392
  247    HD2  LYS  32           HD2      LYS  32  -5.046   0.607   5.664
  248    HD3  LYS  32           HD3      LYS  32  -4.268   2.004   4.898
  249    HE2  LYS  32           HE2      LYS  32  -6.164   3.419   5.532
  250    HE3  LYS  32           HE3      LYS  32  -7.090   2.006   6.048
  251    HZ1  LYS  32           HZ1      LYS  32  -4.547   2.756   7.334
  252    HZ2  LYS  32           HZ2      LYS  32  -5.640   1.649   7.832
  253    HZ3  LYS  32           HZ3      LYS  32  -6.015   3.256   7.885
  254    H    ILE  33           H        ILE  33  -8.045  -0.351   2.079
  255    HA   ILE  33           HA       ILE  33 -10.457   1.082   2.891
  256    HB   ILE  33           HB       ILE  33 -11.895  -0.329   1.770
  257   HG12  ILE  33          HG12      ILE  33  -9.553  -2.050   0.873
  258   HG13  ILE  33          HG13      ILE  33 -10.777  -2.480   2.055
  259   HG21  ILE  33          HG21      ILE  33 -11.536   0.243  -0.527
  260   HG22  ILE  33          HG22      ILE  33 -10.847   1.535   0.449
  261   HG23  ILE  33          HG23      ILE  33  -9.783   0.342  -0.309
  262   HD11  ILE  33          HD11      ILE  33 -12.524  -2.263   0.252
  263   HD12  ILE  33          HD12      ILE  33 -11.192  -2.093  -0.922
  264   HD13  ILE  33          HD13      ILE  33 -11.347  -3.573   0.043
  265    H    SER  34           H        SER  34  -8.094  -0.907   4.099
  266    HA   SER  34           HA       SER  34  -9.918  -1.897   6.212
  267    HB2  SER  34           HB2      SER  34  -7.748  -3.466   4.776
  268    HB3  SER  34           HB3      SER  34  -8.541  -3.982   6.264
  269    HG   SER  34           HG       SER  34  -9.698  -4.942   4.806
  270    H    GLU  35           H        GLU  35  -8.326  -2.858   8.028
  271    HA   GLU  35           HA       GLU  35  -6.680  -0.563   8.851
  272    HB2  GLU  35           HB2      GLU  35  -7.512  -3.137  10.273
  273    HB3  GLU  35           HB3      GLU  35  -6.565  -1.813  10.995
  274    HG2  GLU  35           HG2      GLU  35  -8.481  -0.252  10.295
  275    HG3  GLU  35           HG3      GLU  35  -9.437  -1.713  10.005
  276    H    GLU  36           H        GLU  36  -4.587  -1.150  10.026
  277    HA   GLU  36           HA       GLU  36  -2.874  -2.638   8.171
  278    HB2  GLU  36           HB2      GLU  36  -2.330  -0.322   9.020
  279    HB3  GLU  36           HB3      GLU  36  -2.222  -1.011  10.642
  280    HG2  GLU  36           HG2      GLU  36  -0.508  -2.704   9.496
  281    HG3  GLU  36           HG3      GLU  36  -0.416  -1.456   8.248
  282    H    ASP  37           H        ASP  37  -2.546  -4.716   8.483
  283    HA   ASP  37           HA       ASP  37  -3.205  -6.036  11.021
  284    HB2  ASP  37           HB2      ASP  37  -2.052  -7.012   8.404
  285    HB3  ASP  37           HB3      ASP  37  -2.365  -8.076   9.766
  286    H    GLU  38           H        GLU  38  -1.485  -7.547  11.970
  287    HA   GLU  38           HA       GLU  38   0.673  -6.173  12.989
  288    HB2  GLU  38           HB2      GLU  38  -0.551  -8.677  13.292
  289    HB3  GLU  38           HB3      GLU  38   1.108  -9.094  12.892
  290    HG2  GLU  38           HG2      GLU  38   1.943  -7.671  14.721
  291    HG3  GLU  38           HG3      GLU  38   0.304  -7.095  15.050
  292    H    GLN  39           H        GLN  39   0.658  -7.483   9.866
  293    HA   GLN  39           HA       GLN  39   3.636  -7.620   9.723
  294    HB2  GLN  39           HB2      GLN  39   1.777  -9.479   9.077
  295    HB3  GLN  39           HB3      GLN  39   1.933  -8.691   7.516
  296    HG2  GLN  39           HG2      GLN  39   3.328 -10.677   7.693
  297    HG3  GLN  39           HG3      GLN  39   4.322  -9.254   7.510
  298   HE21  GLN  39          HE21      GLN  39   5.798  -8.748   9.177
  299   HE22  GLN  39          HE22      GLN  39   5.949  -9.591  10.692
  300    H    GLY  40           H        GLY  40   1.288  -5.387   9.357
  301    HA2  GLY  40           HA2      GLY  40   1.398  -3.289   8.444
  302    HA3  GLY  40           HA3      GLY  40   2.847  -3.733   7.549
  303    H    TRP  41           H        TRP  41   0.002  -5.801   7.425
  304    HA   TRP  41           HA       TRP  41  -0.226  -5.390   4.526
  305    HB2  TRP  41           HB2      TRP  41  -1.173  -7.389   6.579
  306    HB3  TRP  41           HB3      TRP  41  -2.210  -7.143   5.200
  307    HD1  TRP  41           HD1      TRP  41  -0.142  -9.606   6.181
  308    HE1  TRP  41           HE1      TRP  41   1.115 -10.807   4.308
  309    HE3  TRP  41           HE3      TRP  41  -0.824  -6.147   2.571
  310    HZ2  TRP  41           HZ2      TRP  41   1.829 -10.221   1.505
  311    HZ3  TRP  41           HZ3      TRP  41   0.054  -6.528   0.278
  312    HH2  TRP  41           HH2      TRP  41   1.335  -8.454  -0.260
  313    H    CYS  42           H        CYS  42  -2.037  -4.431   3.550
  314    HA   CYS  42           HA       CYS  42  -4.295  -3.596   5.268
  315    HB2  CYS  42           HB2      CYS  42  -2.440  -1.765   3.700
  316    HB3  CYS  42           HB3      CYS  42  -4.152  -1.381   3.911
  317    HG   CYS  42           HG       CYS  42  -3.903  -2.031   6.634
  318    H    LYS  43           H        LYS  43  -6.157  -4.029   4.145
  319    HA   LYS  43           HA       LYS  43  -5.878  -4.765   1.294
  320    HB2  LYS  43           HB2      LYS  43  -7.752  -5.386   3.387
  321    HB3  LYS  43           HB3      LYS  43  -8.657  -4.579   2.109
  322    HG2  LYS  43           HG2      LYS  43  -6.714  -6.761   1.295
  323    HG3  LYS  43           HG3      LYS  43  -8.135  -7.226   2.214
  324    HD2  LYS  43           HD2      LYS  43  -9.638  -6.233   0.547
  325    HD3  LYS  43           HD3      LYS  43  -8.231  -5.709  -0.418
  326    HE2  LYS  43           HE2      LYS  43  -7.422  -8.095  -0.453
  327    HE3  LYS  43           HE3      LYS  43  -8.798  -8.572   0.519
  328    HZ1  LYS  43           HZ1      LYS  43 -10.253  -8.169  -1.253
  329    HZ2  LYS  43           HZ2      LYS  43  -9.075  -9.161  -1.744
  330    HZ3  LYS  43           HZ3      LYS  43  -9.043  -7.630  -2.283
  331    H    GLY  44           H        GLY  44  -6.557  -3.409  -0.432
  332    HA2  GLY  44           HA2      GLY  44  -7.902  -0.889   0.174
  333    HA3  GLY  44           HA3      GLY  44  -6.256  -0.672  -0.327
  334    H    ARG  45           H        ARG  45  -7.849   0.500  -1.952
  335    HA   ARG  45           HA       ARG  45  -8.384  -1.303  -4.215
  336    HB2  ARG  45           HB2      ARG  45 -10.409  -0.533  -2.898
  337    HB3  ARG  45           HB3      ARG  45 -10.014   1.128  -3.313
  338    HG2  ARG  45           HG2      ARG  45 -10.396   0.679  -5.690
  339    HG3  ARG  45           HG3      ARG  45 -10.594  -1.035  -5.377
  340    HD2  ARG  45           HD2      ARG  45 -12.449   0.037  -3.623
  341    HD3  ARG  45           HD3      ARG  45 -12.467   1.243  -4.913
  342    HE   ARG  45           HE       ARG  45 -12.722  -1.589  -5.730
  343   HH11  ARG  45          HH11      ARG  45 -14.491   1.358  -4.851
  344   HH12  ARG  45          HH12      ARG  45 -15.927   0.891  -5.703
  345   HH21  ARG  45          HH21      ARG  45 -14.688  -2.313  -6.595
  346   HH22  ARG  45          HH22      ARG  45 -16.121  -1.328  -6.531
  347    H    LEU  46           H        LEU  46  -7.330  -0.801  -5.994
  348    HA   LEU  46           HA       LEU  46  -5.733   1.634  -6.304
  349    HB2  LEU  46           HB2      LEU  46  -6.317  -0.892  -7.901
  350    HB3  LEU  46           HB3      LEU  46  -5.854   0.549  -8.799
  351    HG   LEU  46           HG       LEU  46  -3.819   0.738  -7.310
  352   HD11  LEU  46          HD11      LEU  46  -4.636  -2.031  -6.582
  353   HD12  LEU  46          HD12      LEU  46  -4.448  -0.628  -5.482
  354   HD13  LEU  46          HD13      LEU  46  -3.027  -1.316  -6.283
  355   HD21  LEU  46          HD21      LEU  46  -3.816  -0.036  -9.669
  356   HD22  LEU  46          HD22      LEU  46  -4.060  -1.701  -9.106
  357   HD23  LEU  46          HD23      LEU  46  -2.577  -0.793  -8.693
  358    H    LEU  47           H        LEU  47  -6.021   3.037  -8.339
  359    HA   LEU  47           HA       LEU  47  -8.769   4.002  -8.455
  360    HB2  LEU  47           HB2      LEU  47  -8.021   5.397 -10.406
  361    HB3  LEU  47           HB3      LEU  47  -7.334   5.751  -8.850
  362    HG   LEU  47           HG       LEU  47  -5.637   3.870 -10.320
  363   HD11  LEU  47          HD11      LEU  47  -5.954   6.599 -11.644
  364   HD12  LEU  47          HD12      LEU  47  -6.599   5.089 -12.310
  365   HD13  LEU  47          HD13      LEU  47  -4.863   5.271 -12.109
  366   HD21  LEU  47          HD21      LEU  47  -5.096   5.281  -8.331
  367   HD22  LEU  47          HD22      LEU  47  -5.142   6.727  -9.357
  368   HD23  LEU  47          HD23      LEU  47  -3.929   5.445  -9.644
  369    H    THR  48           H        THR  48  -7.006   1.539 -10.132
  370    HA   THR  48           HA       THR  48  -8.767   1.350 -12.432
  371    HB   THR  48           HB       THR  48  -6.281   0.629 -12.045
  372    HG1  THR  48           HG1      THR  48  -8.158  -0.825 -13.576
  373   HG21  THR  48          HG21      THR  48  -6.857  -0.934 -10.123
  374   HG22  THR  48          HG22      THR  48  -5.804  -1.580 -11.380
  375   HG23  THR  48          HG23      THR  48  -7.528  -2.032 -11.334
  376    H    GLY  49           H        GLY  49  -9.336   0.877  -9.179
  377    HA2  GLY  49           HA2      GLY  49 -11.178   0.047  -8.118
  378    HA3  GLY  49           HA3      GLY  49 -11.723  -0.676  -9.634
  379    H    HIS  50           H        HIS  50  -8.503  -1.760  -9.008
  380    HA   HIS  50           HA       HIS  50  -9.501  -4.413  -8.434
  381    HB2  HIS  50           HB2      HIS  50  -7.298  -3.552  -9.662
  382    HB3  HIS  50           HB3      HIS  50  -6.601  -3.578  -8.059
  383    HD1  HIS  50           HD1      HIS  50  -8.927  -6.515  -8.327
  384    HD2  HIS  50           HD2      HIS  50  -5.107  -5.398  -9.740
  385    HE1  HIS  50           HE1      HIS  50  -7.896  -8.603  -9.245
  386    H    VAL  51           H        VAL  51  -9.447  -5.525  -6.312
  387    HA   VAL  51           HA       VAL  51  -8.679  -3.812  -4.020
  388    HB   VAL  51           HB       VAL  51 -11.174  -5.496  -4.394
  389   HG11  VAL  51          HG11      VAL  51 -10.467  -5.964  -2.136
  390   HG12  VAL  51          HG12      VAL  51 -10.071  -4.256  -1.841
  391   HG13  VAL  51          HG13      VAL  51 -11.762  -4.790  -2.045
  392   HG21  VAL  51          HG21      VAL  51 -10.820  -2.592  -3.627
  393   HG22  VAL  51          HG22      VAL  51 -11.264  -3.176  -5.248
  394   HG23  VAL  51          HG23      VAL  51 -12.362  -3.431  -3.885
  395    H    GLY  52           H        GLY  52  -6.934  -4.740  -3.066
  396    HA2  GLY  52           HA2      GLY  52  -6.938  -7.626  -2.418
  397    HA3  GLY  52           HA3      GLY  52  -5.685  -7.025  -3.481
  398    H    LEU  53           H        LEU  53  -4.643  -8.036  -1.364
  399    HA   LEU  53           HA       LEU  53  -4.335  -6.175   0.893
  400    HB2  LEU  53           HB2      LEU  53  -3.255  -8.877   0.044
  401    HB3  LEU  53           HB3      LEU  53  -2.403  -7.974   1.267
  402    HG   LEU  53           HG       LEU  53  -5.306  -8.793   1.489
  403   HD11  LEU  53          HD11      LEU  53  -4.482 -10.501   3.070
  404   HD12  LEU  53          HD12      LEU  53  -2.805  -9.975   2.786
  405   HD13  LEU  53          HD13      LEU  53  -3.739 -10.726   1.476
  406   HD21  LEU  53          HD21      LEU  53  -3.362  -7.493   3.426
  407   HD22  LEU  53          HD22      LEU  53  -4.876  -8.249   3.947
  408   HD23  LEU  53          HD23      LEU  53  -4.922  -6.844   2.887
  409    H    TYR  54           H        TYR  54  -2.588  -4.712   1.061
  410    HA   TYR  54           HA       TYR  54  -0.464  -4.835  -0.936
  411    HB2  TYR  54           HB2      TYR  54  -0.626  -2.650  -1.614
  412    HB3  TYR  54           HB3      TYR  54  -2.264  -3.213  -1.686
  413    HD1  TYR  54           HD1      TYR  54  -3.977  -2.253  -0.214
  414    HD2  TYR  54           HD2      TYR  54   0.160  -1.097   0.174
  415    HE1  TYR  54           HE1      TYR  54  -4.620  -0.473   1.392
  416    HE2  TYR  54           HE2      TYR  54  -0.485   0.673   1.722
  417    HH   TYR  54           HH       TYR  54  -2.137   1.500   3.087
  418    HA   PRO  55           HA       PRO  55   1.612  -4.268   2.958
  419    HB2  PRO  55           HB2      PRO  55   4.173  -3.829   2.211
  420    HB3  PRO  55           HB3      PRO  55   3.322  -5.378   1.942
  421    HG2  PRO  55           HG2      PRO  55   3.771  -3.161  -0.079
  422    HG3  PRO  55           HG3      PRO  55   3.978  -4.940  -0.275
  423    HD2  PRO  55           HD2      PRO  55   1.723  -3.636  -1.081
  424    HD3  PRO  55           HD3      PRO  55   1.777  -5.324  -0.524
  425    H    ALA  56           H        ALA  56   0.809  -2.515   3.976
  426    HA   ALA  56           HA       ALA  56   0.847   0.156   3.111
  427    HB1  ALA  56           HB1      ALA  56  -0.659  -0.727   4.834
  428    HB2  ALA  56           HB2      ALA  56   0.705  -0.920   5.954
  429    HB3  ALA  56           HB3      ALA  56   0.214   0.699   5.422
  430    H    ASN  57           H        ASN  57   3.298  -1.663   4.785
  431    HA   ASN  57           HA       ASN  57   4.818   0.458   5.846
  432    HB2  ASN  57           HB2      ASN  57   6.199  -1.927   4.567
  433    HB3  ASN  57           HB3      ASN  57   6.622  -1.033   6.016
  434   HD21  ASN  57          HD21      ASN  57   5.125  -3.920   4.879
  435   HD22  ASN  57          HD22      ASN  57   4.394  -4.365   6.402
  436    H    TYR  58           H        TYR  58   4.522  -0.512   2.452
  437    HA   TYR  58           HA       TYR  58   6.891   1.010   1.601
  438    HB2  TYR  58           HB2      TYR  58   4.880  -0.760   0.170
  439    HB3  TYR  58           HB3      TYR  58   6.170   0.101  -0.647
  440    HD1  TYR  58           HD1      TYR  58   5.818  -2.333   2.239
  441    HD2  TYR  58           HD2      TYR  58   8.051  -1.182  -1.285
  442    HE1  TYR  58           HE1      TYR  58   7.373  -4.243   2.579
  443    HE2  TYR  58           HE2      TYR  58   9.548  -3.044  -0.914
  444    HH   TYR  58           HH       TYR  58   9.374  -5.406   1.699
  445    H    VAL  59           H        VAL  59   3.764   2.017   2.401
  446    HA   VAL  59           HA       VAL  59   3.902   4.181   0.392
  447    HB   VAL  59           HB       VAL  59   1.675   3.988  -0.257
  448   HG11  VAL  59          HG11      VAL  59   1.257   1.799  -1.129
  449   HG12  VAL  59          HG12      VAL  59   3.007   2.019  -1.162
  450   HG13  VAL  59          HG13      VAL  59   2.273   1.024   0.102
  451   HG21  VAL  59          HG21      VAL  59  -0.035   2.585   0.778
  452   HG22  VAL  59          HG22      VAL  59   1.134   2.139   2.069
  453   HG23  VAL  59          HG23      VAL  59   0.568   3.802   1.895
  454    H    GLU  60           H        GLU  60   2.550   6.090   1.072
  455    HA   GLU  60           HA       GLU  60   1.948   6.205   3.954
  456    HB2  GLU  60           HB2      GLU  60   4.188   7.740   2.575
  457    HB3  GLU  60           HB3      GLU  60   3.277   8.474   3.890
  458    HG2  GLU  60           HG2      GLU  60   3.793   6.294   5.229
  459    HG3  GLU  60           HG3      GLU  60   5.068   6.049   4.024
  460    H    LYS  61           H        LYS  61   0.928   8.250   4.506
  461    HA   LYS  61           HA       LYS  61  -1.203   8.893   2.686
  462    HB2  LYS  61           HB2      LYS  61  -0.254   9.884   5.383
  463    HB3  LYS  61           HB3      LYS  61  -1.393  10.881   4.471
  464    HG2  LYS  61           HG2      LYS  61  -2.966   9.085   4.251
  465    HG3  LYS  61           HG3      LYS  61  -1.832   7.930   4.976
  466    HD2  LYS  61           HD2      LYS  61  -3.395   8.451   6.682
  467    HD3  LYS  61           HD3      LYS  61  -1.899   9.309   7.098
  468    HE2  LYS  61           HE2      LYS  61  -2.955  11.354   5.939
  469    HE3  LYS  61           HE3      LYS  61  -4.458  10.421   5.890
  470    HZ1  LYS  61           HZ1      LYS  61  -3.001  11.417   8.244
  471    HZ2  LYS  61           HZ2      LYS  61  -4.032  10.162   8.409
  472    HZ3  LYS  61           HZ3      LYS  61  -4.585  11.617   7.859
  473    H    VAL  62           H        VAL  62  -1.710  11.004   1.793
  474    HA   VAL  62           HA       VAL  62   0.613  12.703   1.394
  475    HB   VAL  62           HB       VAL  62   0.629  10.875  -0.341
  476   HG11  VAL  62          HG11      VAL  62  -1.769  10.595  -0.727
  477   HG12  VAL  62          HG12      VAL  62  -1.869  12.225  -1.426
  478   HG13  VAL  62          HG13      VAL  62  -0.929  10.968  -2.238
  479   HG21  VAL  62          HG21      VAL  62   1.218  12.251  -2.212
  480   HG22  VAL  62          HG22      VAL  62   0.361  13.644  -1.531
  481   HG23  VAL  62          HG23      VAL  62   1.804  12.987  -0.709
  482    H    GLY  63           H        GLY  63   0.002  14.802   0.309
  483    HA2  GLY  63           HA2      GLY  63  -1.824  16.224  -0.460
  484    HA3  GLY  63           HA3      GLY  63  -2.838  15.554   0.811
  485    H    LEU  64           H        LEU  64  -2.240  15.942   3.025
  486    HA   LEU  64           HA       LEU  64  -1.851  18.721   3.532
  487    HB2  LEU  64           HB2      LEU  64  -1.790  16.347   5.443
  488    HB3  LEU  64           HB3      LEU  64  -1.883  18.034   5.939
  489    HG   LEU  64           HG       LEU  64  -4.017  16.499   4.412
  490   HD11  LEU  64          HD11      LEU  64  -5.342  16.925   6.506
  491   HD12  LEU  64          HD12      LEU  64  -3.838  17.535   7.268
  492   HD13  LEU  64          HD13      LEU  64  -3.967  15.860   6.716
  493   HD21  LEU  64          HD21      LEU  64  -4.010  19.409   5.331
  494   HD22  LEU  64          HD22      LEU  64  -5.447  18.515   4.777
  495   HD23  LEU  64          HD23      LEU  64  -4.129  18.790   3.659
  496    H    ALA  65           H        ALA  65  -0.360  19.580   5.161
  497    HA   ALA  65           HA       ALA  65   2.434  18.598   4.851
  498    HB1  ALA  65           HB1      ALA  65   1.375  21.457   4.988
  499    HB2  ALA  65           HB2      ALA  65   3.088  21.001   5.009
  500    HB3  ALA  65           HB3      ALA  65   2.112  20.665   3.573
  501    H    ALA  66           H        ALA  66   3.803  19.547   6.721
  502    HA   ALA  66           HA       ALA  66   4.350  19.461   8.868
  503    HB1  ALA  66           HB1      ALA  66   3.140  21.654   8.803
  504    HB2  ALA  66           HB2      ALA  66   1.724  20.822   9.496
  505    HB3  ALA  66           HB3      ALA  66   3.235  20.902  10.400
  506    H    ALA  67           H        ALA  67   2.758  17.135   7.781
  507    HA   ALA  67           HA       ALA  67   2.096  15.839  10.356
  508    HB1  ALA  67           HB1      ALA  67  -0.015  16.435   9.196
  509    HB2  ALA  67           HB2      ALA  67   0.569  15.622   7.717
  510    HB3  ALA  67           HB3      ALA  67   0.264  14.676   9.191
  511    H1   THR 101           H        THR 101  -1.140 -14.462  11.159
  512    HA   THR 101           HA       THR 101  -1.461 -12.401   9.989
  513    HB   THR 101           HB       THR 101   1.117 -13.061   8.528
  514    HG1  THR 101           HG1      THR 101   2.036 -11.618   9.952
  515   HG21  THR 101          HG21      THR 101   0.978 -10.903   7.605
  516   HG22  THR 101          HG22      THR 101  -0.456 -10.467   8.592
  517   HG23  THR 101          HG23      THR 101  -0.569 -11.663   7.284
  518    H    LYS 102           H        LYS 102  -0.171 -15.372   8.442
  519    HA   LYS 102           HA       LYS 102  -1.270 -16.975   7.292
  520    HB2  LYS 102           HB2      LYS 102  -3.323 -14.963   6.303
  521    HB3  LYS 102           HB3      LYS 102  -3.253 -16.667   5.902
  522    HG2  LYS 102           HG2      LYS 102  -3.695 -17.356   8.180
  523    HG3  LYS 102           HG3      LYS 102  -3.569 -15.699   8.760
  524    HD2  LYS 102           HD2      LYS 102  -5.525 -15.169   7.100
  525    HD3  LYS 102           HD3      LYS 102  -5.731 -16.922   7.034
  526    HE2  LYS 102           HE2      LYS 102  -7.215 -16.189   8.728
  527    HE3  LYS 102           HE3      LYS 102  -5.835 -16.879   9.599
  528    HZ1  LYS 102           HZ1      LYS 102  -6.468 -14.758  10.550
  529    HZ2  LYS 102           HZ2      LYS 102  -6.383 -14.019   9.100
  530    HZ3  LYS 102           HZ3      LYS 102  -4.997 -14.565   9.829
  531    H    GLY 103           H        GLY 103  -0.056 -13.944   6.264
  532    HA2  GLY 103           HA2      GLY 103   1.155 -15.133   3.879
  533    HA3  GLY 103           HA3      GLY 103   0.170 -13.674   3.683
  534    HA   PRO 104           HA       PRO 104   4.024 -12.586   6.392
  535    HB2  PRO 104           HB2      PRO 104   6.400 -13.467   5.416
  536    HB3  PRO 104           HB3      PRO 104   5.384 -14.479   6.483
  537    HG2  PRO 104           HG2      PRO 104   5.552 -14.573   3.455
  538    HG3  PRO 104           HG3      PRO 104   5.620 -15.934   4.611
  539    HD2  PRO 104           HD2      PRO 104   3.328 -15.143   3.297
  540    HD3  PRO 104           HD3      PRO 104   3.284 -15.854   4.945
  541    H    ALA 105           H        ALA 105   3.578 -10.569   5.689
  542    HA   ALA 105           HA       ALA 105   3.668  -9.503   3.138
  543    HB1  ALA 105           HB1      ALA 105   3.603  -7.334   4.260
  544    HB2  ALA 105           HB2      ALA 105   2.774  -8.455   5.321
  545    HB3  ALA 105           HB3      ALA 105   4.450  -7.984   5.665
  546    HA   PRO 106           HA       PRO 106   7.990  -9.023   2.181
  547    HB2  PRO 106           HB2      PRO 106   8.062  -6.901   0.494
  548    HB3  PRO 106           HB3      PRO 106   7.160  -8.438   0.317
  549    HG2  PRO 106           HG2      PRO 106   5.994  -5.837   1.286
  550    HG3  PRO 106           HG3      PRO 106   5.468  -6.805  -0.144
  551    HD2  PRO 106           HD2      PRO 106   4.385  -7.121   2.347
  552    HD3  PRO 106           HD3      PRO 106   4.563  -8.467   1.224
  553    H    ASN 107           H        ASN 107   6.835  -7.560   4.303
  554    HA   ASN 107           HA       ASN 107   8.314  -5.141   5.044
  555    HB2  ASN 107           HB2      ASN 107   7.229  -5.070   7.061
  556    HB3  ASN 107           HB3      ASN 107   6.076  -6.032   6.141
  557   HD21  ASN 107          HD21      ASN 107   8.086  -5.866   8.974
  558   HD22  ASN 107          HD22      ASN 107   7.793  -7.500   9.518
  559    HA   PRO 108           HA       PRO 108   9.367  -4.262   7.410
  560    HB2  PRO 108           HB2      PRO 108  11.934  -3.236   7.576
  561    HB3  PRO 108           HB3      PRO 108  11.180  -4.312   8.806
  562    HG2  PRO 108           HG2      PRO 108  13.014  -5.103   6.526
  563    HG3  PRO 108           HG3      PRO 108  13.160  -5.513   8.274
  564    HD2  PRO 108           HD2      PRO 108  11.993  -7.245   6.569
  565    HD3  PRO 108           HD3      PRO 108  11.227  -6.923   8.149
  566    HA   PRO 109           HA       PRO 109   9.442  -1.959   3.651
  567    HB2  PRO 109           HB2      PRO 109   9.623   0.671   4.374
  568    HB3  PRO 109           HB3      PRO 109   8.220  -0.381   4.658
  569    HG2  PRO 109           HG2      PRO 109  10.420   0.352   6.598
  570    HG3  PRO 109           HG3      PRO 109   8.654   0.355   6.882
  571    HD2  PRO 109           HD2      PRO 109  10.270  -1.728   7.629
  572    HD3  PRO 109           HD3      PRO 109   8.587  -1.974   7.106
  573    HA   PRO 110           HA       PRO 110  13.937  -1.265   2.962
  574    HB2  PRO 110           HB2      PRO 110  14.024  -2.017   0.326
  575    HB3  PRO 110           HB3      PRO 110  13.939  -3.260   1.635
  576    HG2  PRO 110           HG2      PRO 110  11.752  -2.118  -0.127
  577    HG3  PRO 110           HG3      PRO 110  12.024  -3.824   0.346
  578    HD2  PRO 110           HD2      PRO 110  10.242  -2.118   1.613
  579    HD3  PRO 110           HD3      PRO 110  11.024  -3.511   2.398
  580    H    ILE 111           H        ILE 111  15.020  -0.167   1.003
  581    HA   ILE 111           HA       ILE 111  13.398   1.852  -0.361
  582    HB   ILE 111           HB       ILE 111  14.017   2.945   1.682
  583   HG12  ILE 111          HG12      ILE 111  14.336   4.035  -0.646
  584   HG13  ILE 111          HG13      ILE 111  14.844   4.891   0.802
  585   HG21  ILE 111          HG21      ILE 111  15.792   1.603   2.593
  586   HG22  ILE 111          HG22      ILE 111  16.885   1.993   1.255
  587   HG23  ILE 111          HG23      ILE 111  16.408   3.237   2.417
  588   HD11  ILE 111          HD11      ILE 111  16.793   3.258  -0.861
  589   HD12  ILE 111          HD12      ILE 111  16.374   4.951  -1.225
  590   HD13  ILE 111          HD13      ILE 111  17.140   4.509   0.329
  591    H    LEU 112           H        LEU 112  14.409   2.459  -2.290
  592    HA   LEU 112           HA       LEU 112  16.968   1.145  -3.020
  593    HB2  LEU 112           HB2      LEU 112  16.252   0.788  -5.305
  594    HB3  LEU 112           HB3      LEU 112  15.552  -0.315  -4.165
  595    HG   LEU 112           HG       LEU 112  13.892   2.066  -5.029
  596   HD11  LEU 112          HD11      LEU 112  14.349  -0.451  -6.679
  597   HD12  LEU 112          HD12      LEU 112  14.800   1.205  -7.132
  598   HD13  LEU 112          HD13      LEU 112  13.094   0.764  -6.981
  599   HD21  LEU 112          HD21      LEU 112  12.941   0.589  -3.313
  600   HD22  LEU 112          HD22      LEU 112  13.279  -0.836  -4.314
  601   HD23  LEU 112          HD23      LEU 112  12.079   0.341  -4.849
  602    H    LYS 113           H        LYS 113  14.507   3.599  -3.954
  603    HA   LYS 113           HA       LYS 113  16.476   5.683  -3.926
  604    HB2  LYS 113           HB2      LYS 113  16.162   4.391  -6.395
  605    HB3  LYS 113           HB3      LYS 113  14.962   5.683  -6.500
  606    HG2  LYS 113           HG2      LYS 113  16.833   7.271  -5.694
  607    HG3  LYS 113           HG3      LYS 113  17.941   5.906  -5.900
  608    HD2  LYS 113           HD2      LYS 113  17.108   5.771  -8.325
  609    HD3  LYS 113           HD3      LYS 113  16.253   7.285  -8.025
  610    HE2  LYS 113           HE2      LYS 113  18.286   7.942  -9.022
  611    HE3  LYS 113           HE3      LYS 113  18.496   8.281  -7.298
  612    HZ1  LYS 113           HZ1      LYS 113  19.489   5.830  -8.643
  613    HZ2  LYS 113           HZ2      LYS 113  19.795   6.257  -7.110
  614    HZ3  LYS 113           HZ3      LYS 113  20.414   7.157  -8.343
  615    H    VAL 114           H        VAL 114  15.055   7.792  -4.704
  616    HA   VAL 114           HA       VAL 114  12.274   7.471  -3.714
  617    HB   VAL 114           HB       VAL 114  12.501   9.561  -2.439
  618   HG11  VAL 114          HG11      VAL 114  14.492   7.429  -1.546
  619   HG12  VAL 114          HG12      VAL 114  13.698   8.650  -0.528
  620   HG13  VAL 114          HG13      VAL 114  12.737   7.393  -1.308
  621   HG21  VAL 114          HG21      VAL 114  14.766  10.416  -1.834
  622   HG22  VAL 114          HG22      VAL 114  15.479   9.381  -3.098
  623   HG23  VAL 114          HG23      VAL 114  14.359  10.676  -3.527
  624    H    TRP 115           H        TRP 115  13.255   7.460  -6.437
  625    HA   TRP 115           HA       TRP 115  11.950   9.882  -7.484
  626    HB2  TRP 115           HB2      TRP 115  14.598   9.835  -7.493
  627    HB3  TRP 115           HB3      TRP 115  14.402   8.661  -8.787
  628    HD1  TRP 115           HD1      TRP 115  14.659  12.249  -8.103
  629    HE1  TRP 115           HE1      TRP 115  14.105  13.688 -10.098
  630    HE3  TRP 115           HE3      TRP 115  12.599   8.639 -11.081
  631    HZ2  TRP 115           HZ2      TRP 115  12.540  13.395 -12.559
  632    HZ3  TRP 115           HZ3      TRP 115  11.533   9.259 -13.226
  633    HH2  TRP 115           HH2      TRP 115  11.462  11.592 -13.967
  Start of MODEL    7
    1    H1   MET   1           H        MET   1 -15.216   2.464   0.953
    2    HA   MET   1           HA       MET   1 -17.103   1.058   1.065
    3    HB2  MET   1           HB2      MET   1 -15.238  -1.046   1.103
    4    HB3  MET   1           HB3      MET   1 -16.073  -1.187   2.627
    5    HG2  MET   1           HG2      MET   1 -18.256  -1.073   1.449
    6    HG3  MET   1           HG3      MET   1 -17.394  -0.977  -0.093
    7    HE1  MET   1           HE1      MET   1 -19.635  -3.182   0.398
    8    HE2  MET   1           HE2      MET   1 -18.680  -3.014  -1.089
    9    HE3  MET   1           HE3      MET   1 -18.826  -4.597  -0.305
   10    H    LYS   2           H        LYS   2 -15.697  -0.172   4.124
   11    HA   LYS   2           HA       LYS   2 -17.419   1.609   5.522
   12    HB2  LYS   2           HB2      LYS   2 -16.774   0.489   7.478
   13    HB3  LYS   2           HB3      LYS   2 -17.018  -0.700   6.206
   14    HG2  LYS   2           HG2      LYS   2 -14.611  -1.069   5.980
   15    HG3  LYS   2           HG3      LYS   2 -14.262   0.315   7.035
   16    HD2  LYS   2           HD2      LYS   2 -14.037  -1.573   8.464
   17    HD3  LYS   2           HD3      LYS   2 -15.574  -0.828   8.857
   18    HE2  LYS   2           HE2      LYS   2 -16.189  -3.030   8.811
   19    HE3  LYS   2           HE3      LYS   2 -16.552  -2.589   7.138
   20    HZ1  LYS   2           HZ1      LYS   2 -14.297  -3.476   6.596
   21    HZ2  LYS   2           HZ2      LYS   2 -15.310  -4.619   7.208
   22    HZ3  LYS   2           HZ3      LYS   2 -14.150  -3.950   8.167
   23    H    VAL   3           H        VAL   3 -14.677   2.672   4.164
   24    HA   VAL   3           HA       VAL   3 -14.392   4.765   6.118
   25    HB   VAL   3           HB       VAL   3 -11.883   4.706   5.911
   26   HG11  VAL   3          HG11      VAL   3 -11.492   3.250   7.761
   27   HG12  VAL   3          HG12      VAL   3 -13.059   4.060   7.989
   28   HG13  VAL   3          HG13      VAL   3 -13.000   2.357   7.471
   29   HG21  VAL   3          HG21      VAL   3 -11.584   3.040   4.110
   30   HG22  VAL   3          HG22      VAL   3 -10.731   2.593   5.595
   31   HG23  VAL   3          HG23      VAL   3 -12.242   1.765   5.175
   32    HA   PRO   4           HA       PRO   4 -14.547   6.847   2.247
   33    HB2  PRO   4           HB2      PRO   4 -13.413   9.282   2.769
   34    HB3  PRO   4           HB3      PRO   4 -14.971   8.760   3.471
   35    HG2  PRO   4           HG2      PRO   4 -12.208   8.536   4.732
   36    HG3  PRO   4           HG3      PRO   4 -13.672   9.289   5.444
   37    HD2  PRO   4           HD2      PRO   4 -13.030   6.740   6.035
   38    HD3  PRO   4           HD3      PRO   4 -14.738   7.162   5.697
   39    H    GLY   5           H        GLY   5 -11.478   5.791   3.475
   40    HA2  GLY   5           HA2      GLY   5  -9.775   5.043   2.149
   41    HA3  GLY   5           HA3      GLY   5 -10.355   6.033   0.819
   42    H    VAL   6           H        VAL   6  -7.646   5.763   2.461
   43    HA   VAL   6           HA       VAL   6  -7.220   8.657   3.023
   44    HB   VAL   6           HB       VAL   6  -5.581   6.220   3.779
   45   HG11  VAL   6          HG11      VAL   6  -5.100   9.174   4.385
   46   HG12  VAL   6          HG12      VAL   6  -4.202   7.815   5.093
   47   HG13  VAL   6          HG13      VAL   6  -4.080   8.135   3.363
   48   HG21  VAL   6          HG21      VAL   6  -7.228   8.175   5.445
   49   HG22  VAL   6          HG22      VAL   6  -7.621   6.486   5.143
   50   HG23  VAL   6          HG23      VAL   6  -6.193   6.889   6.097
   51    H    ARG   7           H        ARG   7  -6.102   9.809   1.540
   52    HA   ARG   7           HA       ARG   7  -5.454   8.657  -1.017
   53    HB2  ARG   7           HB2      ARG   7  -4.718  10.861  -1.652
   54    HB3  ARG   7           HB3      ARG   7  -6.267  10.941  -0.874
   55    HG2  ARG   7           HG2      ARG   7  -3.828  11.579   0.819
   56    HG3  ARG   7           HG3      ARG   7  -4.212  12.666  -0.494
   57    HD2  ARG   7           HD2      ARG   7  -6.152  11.870   1.681
   58    HD3  ARG   7           HD3      ARG   7  -5.146  13.322   1.712
   59    HE   ARG   7           HE       ARG   7  -6.411  13.421  -0.743
   60   HH11  ARG   7          HH11      ARG   7  -7.700  13.263   2.569
   61   HH12  ARG   7          HH12      ARG   7  -9.267  13.791   2.080
   62   HH21  ARG   7          HH21      ARG   7  -8.239  14.448  -1.254
   63   HH22  ARG   7          HH22      ARG   7  -9.439  14.932  -0.079
   64    H    VAL   8           H        VAL   8  -3.780   7.526  -1.566
   65    HA   VAL   8           HA       VAL   8  -1.109   8.220  -0.480
   66    HB   VAL   8           HB       VAL   8  -0.580   5.792  -0.313
   67   HG11  VAL   8          HG11      VAL   8  -1.620   5.433   1.871
   68   HG12  VAL   8          HG12      VAL   8  -1.067   7.105   1.707
   69   HG13  VAL   8          HG13      VAL   8  -2.798   6.720   1.564
   70   HG21  VAL   8          HG21      VAL   8  -2.326   4.114  -0.071
   71   HG22  VAL   8          HG22      VAL   8  -3.594   5.322  -0.351
   72   HG23  VAL   8          HG23      VAL   8  -2.480   4.873  -1.658
   73    H    ARG   9           H        ARG   9   0.685   7.476  -1.921
   74    HA   ARG   9           HA       ARG   9  -0.168   6.883  -4.707
   75    HB2  ARG   9           HB2      ARG   9   0.377   9.321  -4.483
   76    HB3  ARG   9           HB3      ARG   9   2.020   8.853  -3.997
   77    HG2  ARG   9           HG2      ARG   9   2.273   7.585  -6.128
   78    HG3  ARG   9           HG3      ARG   9   0.632   8.020  -6.606
   79    HD2  ARG   9           HD2      ARG   9   2.853  10.022  -6.075
   80    HD3  ARG   9           HD3      ARG   9   2.486   9.319  -7.670
   81    HE   ARG   9           HE       ARG   9   0.075  10.406  -6.817
   82   HH11  ARG   9          HH11      ARG   9   3.345  11.612  -7.584
   83   HH12  ARG   9          HH12      ARG   9   2.758  13.144  -8.147
   84   HH21  ARG   9          HH21      ARG   9  -0.654  12.228  -7.585
   85   HH22  ARG   9          HH22      ARG   9   0.364  13.541  -8.173
   86    H    ALA  10           H        ALA  10   1.020   5.231  -5.586
   87    HA   ALA  10           HA       ALA  10   2.820   3.741  -3.843
   88    HB1  ALA  10           HB1      ALA  10   1.982   3.414  -6.753
   89    HB2  ALA  10           HB2      ALA  10   2.979   2.250  -5.857
   90    HB3  ALA  10           HB3      ALA  10   1.295   2.545  -5.360
   91    H    LEU  11           H        LEU  11   5.029   3.760  -3.925
   92    HA   LEU  11           HA       LEU  11   6.275   5.793  -5.737
   93    HB2  LEU  11           HB2      LEU  11   7.210   4.537  -3.142
   94    HB3  LEU  11           HB3      LEU  11   8.129   5.714  -4.072
   95    HG   LEU  11           HG       LEU  11   5.423   6.216  -2.745
   96   HD11  LEU  11          HD11      LEU  11   6.860   7.712  -1.321
   97   HD12  LEU  11          HD12      LEU  11   8.284   6.939  -2.025
   98   HD13  LEU  11          HD13      LEU  11   7.139   5.966  -1.101
   99   HD21  LEU  11          HD21      LEU  11   7.261   8.173  -4.205
  100   HD22  LEU  11          HD22      LEU  11   5.819   8.594  -3.268
  101   HD23  LEU  11          HD23      LEU  11   5.642   7.650  -4.741
  102    H    TYR  12           H        TYR  12   6.003   2.395  -5.464
  103    HA   TYR  12           HA       TYR  12   8.325   2.084  -7.259
  104    HB2  TYR  12           HB2      TYR  12   7.851  -0.012  -5.162
  105    HB3  TYR  12           HB3      TYR  12   9.299   0.346  -6.068
  106    HD1  TYR  12           HD1      TYR  12   7.496   0.832  -3.037
  107    HD2  TYR  12           HD2      TYR  12  10.613   2.679  -5.413
  108    HE1  TYR  12           HE1      TYR  12   8.107   2.337  -1.124
  109    HE2  TYR  12           HE2      TYR  12  11.085   4.192  -3.583
  110    HH   TYR  12           HH       TYR  12   9.666   3.984  -0.364
  111    H    ASP  13           H        ASP  13   8.197  -0.080  -8.312
  112    HA   ASP  13           HA       ASP  13   5.381  -0.662  -9.102
  113    HB2  ASP  13           HB2      ASP  13   6.472  -1.592 -11.215
  114    HB3  ASP  13           HB3      ASP  13   6.287   0.139 -10.953
  115    H    TYR  14           H        TYR  14   4.739  -2.151  -7.779
  116    HA   TYR  14           HA       TYR  14   5.976  -4.830  -7.800
  117    HB2  TYR  14           HB2      TYR  14   5.385  -2.990  -5.528
  118    HB3  TYR  14           HB3      TYR  14   4.893  -4.654  -5.328
  119    HD1  TYR  14           HD1      TYR  14   6.361  -6.064  -4.164
  120    HD2  TYR  14           HD2      TYR  14   7.977  -2.840  -6.567
  121    HE1  TYR  14           HE1      TYR  14   8.633  -6.905  -3.792
  122    HE2  TYR  14           HE2      TYR  14  10.235  -3.668  -6.199
  123    HH   TYR  14           HH       TYR  14  11.453  -5.642  -5.561
  124    H    THR  15           H        THR  15   4.392  -6.551  -7.200
  125    HA   THR  15           HA       THR  15   1.575  -5.884  -7.753
  126    HB   THR  15           HB       THR  15   2.422  -6.302  -9.903
  127    HG1  THR  15           HG1      THR  15   0.580  -7.766  -9.066
  128   HG21  THR  15          HG21      THR  15   3.874  -8.757  -8.873
  129   HG22  THR  15          HG22      THR  15   4.594  -7.289  -9.556
  130   HG23  THR  15          HG23      THR  15   3.652  -8.363 -10.591
  131    H    GLY  16           H        GLY  16   1.402  -6.226  -5.479
  132    HA2  GLY  16           HA2      GLY  16   0.903  -7.331  -3.594
  133    HA3  GLY  16           HA3      GLY  16   0.291  -8.630  -4.652
  134    H    GLN  17           H        GLN  17   1.018 -10.102  -2.874
  135    HA   GLN  17           HA       GLN  17   3.862 -10.769  -3.236
  136    HB2  GLN  17           HB2      GLN  17   3.812  -9.504  -1.143
  137    HB3  GLN  17           HB3      GLN  17   2.574 -10.584  -0.493
  138    HG2  GLN  17           HG2      GLN  17   4.815 -11.081   0.402
  139    HG3  GLN  17           HG3      GLN  17   4.142 -12.457  -0.449
  140   HE21  GLN  17          HE21      GLN  17   5.176 -13.113  -2.477
  141   HE22  GLN  17          HE22      GLN  17   6.801 -12.551  -2.867
  142    H    GLU  18           H        GLU  18   0.489 -11.797  -2.726
  143    HA   GLU  18           HA       GLU  18   1.249 -14.425  -3.589
  144    HB2  GLU  18           HB2      GLU  18   0.701 -13.885  -0.784
  145    HB3  GLU  18           HB3      GLU  18  -0.595 -14.870  -1.451
  146    HG2  GLU  18           HG2      GLU  18   1.133 -16.419  -2.413
  147    HG3  GLU  18           HG3      GLU  18   2.395 -15.465  -1.635
  148    H    ALA  19           H        ALA  19  -1.189 -15.615  -3.522
  149    HA   ALA  19           HA       ALA  19  -2.445 -14.226  -5.721
  150    HB1  ALA  19           HB1      ALA  19  -2.113 -16.693  -5.541
  151    HB2  ALA  19           HB2      ALA  19  -3.310 -16.720  -4.220
  152    HB3  ALA  19           HB3      ALA  19  -3.777 -16.191  -5.852
  153    H    ASP  20           H        ASP  20  -2.903 -13.606  -2.400
  154    HA   ASP  20           HA       ASP  20  -5.809 -13.012  -2.793
  155    HB2  ASP  20           HB2      ASP  20  -4.774 -14.671  -1.016
  156    HB3  ASP  20           HB3      ASP  20  -4.460 -13.194  -0.114
  157    H    GLU  21           H        GLU  21  -2.943 -11.430  -3.022
  158    HA   GLU  21           HA       GLU  21  -3.741  -8.985  -1.538
  159    HB2  GLU  21           HB2      GLU  21  -1.231  -9.990  -2.957
  160    HB3  GLU  21           HB3      GLU  21  -1.357  -8.355  -2.329
  161    HG2  GLU  21           HG2      GLU  21  -0.189  -9.903  -0.808
  162    HG3  GLU  21           HG3      GLU  21  -1.579  -9.102  -0.070
  163    H    LEU  22           H        LEU  22  -3.158  -6.970  -2.612
  164    HA   LEU  22           HA       LEU  22  -4.599  -6.499  -5.116
  165    HB2  LEU  22           HB2      LEU  22  -4.977  -5.358  -2.792
  166    HB3  LEU  22           HB3      LEU  22  -3.439  -4.582  -3.045
  167    HG   LEU  22           HG       LEU  22  -4.398  -3.434  -5.076
  168   HD11  LEU  22          HD11      LEU  22  -6.126  -4.999  -5.690
  169   HD12  LEU  22          HD12      LEU  22  -6.920  -3.469  -5.270
  170   HD13  LEU  22          HD13      LEU  22  -6.942  -4.827  -4.133
  171   HD21  LEU  22          HD21      LEU  22  -4.366  -2.244  -2.973
  172   HD22  LEU  22          HD22      LEU  22  -5.832  -3.081  -2.424
  173   HD23  LEU  22          HD23      LEU  22  -5.910  -1.921  -3.767
  174    H    SER  23           H        SER  23  -3.536  -5.639  -6.913
  175    HA   SER  23           HA       SER  23  -0.577  -5.089  -6.663
  176    HB2  SER  23           HB2      SER  23  -2.254  -6.318  -8.878
  177    HB3  SER  23           HB3      SER  23  -0.660  -5.601  -9.177
  178    HG   SER  23           HG       SER  23  -1.266  -7.746  -7.387
  179    H    PHE  24           H        PHE  24   0.053  -3.066  -7.081
  180    HA   PHE  24           HA       PHE  24  -1.835  -1.216  -8.503
  181    HB2  PHE  24           HB2      PHE  24  -0.826   0.544  -7.091
  182    HB3  PHE  24           HB3      PHE  24  -1.823  -0.658  -6.282
  183    HD1  PHE  24           HD1      PHE  24   1.818   0.044  -7.029
  184    HD2  PHE  24           HD2      PHE  24  -1.098  -1.575  -4.236
  185    HE1  PHE  24           HE1      PHE  24   3.611  -0.389  -5.392
  186    HE2  PHE  24           HE2      PHE  24   0.738  -1.877  -2.591
  187    HZ   PHE  24           HZ       PHE  24   3.048  -1.370  -3.160
  188    H    LYS  25           H        LYS  25  -0.165   0.875  -9.100
  189    HA   LYS  25           HA       LYS  25   2.129  -0.245 -10.605
  190    HB2  LYS  25           HB2      LYS  25  -0.338   0.839 -11.717
  191    HB3  LYS  25           HB3      LYS  25   0.920   2.039 -11.950
  192    HG2  LYS  25           HG2      LYS  25   0.880   0.642 -13.896
  193    HG3  LYS  25           HG3      LYS  25   2.362   0.294 -13.001
  194    HD2  LYS  25           HD2      LYS  25   1.110  -1.684 -11.959
  195    HD3  LYS  25           HD3      LYS  25  -0.168  -1.401 -13.153
  196    HE2  LYS  25           HE2      LYS  25   1.323  -1.888 -14.972
  197    HE3  LYS  25           HE3      LYS  25   2.752  -1.738 -13.933
  198    HZ1  LYS  25           HZ1      LYS  25   0.759  -3.897 -13.913
  199    HZ2  LYS  25           HZ2      LYS  25   1.871  -3.721 -12.705
  200    HZ3  LYS  25           HZ3      LYS  25   2.336  -4.042 -14.256
  201    H    ALA  26           H        ALA  26   3.898   1.366 -10.875
  202    HA   ALA  26           HA       ALA  26   4.216   2.969  -8.526
  203    HB1  ALA  26           HB1      ALA  26   5.686   3.144 -11.181
  204    HB2  ALA  26           HB2      ALA  26   6.222   3.831  -9.635
  205    HB3  ALA  26           HB3      ALA  26   6.145   2.079  -9.824
  206    H    GLY  27           H        GLY  27   3.575   5.054  -8.128
  207    HA2  GLY  27           HA2      GLY  27   3.003   7.233  -8.564
  208    HA3  GLY  27           HA3      GLY  27   2.947   6.907 -10.297
  209    H    GLU  28           H        GLU  28   1.149   4.406  -9.027
  210    HA   GLU  28           HA       GLU  28  -1.351   5.642  -9.787
  211    HB2  GLU  28           HB2      GLU  28  -0.762   3.215 -10.173
  212    HB3  GLU  28           HB3      GLU  28  -0.790   2.964  -8.423
  213    HG2  GLU  28           HG2      GLU  28  -2.826   2.145  -9.362
  214    HG3  GLU  28           HG3      GLU  28  -3.204   3.535  -8.369
  215    H    GLU  29           H        GLU  29  -3.140   6.083  -8.379
  216    HA   GLU  29           HA       GLU  29  -2.383   6.415  -5.516
  217    HB2  GLU  29           HB2      GLU  29  -4.078   8.093  -7.359
  218    HB3  GLU  29           HB3      GLU  29  -4.167   8.197  -5.602
  219    HG2  GLU  29           HG2      GLU  29  -1.631   8.553  -5.619
  220    HG3  GLU  29           HG3      GLU  29  -1.737   8.731  -7.367
  221    H    LEU  30           H        LEU  30  -3.217   4.796  -4.341
  222    HA   LEU  30           HA       LEU  30  -5.920   3.746  -5.024
  223    HB2  LEU  30           HB2      LEU  30  -5.148   2.018  -3.129
  224    HB3  LEU  30           HB3      LEU  30  -4.822   1.747  -4.849
  225    HG   LEU  30           HG       LEU  30  -2.746   3.009  -3.051
  226   HD11  LEU  30          HD11      LEU  30  -1.855   0.745  -2.643
  227   HD12  LEU  30          HD12      LEU  30  -3.299   0.038  -3.405
  228   HD13  LEU  30          HD13      LEU  30  -3.436   0.979  -1.899
  229   HD21  LEU  30          HD21      LEU  30  -1.230   1.894  -4.712
  230   HD22  LEU  30          HD22      LEU  30  -2.371   2.938  -5.569
  231   HD23  LEU  30          HD23      LEU  30  -2.660   1.212  -5.532
  232    H    MET  31           H        MET  31  -7.168   3.164  -2.953
  233    HA   MET  31           HA       MET  31  -6.826   5.363  -0.955
  234    HB2  MET  31           HB2      MET  31  -9.484   4.004  -1.405
  235    HB3  MET  31           HB3      MET  31  -9.059   5.531  -0.658
  236    HG2  MET  31           HG2      MET  31  -8.942   4.953  -3.617
  237    HG3  MET  31           HG3      MET  31 -10.173   5.902  -2.791
  238    HE1  MET  31           HE1      MET  31  -8.194   9.122  -1.689
  239    HE2  MET  31           HE2      MET  31  -9.754   8.274  -1.659
  240    HE3  MET  31           HE3      MET  31  -8.386   7.684  -0.679
  241    H    LYS  32           H        LYS  32  -5.887   4.511   0.824
  242    HA   LYS  32           HA       LYS  32  -5.932   1.689   1.405
  243    HB2  LYS  32           HB2      LYS  32  -4.215   3.186   2.236
  244    HB3  LYS  32           HB3      LYS  32  -5.402   4.093   3.196
  245    HG2  LYS  32           HG2      LYS  32  -5.961   2.029   4.503
  246    HG3  LYS  32           HG3      LYS  32  -4.768   1.136   3.556
  247    HD2  LYS  32           HD2      LYS  32  -3.829   1.638   5.643
  248    HD3  LYS  32           HD3      LYS  32  -3.024   2.721   4.469
  249    HE2  LYS  32           HE2      LYS  32  -4.719   4.498   5.230
  250    HE3  LYS  32           HE3      LYS  32  -5.227   3.351   6.461
  251    HZ1  LYS  32           HZ1      LYS  32  -3.669   4.780   7.435
  252    HZ2  LYS  32           HZ2      LYS  32  -2.511   4.520   6.281
  253    HZ3  LYS  32           HZ3      LYS  32  -2.919   3.316   7.272
  254    H    ILE  33           H        ILE  33  -7.380   0.442   2.795
  255    HA   ILE  33           HA       ILE  33  -9.536   2.016   3.952
  256    HB   ILE  33           HB       ILE  33 -11.175   0.453   3.367
  257   HG12  ILE  33          HG12      ILE  33  -9.594  -1.244   1.493
  258   HG13  ILE  33          HG13      ILE  33  -9.311  -1.546   3.204
  259   HG21  ILE  33          HG21      ILE  33  -9.673   1.067   0.818
  260   HG22  ILE  33          HG22      ILE  33 -11.404   0.771   0.998
  261   HG23  ILE  33          HG23      ILE  33 -10.679   2.218   1.721
  262   HD11  ILE  33          HD11      ILE  33 -11.091  -2.983   2.367
  263   HD12  ILE  33          HD12      ILE  33 -11.730  -1.860   3.580
  264   HD13  ILE  33          HD13      ILE  33 -12.033  -1.567   1.849
  265    H    SER  34           H        SER  34  -6.998   0.519   5.092
  266    HA   SER  34           HA       SER  34  -8.408  -0.440   7.467
  267    HB2  SER  34           HB2      SER  34  -7.918  -2.327   5.676
  268    HB3  SER  34           HB3      SER  34  -6.248  -2.188   6.274
  269    HG   SER  34           HG       SER  34  -6.869  -3.294   7.942
  270    H    GLU  35           H        GLU  35  -6.383  -1.255   8.973
  271    HA   GLU  35           HA       GLU  35  -4.593   1.100   9.162
  272    HB2  GLU  35           HB2      GLU  35  -4.462   0.618  11.480
  273    HB3  GLU  35           HB3      GLU  35  -6.167   0.617  11.027
  274    HG2  GLU  35           HG2      GLU  35  -5.888  -1.974  10.804
  275    HG3  GLU  35           HG3      GLU  35  -4.391  -1.757  11.713
  276    H    GLU  36           H        GLU  36  -2.330   0.492  10.150
  277    HA   GLU  36           HA       GLU  36  -1.164  -1.420   8.364
  278    HB2  GLU  36           HB2      GLU  36  -0.233   0.808   9.018
  279    HB3  GLU  36           HB3      GLU  36   0.130   0.142  10.622
  280    HG2  GLU  36           HG2      GLU  36   1.600  -1.544   9.589
  281    HG3  GLU  36           HG3      GLU  36   1.138  -0.984   7.972
  282    H    ASP  37           H        ASP  37  -1.036  -3.462   8.639
  283    HA   ASP  37           HA       ASP  37  -1.480  -4.869  11.148
  284    HB2  ASP  37           HB2      ASP  37  -1.112  -5.541   8.281
  285    HB3  ASP  37           HB3      ASP  37  -0.500  -6.766   9.372
  286    H    GLU  38           H        GLU  38   0.177  -6.627  11.811
  287    HA   GLU  38           HA       GLU  38   2.530  -5.491  12.695
  288    HB2  GLU  38           HB2      GLU  38   1.236  -7.573  13.448
  289    HB3  GLU  38           HB3      GLU  38   2.181  -8.469  12.242
  290    HG2  GLU  38           HG2      GLU  38   4.265  -7.762  13.407
  291    HG3  GLU  38           HG3      GLU  38   3.311  -6.808  14.549
  292    H    GLN  39           H        GLN  39   2.044  -6.691   9.508
  293    HA   GLN  39           HA       GLN  39   4.971  -6.777   9.007
  294    HB2  GLN  39           HB2      GLN  39   2.845  -8.550   8.153
  295    HB3  GLN  39           HB3      GLN  39   3.451  -7.770   6.746
  296    HG2  GLN  39           HG2      GLN  39   4.689  -9.847   8.410
  297    HG3  GLN  39           HG3      GLN  39   4.834  -9.541   6.706
  298   HE21  GLN  39          HE21      GLN  39   6.492  -9.503   9.612
  299   HE22  GLN  39          HE22      GLN  39   7.922  -8.633   9.073
  300    H    GLY  40           H        GLY  40   2.898  -4.372   9.043
  301    HA2  GLY  40           HA2      GLY  40   2.912  -2.366   7.880
  302    HA3  GLY  40           HA3      GLY  40   4.207  -2.970   6.859
  303    H    TRP  41           H        TRP  41   1.230  -4.763   7.313
  304    HA   TRP  41           HA       TRP  41   0.617  -4.691   4.432
  305    HB2  TRP  41           HB2      TRP  41   0.075  -6.446   6.814
  306    HB3  TRP  41           HB3      TRP  41  -1.246  -6.306   5.672
  307    HD1  TRP  41           HD1      TRP  41   1.133  -8.684   6.432
  308    HE1  TRP  41           HE1      TRP  41   1.718 -10.135   4.408
  309    HE3  TRP  41           HE3      TRP  41  -0.526  -5.630   2.705
  310    HZ2  TRP  41           HZ2      TRP  41   1.991  -9.773   1.575
  311    HZ3  TRP  41           HZ3      TRP  41  -0.134  -6.256   0.330
  312    HH2  TRP  41           HH2      TRP  41   1.123  -8.182  -0.263
  313    H    CYS  42           H        CYS  42  -1.239  -3.574   3.648
  314    HA   CYS  42           HA       CYS  42  -3.148  -2.503   5.650
  315    HB2  CYS  42           HB2      CYS  42  -1.434  -0.954   3.690
  316    HB3  CYS  42           HB3      CYS  42  -3.080  -0.412   4.048
  317    HG   CYS  42           HG       CYS  42  -1.334   0.945   5.550
  318    H    LYS  43           H        LYS  43  -5.165  -2.966   4.975
  319    HA   LYS  43           HA       LYS  43  -5.521  -4.060   2.253
  320    HB2  LYS  43           HB2      LYS  43  -6.916  -4.247   4.794
  321    HB3  LYS  43           HB3      LYS  43  -8.047  -3.653   3.591
  322    HG2  LYS  43           HG2      LYS  43  -6.352  -5.980   2.693
  323    HG3  LYS  43           HG3      LYS  43  -7.383  -6.277   4.086
  324    HD2  LYS  43           HD2      LYS  43  -9.346  -5.401   2.746
  325    HD3  LYS  43           HD3      LYS  43  -8.267  -5.311   1.333
  326    HE2  LYS  43           HE2      LYS  43  -7.678  -7.734   1.647
  327    HE3  LYS  43           HE3      LYS  43  -8.620  -7.762   3.129
  328    HZ1  LYS  43           HZ1      LYS  43  -9.782  -8.794   1.453
  329    HZ2  LYS  43           HZ2      LYS  43  -9.748  -7.576   0.407
  330    HZ3  LYS  43           HZ3      LYS  43 -10.634  -7.432   1.806
  331    H    GLY  44           H        GLY  44  -6.486  -2.921   0.522
  332    HA2  GLY  44           HA2      GLY  44  -7.665  -0.284   1.023
  333    HA3  GLY  44           HA3      GLY  44  -6.148  -0.247   0.155
  334    H    ARG  45           H        ARG  45  -8.082   0.790  -1.237
  335    HA   ARG  45           HA       ARG  45  -9.125  -1.305  -3.058
  336    HB2  ARG  45           HB2      ARG  45 -10.813   0.018  -1.538
  337    HB3  ARG  45           HB3      ARG  45 -10.386   1.414  -2.520
  338    HG2  ARG  45           HG2      ARG  45 -11.052  -0.486  -4.450
  339    HG3  ARG  45           HG3      ARG  45 -12.125  -0.923  -3.133
  340    HD2  ARG  45           HD2      ARG  45 -11.896   1.719  -4.617
  341    HD3  ARG  45           HD3      ARG  45 -13.228   0.573  -4.662
  342    HE   ARG  45           HE       ARG  45 -12.500   2.297  -2.332
  343   HH11  ARG  45          HH11      ARG  45 -15.113   0.978  -4.504
  344   HH12  ARG  45          HH12      ARG  45 -16.312   1.646  -3.470
  345   HH21  ARG  45          HH21      ARG  45 -14.267   3.257  -1.187
  346   HH22  ARG  45          HH22      ARG  45 -15.873   3.019  -1.838
  347    H    LEU  46           H        LEU  46  -9.016  -0.868  -5.232
  348    HA   LEU  46           HA       LEU  46  -7.141   1.261  -6.058
  349    HB2  LEU  46           HB2      LEU  46  -7.831  -1.507  -7.041
  350    HB3  LEU  46           HB3      LEU  46  -7.476  -0.326  -8.308
  351    HG   LEU  46           HG       LEU  46  -5.767  -0.760  -5.887
  352   HD11  LEU  46          HD11      LEU  46  -5.960  -2.827  -7.285
  353   HD12  LEU  46          HD12      LEU  46  -4.338  -2.135  -7.156
  354   HD13  LEU  46          HD13      LEU  46  -5.291  -1.913  -8.650
  355   HD21  LEU  46          HD21      LEU  46  -5.298   1.425  -7.077
  356   HD22  LEU  46          HD22      LEU  46  -5.141   0.544  -8.603
  357   HD23  LEU  46          HD23      LEU  46  -3.966   0.297  -7.309
  358    H    LEU  47           H        LEU  47  -7.599   2.062  -8.378
  359    HA   LEU  47           HA       LEU  47  -9.909   3.690  -8.251
  360    HB2  LEU  47           HB2      LEU  47  -8.128   3.036 -10.631
  361    HB3  LEU  47           HB3      LEU  47  -9.290   4.345 -10.551
  362    HG   LEU  47           HG       LEU  47  -7.190   5.306 -10.213
  363   HD11  LEU  47          HD11      LEU  47  -8.289   5.085  -7.402
  364   HD12  LEU  47          HD12      LEU  47  -8.963   6.138  -8.677
  365   HD13  LEU  47          HD13      LEU  47  -7.310   6.387  -8.088
  366   HD21  LEU  47          HD21      LEU  47  -6.012   3.150  -9.587
  367   HD22  LEU  47          HD22      LEU  47  -6.448   3.529  -7.888
  368   HD23  LEU  47          HD23      LEU  47  -5.469   4.643  -8.828
  369    H    THR  48           H        THR  48  -9.205   0.697 -10.034
  370    HA   THR  48           HA       THR  48 -11.688   0.598 -11.452
  371    HB   THR  48           HB       THR  48  -9.548  -0.455 -12.134
  372    HG1  THR  48           HG1      THR  48 -11.844  -2.050 -11.896
  373   HG21  THR  48          HG21      THR  48 -10.099  -2.457  -9.899
  374   HG22  THR  48          HG22      THR  48  -8.686  -1.383 -10.058
  375   HG23  THR  48          HG23      THR  48  -8.953  -2.693 -11.212
  376    H    GLY  49           H        GLY  49 -11.471   0.636  -8.224
  377    HA2  GLY  49           HA2      GLY  49 -12.983   0.130  -6.648
  378    HA3  GLY  49           HA3      GLY  49 -13.904  -0.816  -7.810
  379    H    HIS  50           H        HIS  50 -10.775  -2.173  -7.890
  380    HA   HIS  50           HA       HIS  50 -11.701  -4.519  -6.504
  381    HB2  HIS  50           HB2      HIS  50 -10.262  -4.572  -8.478
  382    HB3  HIS  50           HB3      HIS  50  -9.019  -3.639  -7.651
  383    HD1  HIS  50           HD1      HIS  50 -10.701  -6.912  -6.235
  384    HD2  HIS  50           HD2      HIS  50  -7.121  -5.352  -7.831
  385    HE1  HIS  50           HE1      HIS  50  -8.924  -8.685  -5.885
  386    H    VAL  51           H        VAL  51 -10.993  -5.328  -4.411
  387    HA   VAL  51           HA       VAL  51  -9.364  -3.458  -2.803
  388    HB   VAL  51           HB       VAL  51 -11.894  -3.367  -2.464
  389   HG11  VAL  51          HG11      VAL  51 -13.015  -5.044  -1.171
  390   HG12  VAL  51          HG12      VAL  51 -12.291  -5.845  -2.568
  391   HG13  VAL  51          HG13      VAL  51 -11.532  -5.997  -0.979
  392   HG21  VAL  51          HG21      VAL  51 -11.797  -3.278  -0.012
  393   HG22  VAL  51          HG22      VAL  51 -10.168  -3.993  -0.055
  394   HG23  VAL  51          HG23      VAL  51 -10.483  -2.404  -0.799
  395    H    GLY  52           H        GLY  52  -7.888  -4.451  -1.316
  396    HA2  GLY  52           HA2      GLY  52  -7.786  -7.185  -0.633
  397    HA3  GLY  52           HA3      GLY  52  -6.814  -6.956  -2.088
  398    H    LEU  53           H        LEU  53  -5.285  -7.749  -0.111
  399    HA   LEU  53           HA       LEU  53  -4.305  -5.625   1.642
  400    HB2  LEU  53           HB2      LEU  53  -3.610  -8.502   1.026
  401    HB3  LEU  53           HB3      LEU  53  -2.327  -7.502   1.653
  402    HG   LEU  53           HG       LEU  53  -4.910  -8.156   3.083
  403   HD11  LEU  53          HD11      LEU  53  -2.958  -9.840   2.897
  404   HD12  LEU  53          HD12      LEU  53  -3.464  -9.410   4.552
  405   HD13  LEU  53          HD13      LEU  53  -1.999  -8.706   3.831
  406   HD21  LEU  53          HD21      LEU  53  -3.782  -6.967   5.028
  407   HD22  LEU  53          HD22      LEU  53  -4.358  -5.885   3.781
  408   HD23  LEU  53          HD23      LEU  53  -2.630  -6.276   3.863
  409    H    TYR  54           H        TYR  54  -2.544  -4.277   1.290
  410    HA   TYR  54           HA       TYR  54  -0.831  -4.715  -1.033
  411    HB2  TYR  54           HB2      TYR  54  -1.116  -2.664  -1.977
  412    HB3  TYR  54           HB3      TYR  54  -2.750  -3.071  -1.599
  413    HD1  TYR  54           HD1      TYR  54  -4.013  -1.788   0.051
  414    HD2  TYR  54           HD2      TYR  54   0.173  -0.961  -0.607
  415    HE1  TYR  54           HE1      TYR  54  -4.170   0.225   1.492
  416    HE2  TYR  54           HE2      TYR  54   0.015   1.002   0.775
  417    HH   TYR  54           HH       TYR  54  -1.276   2.219   2.329
  418    HA   PRO  55           HA       PRO  55   1.847  -3.788   2.397
  419    HB2  PRO  55           HB2      PRO  55   4.238  -3.375   1.181
  420    HB3  PRO  55           HB3      PRO  55   3.445  -4.983   1.237
  421    HG2  PRO  55           HG2      PRO  55   3.394  -2.933  -0.985
  422    HG3  PRO  55           HG3      PRO  55   3.740  -4.691  -1.101
  423    HD2  PRO  55           HD2      PRO  55   1.285  -3.667  -1.680
  424    HD3  PRO  55           HD3      PRO  55   1.499  -5.248  -0.881
  425    H    ALA  56           H        ALA  56   1.585  -1.892   3.535
  426    HA   ALA  56           HA       ALA  56   1.308   0.677   2.340
  427    HB1  ALA  56           HB1      ALA  56   1.765   1.457   4.760
  428    HB2  ALA  56           HB2      ALA  56   0.344   0.468   4.421
  429    HB3  ALA  56           HB3      ALA  56   1.773  -0.270   5.175
  430    H    ASN  57           H        ASN  57   4.089  -1.082   3.414
  431    HA   ASN  57           HA       ASN  57   6.088   0.879   3.588
  432    HB2  ASN  57           HB2      ASN  57   6.225  -1.960   2.462
  433    HB3  ASN  57           HB3      ASN  57   7.638  -0.971   2.785
  434   HD21  ASN  57          HD21      ASN  57   6.073  -3.572   4.028
  435   HD22  ASN  57          HD22      ASN  57   6.525  -3.273   5.708
  436    H    TYR  58           H        TYR  58   4.368  -0.055   0.659
  437    HA   TYR  58           HA       TYR  58   6.565   0.961  -1.039
  438    HB2  TYR  58           HB2      TYR  58   4.308  -0.927  -1.557
  439    HB3  TYR  58           HB3      TYR  58   5.286  -0.252  -2.856
  440    HD1  TYR  58           HD1      TYR  58   5.681  -2.049   0.403
  441    HD2  TYR  58           HD2      TYR  58   7.082  -1.653  -3.630
  442    HE1  TYR  58           HE1      TYR  58   7.482  -3.680   0.897
  443    HE2  TYR  58           HE2      TYR  58   8.879  -3.283  -3.160
  444    HH   TYR  58           HH       TYR  58  10.020  -4.451  -1.448
  445    H    VAL  59           H        VAL  59   3.950   2.331   0.438
  446    HA   VAL  59           HA       VAL  59   3.618   4.223  -1.802
  447    HB   VAL  59           HB       VAL  59   1.281   4.250  -1.687
  448   HG11  VAL  59          HG11      VAL  59   1.750   1.278  -1.193
  449   HG12  VAL  59          HG12      VAL  59   0.420   2.047  -2.085
  450   HG13  VAL  59          HG13      VAL  59   2.059   2.075  -2.739
  451   HG21  VAL  59          HG21      VAL  59   1.410   2.696   0.910
  452   HG22  VAL  59          HG22      VAL  59   0.934   4.385   0.710
  453   HG23  VAL  59          HG23      VAL  59  -0.092   3.133   0.031
  454    H    GLU  60           H        GLU  60   2.810   6.353  -1.005
  455    HA   GLU  60           HA       GLU  60   3.244   6.843   1.891
  456    HB2  GLU  60           HB2      GLU  60   4.712   8.100  -0.457
  457    HB3  GLU  60           HB3      GLU  60   4.417   9.016   1.039
  458    HG2  GLU  60           HG2      GLU  60   5.457   7.157   2.335
  459    HG3  GLU  60           HG3      GLU  60   5.949   6.400   0.824
  460    H    LYS  61           H        LYS  61   2.384   9.030   2.468
  461    HA   LYS  61           HA       LYS  61  -0.221   9.350   1.197
  462    HB2  LYS  61           HB2      LYS  61   1.218  10.559   3.535
  463    HB3  LYS  61           HB3      LYS  61   0.046  11.589   2.708
  464    HG2  LYS  61           HG2      LYS  61  -1.580   9.583   2.863
  465    HG3  LYS  61           HG3      LYS  61  -0.476   8.958   4.096
  466    HD2  LYS  61           HD2      LYS  61  -2.113  11.521   4.050
  467    HD3  LYS  61           HD3      LYS  61  -2.187  10.227   5.249
  468    HE2  LYS  61           HE2      LYS  61   0.195  12.068   4.739
  469    HE3  LYS  61           HE3      LYS  61  -0.995  12.341   6.005
  470    HZ1  LYS  61           HZ1      LYS  61   1.021  11.192   6.809
  471    HZ2  LYS  61           HZ2      LYS  61   0.719   9.919   5.853
  472    HZ3  LYS  61           HZ3      LYS  61  -0.354  10.303   7.053
  473    H    VAL  62           H        VAL  62  -0.985  11.295   0.230
  474    HA   VAL  62           HA       VAL  62   1.045  13.096  -0.859
  475    HB   VAL  62           HB       VAL  62   0.799  11.059  -2.298
  476   HG11  VAL  62          HG11      VAL  62  -1.263  10.660  -3.552
  477   HG12  VAL  62          HG12      VAL  62  -1.562  10.563  -1.809
  478   HG13  VAL  62          HG13      VAL  62  -2.064  12.000  -2.719
  479   HG21  VAL  62          HG21      VAL  62   1.460  13.253  -3.287
  480   HG22  VAL  62          HG22      VAL  62   0.747  12.083  -4.398
  481   HG23  VAL  62          HG23      VAL  62  -0.227  13.447  -3.847
  482    H    GLY  63           H        GLY  63  -0.428  14.660  -2.476
  483    HA2  GLY  63           HA2      GLY  63  -2.337  15.926  -2.737
  484    HA3  GLY  63           HA3      GLY  63  -2.964  15.354  -1.182
  485    H    LEU  64           H        LEU  64  -1.136  16.043   0.602
  486    HA   LEU  64           HA       LEU  64  -1.367  19.018   0.535
  487    HB2  LEU  64           HB2      LEU  64  -1.114  17.074   2.840
  488    HB3  LEU  64           HB3      LEU  64  -0.811  18.791   3.020
  489    HG   LEU  64           HG       LEU  64  -3.136  19.188   1.976
  490   HD11  LEU  64          HD11      LEU  64  -3.318  16.211   2.598
  491   HD12  LEU  64          HD12      LEU  64  -3.749  17.041   1.089
  492   HD13  LEU  64          HD13      LEU  64  -4.747  17.257   2.522
  493   HD21  LEU  64          HD21      LEU  64  -2.605  19.576   4.315
  494   HD22  LEU  64          HD22      LEU  64  -2.898  17.859   4.693
  495   HD23  LEU  64          HD23      LEU  64  -4.241  18.893   4.137
  496    H    ALA  65           H        ALA  65   0.360  20.251   1.742
  497    HA   ALA  65           HA       ALA  65   3.086  19.308   1.104
  498    HB1  ALA  65           HB1      ALA  65   1.733  21.924   0.328
  499    HB2  ALA  65           HB2      ALA  65   3.473  21.665   0.230
  500    HB3  ALA  65           HB3      ALA  65   2.382  20.685  -0.771
  501    H    ALA  66           H        ALA  66   4.702  20.534   2.133
  502    HA   ALA  66           HA       ALA  66   5.802  21.061   4.032
  503    HB1  ALA  66           HB1      ALA  66   5.272  23.378   4.826
  504    HB2  ALA  66           HB2      ALA  66   5.456  23.225   3.062
  505    HB3  ALA  66           HB3      ALA  66   3.840  23.354   3.771
  506    H    ALA  67           H        ALA  67   4.661  19.042   4.901
  507    HA   ALA  67           HA       ALA  67   4.085  19.356   7.641
  508    HB1  ALA  67           HB1      ALA  67   1.817  19.968   6.977
  509    HB2  ALA  67           HB2      ALA  67   1.741  18.606   5.826
  510    HB3  ALA  67           HB3      ALA  67   1.809  18.305   7.585
  511    H1   THR 101           H        THR 101   2.131 -13.567  11.534
  512    HA   THR 101           HA       THR 101  -0.073 -12.753  11.397
  513    HB   THR 101           HB       THR 101   0.547 -10.376  11.386
  514    HG1  THR 101           HG1      THR 101  -1.283  -9.821  10.357
  515   HG21  THR 101          HG21      THR 101   0.900  -9.148   9.322
  516   HG22  THR 101          HG22      THR 101   0.963 -10.645   8.379
  517   HG23  THR 101          HG23      THR 101   2.234 -10.291   9.581
  518    H    LYS 102           H        LYS 102  -1.327 -13.886  10.005
  519    HA   LYS 102           HA       LYS 102  -0.193 -15.648   8.133
  520    HB2  LYS 102           HB2      LYS 102  -2.982 -14.576   8.582
  521    HB3  LYS 102           HB3      LYS 102  -2.691 -15.676   7.251
  522    HG2  LYS 102           HG2      LYS 102  -1.616 -16.610   9.889
  523    HG3  LYS 102           HG3      LYS 102  -3.362 -16.412   9.826
  524    HD2  LYS 102           HD2      LYS 102  -2.740 -18.714   9.243
  525    HD3  LYS 102           HD3      LYS 102  -3.531 -17.896   7.881
  526    HE2  LYS 102           HE2      LYS 102  -1.226 -17.323   7.013
  527    HE3  LYS 102           HE3      LYS 102  -0.534 -18.353   8.248
  528    HZ1  LYS 102           HZ1      LYS 102  -2.322 -19.162   6.055
  529    HZ2  LYS 102           HZ2      LYS 102  -1.800 -20.211   7.234
  530    HZ3  LYS 102           HZ3      LYS 102  -0.734 -19.486   6.189
  531    H    GLY 103           H        GLY 103   0.539 -15.411   6.071
  532    HA2  GLY 103           HA2      GLY 103   0.587 -14.586   3.879
  533    HA3  GLY 103           HA3      GLY 103  -0.472 -13.263   4.333
  534    HA   PRO 104           HA       PRO 104   4.026 -12.068   5.710
  535    HB2  PRO 104           HB2      PRO 104   6.071 -12.987   4.124
  536    HB3  PRO 104           HB3      PRO 104   5.459 -13.899   5.540
  537    HG2  PRO 104           HG2      PRO 104   4.715 -14.266   2.621
  538    HG3  PRO 104           HG3      PRO 104   5.195 -15.519   3.813
  539    HD2  PRO 104           HD2      PRO 104   2.589 -14.978   3.216
  540    HD3  PRO 104           HD3      PRO 104   3.088 -15.408   4.883
  541    H    ALA 105           H        ALA 105   5.102 -10.270   4.872
  542    HA   ALA 105           HA       ALA 105   3.984  -9.055   2.457
  543    HB1  ALA 105           HB1      ALA 105   3.844  -7.794   4.530
  544    HB2  ALA 105           HB2      ALA 105   5.569  -8.074   4.878
  545    HB3  ALA 105           HB3      ALA 105   5.101  -7.006   3.580
  546    HA   PRO 106           HA       PRO 106   7.777  -9.160   0.091
  547    HB2  PRO 106           HB2      PRO 106   7.871  -6.557  -0.946
  548    HB3  PRO 106           HB3      PRO 106   6.796  -7.880  -1.465
  549    HG2  PRO 106           HG2      PRO 106   6.172  -5.586   0.344
  550    HG3  PRO 106           HG3      PRO 106   5.213  -6.266  -1.018
  551    HD2  PRO 106           HD2      PRO 106   4.713  -6.866   1.573
  552    HD3  PRO 106           HD3      PRO 106   4.485  -8.054   0.284
  553    H    ASN 107           H        ASN 107   7.429  -7.009   2.474
  554    HA   ASN 107           HA       ASN 107   9.571  -5.375   2.893
  555    HB2  ASN 107           HB2      ASN 107   7.614  -5.779   4.475
  556    HB3  ASN 107           HB3      ASN 107   8.543  -7.128   5.143
  557   HD21  ASN 107          HD21      ASN 107   8.416  -3.598   4.767
  558   HD22  ASN 107          HD22      ASN 107   9.642  -3.200   5.912
  559    HA   PRO 108           HA       PRO 108  11.739  -4.785   4.682
  560    HB2  PRO 108           HB2      PRO 108  14.214  -4.361   3.489
  561    HB3  PRO 108           HB3      PRO 108  13.898  -5.035   5.118
  562    HG2  PRO 108           HG2      PRO 108  14.408  -6.521   2.533
  563    HG3  PRO 108           HG3      PRO 108  15.110  -6.812   4.162
  564    HD2  PRO 108           HD2      PRO 108  13.049  -8.300   3.277
  565    HD3  PRO 108           HD3      PRO 108  13.050  -7.721   4.969
  566    HA   PRO 109           HA       PRO 109  10.383  -2.516   1.235
  567    HB2  PRO 109           HB2      PRO 109  11.131   0.044   1.799
  568    HB3  PRO 109           HB3      PRO 109   9.923  -0.839   2.762
  569    HG2  PRO 109           HG2      PRO 109  12.861  -0.458   3.387
  570    HG3  PRO 109           HG3      PRO 109  11.452  -0.280   4.480
  571    HD2  PRO 109           HD2      PRO 109  12.969  -2.536   4.379
  572    HD3  PRO 109           HD3      PRO 109  11.231  -2.542   4.766
  573    HA   PRO 110           HA       PRO 110  13.641  -2.323  -1.665
  574    HB2  PRO 110           HB2      PRO 110  12.829  -0.585  -3.606
  575    HB3  PRO 110           HB3      PRO 110  12.009  -2.130  -3.273
  576    HG2  PRO 110           HG2      PRO 110  11.170   0.623  -2.385
  577    HG3  PRO 110           HG3      PRO 110  10.166  -0.716  -3.018
  578    HD2  PRO 110           HD2      PRO 110  10.501  -0.132  -0.323
  579    HD3  PRO 110           HD3      PRO 110  10.089  -1.750  -0.941
  580    H    ILE 111           H        ILE 111  12.793   1.150  -1.813
  581    HA   ILE 111           HA       ILE 111  15.323   1.991  -0.580
  582    HB   ILE 111           HB       ILE 111  15.580   3.515  -2.635
  583   HG12  ILE 111          HG12      ILE 111  13.672   1.508  -3.963
  584   HG13  ILE 111          HG13      ILE 111  13.256   3.152  -3.534
  585   HG21  ILE 111          HG21      ILE 111  15.917   0.574  -3.267
  586   HG22  ILE 111          HG22      ILE 111  16.900   1.947  -3.804
  587   HG23  ILE 111          HG23      ILE 111  16.940   1.441  -2.116
  588   HD11  ILE 111          HD11      ILE 111  15.008   3.964  -5.117
  589   HD12  ILE 111          HD12      ILE 111  15.346   2.276  -5.565
  590   HD13  ILE 111          HD13      ILE 111  13.757   2.975  -5.892
  591    H    LEU 112           H        LEU 112  15.129   4.646  -1.008
  592    HA   LEU 112           HA       LEU 112  14.361   6.477   0.015
  593    HB2  LEU 112           HB2      LEU 112  11.897   5.696  -1.568
  594    HB3  LEU 112           HB3      LEU 112  12.115   7.234  -0.777
  595    HG   LEU 112           HG       LEU 112  12.515   7.648  -2.993
  596   HD11  LEU 112          HD11      LEU 112  15.311   7.353  -1.831
  597   HD12  LEU 112          HD12      LEU 112  14.171   8.675  -1.475
  598   HD13  LEU 112          HD13      LEU 112  14.788   8.444  -3.121
  599   HD21  LEU 112          HD21      LEU 112  14.460   5.342  -3.207
  600   HD22  LEU 112          HD22      LEU 112  14.044   6.481  -4.478
  601   HD23  LEU 112          HD23      LEU 112  12.809   5.378  -3.893
  602    H    LYS 113           H        LYS 113  14.600   5.352   2.126
  603    HA   LYS 113           HA       LYS 113  12.024   4.780   3.451
  604    HB2  LYS 113           HB2      LYS 113  13.278   4.032   5.334
  605    HB3  LYS 113           HB3      LYS 113  13.899   3.250   3.899
  606    HG2  LYS 113           HG2      LYS 113  15.922   4.441   3.926
  607    HG3  LYS 113           HG3      LYS 113  15.299   5.698   5.016
  608    HD2  LYS 113           HD2      LYS 113  15.145   4.170   6.867
  609    HD3  LYS 113           HD3      LYS 113  15.531   2.777   5.863
  610    HE2  LYS 113           HE2      LYS 113  17.487   5.071   5.891
  611    HE3  LYS 113           HE3      LYS 113  17.382   4.063   7.347
  612    HZ1  LYS 113           HZ1      LYS 113  17.656   2.768   4.728
  613    HZ2  LYS 113           HZ2      LYS 113  17.971   2.199   6.212
  614    HZ3  LYS 113           HZ3      LYS 113  18.985   3.335   5.570
  615    H    VAL 114           H        VAL 114  11.899   5.651   5.792
  616    HA   VAL 114           HA       VAL 114  12.561   8.556   5.897
  617    HB   VAL 114           HB       VAL 114  10.534   8.952   7.041
  618   HG11  VAL 114          HG11      VAL 114   8.891   8.488   5.368
  619   HG12  VAL 114          HG12      VAL 114  10.432   8.802   4.555
  620   HG13  VAL 114          HG13      VAL 114   9.828   7.140   4.709
  621   HG21  VAL 114          HG21      VAL 114  10.218   7.106   8.494
  622   HG22  VAL 114          HG22      VAL 114   8.825   7.118   7.410
  623   HG23  VAL 114          HG23      VAL 114  10.133   5.948   7.165
  624    H    TRP 115           H        TRP 115  13.613   5.727   7.123
  625    HA   TRP 115           HA       TRP 115  14.924   5.079   8.820
  626    HB2  TRP 115           HB2      TRP 115  14.961   7.972   9.713
  627    HB3  TRP 115           HB3      TRP 115  15.751   6.665  10.551
  628    HD1  TRP 115           HD1      TRP 115  15.932   8.528   7.245
  629    HE1  TRP 115           HE1      TRP 115  18.303   8.298   6.228
  630    HE3  TRP 115           HE3      TRP 115  17.959   5.341  10.666
  631    HZ2  TRP 115           HZ2      TRP 115  20.847   7.235   7.082
  632    HZ3  TRP 115           HZ3      TRP 115  20.371   4.832  10.633
  633    HH2  TRP 115           HH2      TRP 115  21.836   5.762   8.839
  Start of MODEL    8
    1    H1   MET   1           H        MET   1 -19.757  10.848  12.369
    2    HA   MET   1           HA       MET   1 -17.510   9.943  12.027
    3    HB2  MET   1           HB2      MET   1 -17.611   8.214  13.665
    4    HB3  MET   1           HB3      MET   1 -18.771   9.459  14.078
    5    HG2  MET   1           HG2      MET   1 -20.548   7.938  13.038
    6    HG3  MET   1           HG3      MET   1 -19.301   6.691  13.007
    7    HE1  MET   1           HE1      MET   1 -21.691   5.578  15.920
    8    HE2  MET   1           HE2      MET   1 -22.213   6.500  14.506
    9    HE3  MET   1           HE3      MET   1 -21.035   5.187  14.316
   10    H    LYS   2           H        LYS   2 -16.359   9.092  10.357
   11    HA   LYS   2           HA       LYS   2 -17.336   6.666   8.999
   12    HB2  LYS   2           HB2      LYS   2 -16.675   9.340   7.647
   13    HB3  LYS   2           HB3      LYS   2 -16.706   7.798   6.798
   14    HG2  LYS   2           HG2      LYS   2 -19.114   7.516   7.418
   15    HG3  LYS   2           HG3      LYS   2 -19.086   9.153   8.097
   16    HD2  LYS   2           HD2      LYS   2 -18.357  10.049   5.880
   17    HD3  LYS   2           HD3      LYS   2 -18.393   8.399   5.223
   18    HE2  LYS   2           HE2      LYS   2 -20.827   8.278   5.898
   19    HE3  LYS   2           HE3      LYS   2 -20.761  10.006   6.282
   20    HZ1  LYS   2           HZ1      LYS   2 -20.216  10.438   3.981
   21    HZ2  LYS   2           HZ2      LYS   2 -21.574   9.529   4.026
   22    HZ3  LYS   2           HZ3      LYS   2 -20.164   8.821   3.627
   23    H    VAL   3           H        VAL   3 -15.587   5.854   7.550
   24    HA   VAL   3           HA       VAL   3 -12.872   6.743   8.335
   25    HB   VAL   3           HB       VAL   3 -13.330   4.965   9.771
   26   HG11  VAL   3          HG11      VAL   3 -15.184   3.805   8.720
   27   HG12  VAL   3          HG12      VAL   3 -14.132   3.238   7.408
   28   HG13  VAL   3          HG13      VAL   3 -13.868   2.695   9.083
   29   HG21  VAL   3          HG21      VAL   3 -11.584   3.906   7.523
   30   HG22  VAL   3          HG22      VAL   3 -11.102   5.125   8.730
   31   HG23  VAL   3          HG23      VAL   3 -11.512   3.493   9.256
   32    HA   PRO   4           HA       PRO   4 -13.616   6.694   3.783
   33    HB2  PRO   4           HB2      PRO   4 -12.241   8.965   3.148
   34    HB3  PRO   4           HB3      PRO   4 -13.908   9.002   3.796
   35    HG2  PRO   4           HG2      PRO   4 -11.317   9.365   5.319
   36    HG3  PRO   4           HG3      PRO   4 -12.781  10.381   5.386
   37    HD2  PRO   4           HD2      PRO   4 -12.212   8.427   7.212
   38    HD3  PRO   4           HD3      PRO   4 -13.898   8.802   6.730
   39    H    GLY   5           H        GLY   5 -11.926   6.469   1.991
   40    HA2  GLY   5           HA2      GLY   5  -9.819   4.819   2.915
   41    HA3  GLY   5           HA3      GLY   5 -10.106   5.387   1.252
   42    H    VAL   6           H        VAL   6  -7.499   5.223   2.283
   43    HA   VAL   6           HA       VAL   6  -6.728   8.117   2.555
   44    HB   VAL   6           HB       VAL   6  -5.397   5.638   3.721
   45   HG11  VAL   6          HG11      VAL   6  -3.838   7.221   4.792
   46   HG12  VAL   6          HG12      VAL   6  -3.715   7.285   3.031
   47   HG13  VAL   6          HG13      VAL   6  -4.582   8.566   3.897
   48   HG21  VAL   6          HG21      VAL   6  -5.972   6.517   5.905
   49   HG22  VAL   6          HG22      VAL   6  -6.705   7.962   5.171
   50   HG23  VAL   6          HG23      VAL   6  -7.469   6.397   4.963
   51    H    ARG   7           H        ARG   7  -5.866   8.715   0.592
   52    HA   ARG   7           HA       ARG   7  -5.205   6.582  -1.297
   53    HB2  ARG   7           HB2      ARG   7  -5.285   8.024  -2.966
   54    HB3  ARG   7           HB3      ARG   7  -6.328   8.893  -1.872
   55    HG2  ARG   7           HG2      ARG   7  -3.390   9.525  -2.369
   56    HG3  ARG   7           HG3      ARG   7  -4.717  10.248  -3.227
   57    HD2  ARG   7           HD2      ARG   7  -4.147  10.563  -0.250
   58    HD3  ARG   7           HD3      ARG   7  -3.910  11.770  -1.512
   59    HE   ARG   7           HE       ARG   7  -6.288  11.312  -0.053
   60   HH11  ARG   7          HH11      ARG   7  -5.181  12.395  -3.283
   61   HH12  ARG   7          HH12      ARG   7  -6.704  13.126  -3.629
   62   HH21  ARG   7          HH21      ARG   7  -8.315  12.017  -0.685
   63   HH22  ARG   7          HH22      ARG   7  -8.574  12.765  -2.215
   64    H    VAL   8           H        VAL   8  -3.270   5.680  -1.485
   65    HA   VAL   8           HA       VAL   8  -0.920   7.178  -0.472
   66    HB   VAL   8           HB       VAL   8   0.027   5.086   0.392
   67   HG11  VAL   8          HG11      VAL   8  -2.643   5.764   1.689
   68   HG12  VAL   8          HG12      VAL   8  -1.239   5.018   2.466
   69   HG13  VAL   8          HG13      VAL   8  -1.144   6.689   1.903
   70   HG21  VAL   8          HG21      VAL   8  -1.411   3.170   0.931
   71   HG22  VAL   8          HG22      VAL   8  -2.753   3.910   0.040
   72   HG23  VAL   8          HG23      VAL   8  -1.264   3.412  -0.817
   73    H    ARG   9           H        ARG   9   0.831   7.064  -1.800
   74    HA   ARG   9           HA       ARG   9   0.255   6.005  -4.492
   75    HB2  ARG   9           HB2      ARG   9   0.663   8.437  -4.218
   76    HB3  ARG   9           HB3      ARG   9   2.296   8.086  -3.642
   77    HG2  ARG   9           HG2      ARG   9   2.765   6.965  -5.854
   78    HG3  ARG   9           HG3      ARG   9   1.099   7.315  -6.343
   79    HD2  ARG   9           HD2      ARG   9   2.533   8.953  -7.355
   80    HD3  ARG   9           HD3      ARG   9   1.577   9.769  -6.107
   81    HE   ARG   9           HE       ARG   9   4.056   8.826  -5.026
   82   HH11  ARG   9          HH11      ARG   9   2.972  11.321  -7.362
   83   HH12  ARG   9          HH12      ARG   9   4.358  12.320  -7.060
   84   HH21  ARG   9          HH21      ARG   9   5.832  10.187  -4.665
   85   HH22  ARG   9          HH22      ARG   9   6.024  11.656  -5.525
   86    H    ALA  10           H        ALA  10   1.370   4.407  -5.250
   87    HA   ALA  10           HA       ALA  10   3.251   2.934  -3.597
   88    HB1  ALA  10           HB1      ALA  10   3.418   1.545  -5.746
   89    HB2  ALA  10           HB2      ALA  10   1.796   1.667  -5.018
   90    HB3  ALA  10           HB3      ALA  10   2.214   2.650  -6.430
   91    H    LEU  11           H        LEU  11   5.366   3.280  -3.394
   92    HA   LEU  11           HA       LEU  11   6.746   5.255  -4.954
   93    HB2  LEU  11           HB2      LEU  11   7.585   3.168  -2.906
   94    HB3  LEU  11           HB3      LEU  11   8.718   4.323  -3.589
   95    HG   LEU  11           HG       LEU  11   6.152   5.419  -2.413
   96   HD11  LEU  11          HD11      LEU  11   6.755   3.890  -0.674
   97   HD12  LEU  11          HD12      LEU  11   7.193   5.526  -0.159
   98   HD13  LEU  11          HD13      LEU  11   8.442   4.398  -0.714
   99   HD21  LEU  11          HD21      LEU  11   7.617   7.297  -1.814
  100   HD22  LEU  11          HD22      LEU  11   7.753   6.919  -3.541
  101   HD23  LEU  11          HD23      LEU  11   9.030   6.434  -2.423
  102    H    TYR  12           H        TYR  12   6.412   1.747  -5.406
  103    HA   TYR  12           HA       TYR  12   7.907   1.865  -7.879
  104    HB2  TYR  12           HB2      TYR  12   9.084  -0.408  -6.784
  105    HB3  TYR  12           HB3      TYR  12   9.872   1.089  -7.178
  106    HD1  TYR  12           HD1      TYR  12   7.648  -0.111  -4.433
  107    HD2  TYR  12           HD2      TYR  12  11.373   1.881  -5.390
  108    HE1  TYR  12           HE1      TYR  12   8.149   0.184  -2.047
  109    HE2  TYR  12           HE2      TYR  12  11.922   1.985  -3.084
  110    HH   TYR  12           HH       TYR  12   9.617   1.127  -0.415
  111    H    ASP  13           H        ASP  13   7.706  -0.245  -9.028
  112    HA   ASP  13           HA       ASP  13   5.031  -1.261  -8.885
  113    HB2  ASP  13           HB2      ASP  13   7.231  -2.223 -10.750
  114    HB3  ASP  13           HB3      ASP  13   5.495  -2.196 -11.012
  115    H    TYR  14           H        TYR  14   4.584  -2.747  -7.268
  116    HA   TYR  14           HA       TYR  14   5.991  -5.347  -7.250
  117    HB2  TYR  14           HB2      TYR  14   5.781  -3.431  -4.920
  118    HB3  TYR  14           HB3      TYR  14   5.474  -5.121  -4.605
  119    HD1  TYR  14           HD1      TYR  14   7.314  -6.494  -3.891
  120    HD2  TYR  14           HD2      TYR  14   8.031  -2.948  -6.286
  121    HE1  TYR  14           HE1      TYR  14   9.684  -7.054  -4.033
  122    HE2  TYR  14           HE2      TYR  14  10.424  -3.446  -6.327
  123    HH   TYR  14           HH       TYR  14  11.940  -5.250  -6.092
  124    H    THR  15           H        THR  15   4.499  -7.094  -6.336
  125    HA   THR  15           HA       THR  15   1.698  -6.191  -5.963
  126    HB   THR  15           HB       THR  15   1.582  -6.668  -8.217
  127    HG1  THR  15           HG1      THR  15   0.116  -7.917  -6.741
  128   HG21  THR  15          HG21      THR  15   3.697  -7.717  -8.719
  129   HG22  THR  15          HG22      THR  15   2.390  -8.768  -9.283
  130   HG23  THR  15          HG23      THR  15   3.252  -9.161  -7.789
  131    H    GLY  16           H        GLY  16   2.156  -6.478  -3.820
  132    HA2  GLY  16           HA2      GLY  16   2.226  -7.677  -1.818
  133    HA3  GLY  16           HA3      GLY  16   1.233  -8.857  -2.705
  134    H    GLN  17           H        GLN  17   2.085 -10.643  -1.724
  135    HA   GLN  17           HA       GLN  17   4.827 -11.416  -2.483
  136    HB2  GLN  17           HB2      GLN  17   5.320 -12.376  -0.392
  137    HB3  GLN  17           HB3      GLN  17   4.720 -10.787  -0.039
  138    HG2  GLN  17           HG2      GLN  17   3.483 -11.839   1.532
  139    HG3  GLN  17           HG3      GLN  17   2.372 -12.150   0.212
  140   HE21  GLN  17          HE21      GLN  17   5.391 -13.640   1.553
  141   HE22  GLN  17          HE22      GLN  17   4.810 -15.303   1.478
  142    H    GLU  18           H        GLU  18   1.449 -12.061  -2.736
  143    HA   GLU  18           HA       GLU  18   2.002 -14.721  -3.746
  144    HB2  GLU  18           HB2      GLU  18   0.783 -14.128  -1.127
  145    HB3  GLU  18           HB3      GLU  18  -0.381 -14.929  -2.171
  146    HG2  GLU  18           HG2      GLU  18   2.436 -16.027  -1.898
  147    HG3  GLU  18           HG3      GLU  18   1.188 -16.378  -0.704
  148    H    ALA  19           H        ALA  19  -0.120 -15.579  -4.663
  149    HA   ALA  19           HA       ALA  19  -1.095 -13.666  -6.599
  150    HB1  ALA  19           HB1      ALA  19  -0.661 -16.081  -7.053
  151    HB2  ALA  19           HB2      ALA  19  -2.011 -16.514  -5.980
  152    HB3  ALA  19           HB3      ALA  19  -2.310 -15.602  -7.478
  153    H    ASP  20           H        ASP  20  -2.108 -14.099  -3.407
  154    HA   ASP  20           HA       ASP  20  -5.003 -13.707  -3.896
  155    HB2  ASP  20           HB2      ASP  20  -3.290 -14.907  -1.829
  156    HB3  ASP  20           HB3      ASP  20  -4.430 -13.768  -1.129
  157    H    GLU  21           H        GLU  21  -2.344 -11.804  -3.613
  158    HA   GLU  21           HA       GLU  21  -3.490  -9.587  -2.120
  159    HB2  GLU  21           HB2      GLU  21  -0.787 -10.316  -3.298
  160    HB3  GLU  21           HB3      GLU  21  -1.081  -8.750  -2.592
  161    HG2  GLU  21           HG2      GLU  21   0.035 -10.530  -1.137
  162    HG3  GLU  21           HG3      GLU  21  -1.226  -9.526  -0.444
  163    H    LEU  22           H        LEU  22  -2.811  -7.419  -3.012
  164    HA   LEU  22           HA       LEU  22  -4.217  -6.834  -5.501
  165    HB2  LEU  22           HB2      LEU  22  -4.431  -5.593  -3.241
  166    HB3  LEU  22           HB3      LEU  22  -2.794  -5.062  -3.462
  167    HG   LEU  22           HG       LEU  22  -3.952  -4.132  -5.769
  168   HD11  LEU  22          HD11      LEU  22  -6.057  -3.068  -5.225
  169   HD12  LEU  22          HD12      LEU  22  -6.091  -3.898  -3.663
  170   HD13  LEU  22          HD13      LEU  22  -6.162  -4.830  -5.184
  171   HD21  LEU  22          HD21      LEU  22  -2.456  -2.916  -4.274
  172   HD22  LEU  22          HD22      LEU  22  -3.837  -2.581  -3.213
  173   HD23  LEU  22          HD23      LEU  22  -3.820  -1.957  -4.842
  174    H    SER  23           H        SER  23  -3.080  -5.293  -7.085
  175    HA   SER  23           HA       SER  23  -0.112  -5.575  -7.154
  176    HB2  SER  23           HB2      SER  23  -0.463  -5.778  -9.651
  177    HB3  SER  23           HB3      SER  23  -0.961  -7.175  -8.701
  178    HG   SER  23           HG       SER  23  -3.120  -6.469  -8.843
  179    H    PHE  24           H        PHE  24   0.924  -3.575  -7.343
  180    HA   PHE  24           HA       PHE  24  -0.659  -1.376  -8.567
  181    HB2  PHE  24           HB2      PHE  24   0.145   0.168  -6.891
  182    HB3  PHE  24           HB3      PHE  24  -0.953  -1.041  -6.266
  183    HD1  PHE  24           HD1      PHE  24   2.805  -0.632  -6.674
  184    HD2  PHE  24           HD2      PHE  24  -0.476  -1.717  -4.075
  185    HE1  PHE  24           HE1      PHE  24   4.386  -1.004  -4.813
  186    HE2  PHE  24           HE2      PHE  24   1.134  -1.883  -2.185
  187    HZ   PHE  24           HZ       PHE  24   3.532  -1.583  -2.564
  188    H    LYS  25           H        LYS  25   0.740   0.376  -9.354
  189    HA   LYS  25           HA       LYS  25   3.464  -0.522 -10.186
  190    HB2  LYS  25           HB2      LYS  25   1.207   0.804 -11.720
  191    HB3  LYS  25           HB3      LYS  25   2.875   1.194 -12.104
  192    HG2  LYS  25           HG2      LYS  25   2.130  -0.497 -13.565
  193    HG3  LYS  25           HG3      LYS  25   3.400  -1.150 -12.542
  194    HD2  LYS  25           HD2      LYS  25   1.807  -2.472 -11.293
  195    HD3  LYS  25           HD3      LYS  25   0.423  -1.658 -12.091
  196    HE2  LYS  25           HE2      LYS  25   1.126  -2.496 -14.265
  197    HE3  LYS  25           HE3      LYS  25   2.637  -3.113 -13.590
  198    HZ1  LYS  25           HZ1      LYS  25   1.164  -4.885 -13.912
  199    HZ2  LYS  25           HZ2      LYS  25  -0.050  -4.192 -13.035
  200    HZ3  LYS  25           HZ3      LYS  25   1.339  -4.695 -12.299
  201    H    ALA  26           H        ALA  26   4.917   1.375 -10.598
  202    HA   ALA  26           HA       ALA  26   5.026   3.062  -8.303
  203    HB1  ALA  26           HB1      ALA  26   6.986   2.459  -9.680
  204    HB2  ALA  26           HB2      ALA  26   6.357   3.407 -11.029
  205    HB3  ALA  26           HB3      ALA  26   6.832   4.220  -9.513
  206    H    GLY  27           H        GLY  27   3.788   4.805  -7.852
  207    HA2  GLY  27           HA2      GLY  27   3.008   6.992  -8.308
  208    HA3  GLY  27           HA3      GLY  27   2.879   6.625 -10.019
  209    H    GLU  28           H        GLU  28   1.540   3.903  -8.735
  210    HA   GLU  28           HA       GLU  28  -1.132   4.769  -9.322
  211    HB2  GLU  28           HB2      GLU  28   0.037   2.224  -8.078
  212    HB3  GLU  28           HB3      GLU  28  -1.695   2.447  -8.302
  213    HG2  GLU  28           HG2      GLU  28   0.333   2.620 -10.571
  214    HG3  GLU  28           HG3      GLU  28  -0.636   1.190 -10.162
  215    H    GLU  29           H        GLU  29  -2.842   5.243  -8.033
  216    HA   GLU  29           HA       GLU  29  -2.274   5.804  -5.173
  217    HB2  GLU  29           HB2      GLU  29  -4.182   6.949  -7.220
  218    HB3  GLU  29           HB3      GLU  29  -4.506   7.111  -5.491
  219    HG2  GLU  29           HG2      GLU  29  -2.546   8.352  -5.078
  220    HG3  GLU  29           HG3      GLU  29  -1.802   7.884  -6.599
  221    H    LEU  30           H        LEU  30  -2.854   4.174  -3.961
  222    HA   LEU  30           HA       LEU  30  -5.345   2.654  -4.602
  223    HB2  LEU  30           HB2      LEU  30  -4.343   1.056  -2.916
  224    HB3  LEU  30           HB3      LEU  30  -3.740   0.983  -4.578
  225    HG   LEU  30           HG       LEU  30  -2.243   2.426  -2.401
  226   HD11  LEU  30          HD11      LEU  30  -2.124  -0.503  -3.210
  227   HD12  LEU  30          HD12      LEU  30  -2.641   0.125  -1.652
  228   HD13  LEU  30          HD13      LEU  30  -0.953   0.299  -2.135
  229   HD21  LEU  30          HD21      LEU  30  -1.405   2.861  -4.699
  230   HD22  LEU  30          HD22      LEU  30  -1.342   1.123  -5.018
  231   HD23  LEU  30          HD23      LEU  30  -0.267   1.870  -3.815
  232    H    MET  31           H        MET  31  -6.984   2.723  -3.131
  233    HA   MET  31           HA       MET  31  -6.651   4.602  -0.900
  234    HB2  MET  31           HB2      MET  31  -9.264   3.320  -1.745
  235    HB3  MET  31           HB3      MET  31  -8.951   4.729  -0.731
  236    HG2  MET  31           HG2      MET  31  -7.688   5.529  -2.997
  237    HG3  MET  31           HG3      MET  31  -8.910   4.464  -3.690
  238    HE1  MET  31           HE1      MET  31  -9.315   8.679  -2.171
  239    HE2  MET  31           HE2      MET  31  -8.321   7.542  -1.223
  240    HE3  MET  31           HE3      MET  31  -7.977   7.812  -2.950
  241    H    LYS  32           H        LYS  32  -5.935   3.745   0.915
  242    HA   LYS  32           HA       LYS  32  -6.143   0.974   1.630
  243    HB2  LYS  32           HB2      LYS  32  -4.441   2.474   2.472
  244    HB3  LYS  32           HB3      LYS  32  -5.651   3.514   3.218
  245    HG2  LYS  32           HG2      LYS  32  -6.315   1.105   4.432
  246    HG3  LYS  32           HG3      LYS  32  -4.580   0.908   4.188
  247    HD2  LYS  32           HD2      LYS  32  -4.573   1.903   6.250
  248    HD3  LYS  32           HD3      LYS  32  -4.463   3.356   5.270
  249    HE2  LYS  32           HE2      LYS  32  -6.981   2.176   6.567
  250    HE3  LYS  32           HE3      LYS  32  -6.085   3.570   7.122
  251    HZ1  LYS  32           HZ1      LYS  32  -6.696   4.683   5.092
  252    HZ2  LYS  32           HZ2      LYS  32  -7.982   4.258   6.001
  253    HZ3  LYS  32           HZ3      LYS  32  -7.644   3.406   4.628
  254    H    ILE  33           H        ILE  33  -7.894  -0.124   2.648
  255    HA   ILE  33           HA       ILE  33 -10.043   1.616   3.742
  256    HB   ILE  33           HB       ILE  33 -11.599   0.256   2.857
  257   HG12  ILE  33          HG12      ILE  33  -9.703  -1.848   1.797
  258   HG13  ILE  33          HG13      ILE  33 -10.548  -2.012   3.311
  259   HG21  ILE  33          HG21      ILE  33 -11.543   0.589   0.586
  260   HG22  ILE  33          HG22      ILE  33 -10.363   1.752   1.212
  261   HG23  ILE  33          HG23      ILE  33  -9.823   0.240   0.465
  262   HD11  ILE  33          HD11      ILE  33 -12.710  -1.964   2.184
  263   HD12  ILE  33          HD12      ILE  33 -11.903  -1.713   0.616
  264   HD13  ILE  33          HD13      ILE  33 -11.643  -3.222   1.500
  265    H    SER  34           H        SER  34  -7.653  -0.155   4.962
  266    HA   SER  34           HA       SER  34  -9.238  -0.990   7.285
  267    HB2  SER  34           HB2      SER  34  -9.052  -2.893   5.490
  268    HB3  SER  34           HB3      SER  34  -7.347  -2.972   5.943
  269    HG   SER  34           HG       SER  34  -9.471  -4.048   7.117
  270    H    GLU  35           H        GLU  35  -7.399  -2.076   8.834
  271    HA   GLU  35           HA       GLU  35  -5.494   0.096   9.330
  272    HB2  GLU  35           HB2      GLU  35  -5.060  -1.165  11.340
  273    HB3  GLU  35           HB3      GLU  35  -6.784  -1.206  11.061
  274    HG2  GLU  35           HG2      GLU  35  -6.461  -3.498   9.970
  275    HG3  GLU  35           HG3      GLU  35  -4.795  -3.455  10.552
  276    H    GLU  36           H        GLU  36  -3.139  -0.436   9.910
  277    HA   GLU  36           HA       GLU  36  -1.863  -2.083   7.916
  278    HB2  GLU  36           HB2      GLU  36  -1.098   0.253   8.451
  279    HB3  GLU  36           HB3      GLU  36  -0.765  -0.282  10.110
  280    HG2  GLU  36           HG2      GLU  36   0.849  -1.980   9.201
  281    HG3  GLU  36           HG3      GLU  36   0.515  -1.395   7.558
  282    H    ASP  37           H        ASP  37  -0.969  -4.029   8.432
  283    HA   ASP  37           HA       ASP  37  -1.530  -5.097  11.137
  284    HB2  ASP  37           HB2      ASP  37  -2.073  -6.156   8.680
  285    HB3  ASP  37           HB3      ASP  37  -0.517  -6.924   9.024
  286    H    GLU  38           H        GLU  38   0.120  -6.910  11.737
  287    HA   GLU  38           HA       GLU  38   2.441  -5.809  12.704
  288    HB2  GLU  38           HB2      GLU  38   3.155  -8.125  13.139
  289    HB3  GLU  38           HB3      GLU  38   1.436  -7.882  13.524
  290    HG2  GLU  38           HG2      GLU  38   0.851  -8.921  11.310
  291    HG3  GLU  38           HG3      GLU  38   2.556  -9.213  11.004
  292    H    GLN  39           H        GLN  39   2.086  -6.977   9.483
  293    HA   GLN  39           HA       GLN  39   5.018  -7.014   9.109
  294    HB2  GLN  39           HB2      GLN  39   3.033  -8.927   8.359
  295    HB3  GLN  39           HB3      GLN  39   3.557  -8.175   6.876
  296    HG2  GLN  39           HG2      GLN  39   5.160  -9.759   8.880
  297    HG3  GLN  39           HG3      GLN  39   4.867 -10.095   7.195
  298   HE21  GLN  39          HE21      GLN  39   6.776  -8.109   9.445
  299   HE22  GLN  39          HE22      GLN  39   7.773  -7.345   8.227
  300    H    GLY  40           H        GLY  40   2.821  -4.741   9.011
  301    HA2  GLY  40           HA2      GLY  40   2.766  -2.763   7.864
  302    HA3  GLY  40           HA3      GLY  40   4.111  -3.325   6.842
  303    H    TRP  41           H        TRP  41   1.166  -5.292   7.342
  304    HA   TRP  41           HA       TRP  41   0.664  -5.259   4.440
  305    HB2  TRP  41           HB2      TRP  41  -0.178  -6.901   6.818
  306    HB3  TRP  41           HB3      TRP  41  -1.387  -6.714   5.567
  307    HD1  TRP  41           HD1      TRP  41   0.719  -9.207   6.516
  308    HE1  TRP  41           HE1      TRP  41   1.237 -10.795   4.552
  309    HE3  TRP  41           HE3      TRP  41  -0.291  -6.057   2.639
  310    HZ2  TRP  41           HZ2      TRP  41   1.735 -10.474   1.701
  311    HZ3  TRP  41           HZ3      TRP  41   0.220  -6.729   0.298
  312    HH2  TRP  41           HH2      TRP  41   1.219  -8.866  -0.170
  313    H    CYS  42           H        CYS  42  -1.424  -4.526   3.545
  314    HA   CYS  42           HA       CYS  42  -3.300  -3.263   5.397
  315    HB2  CYS  42           HB2      CYS  42  -1.603  -1.794   3.349
  316    HB3  CYS  42           HB3      CYS  42  -3.259  -1.261   3.744
  317    HG   CYS  42           HG       CYS  42  -1.065  -1.895   6.054
  318    H    LYS  43           H        LYS  43  -5.349  -3.390   4.555
  319    HA   LYS  43           HA       LYS  43  -5.679  -4.634   1.877
  320    HB2  LYS  43           HB2      LYS  43  -6.612  -5.430   4.406
  321    HB3  LYS  43           HB3      LYS  43  -8.034  -4.707   3.676
  322    HG2  LYS  43           HG2      LYS  43  -6.379  -6.634   2.003
  323    HG3  LYS  43           HG3      LYS  43  -7.289  -7.301   3.337
  324    HD2  LYS  43           HD2      LYS  43  -9.390  -6.553   2.460
  325    HD3  LYS  43           HD3      LYS  43  -8.588  -5.502   1.282
  326    HE2  LYS  43           HE2      LYS  43  -9.342  -7.415   0.062
  327    HE3  LYS  43           HE3      LYS  43  -7.584  -7.459   0.198
  328    HZ1  LYS  43           HZ1      LYS  43  -7.851  -9.141   1.974
  329    HZ2  LYS  43           HZ2      LYS  43  -8.468  -9.614   0.557
  330    HZ3  LYS  43           HZ3      LYS  43  -9.493  -9.121   1.732
  331    H    GLY  44           H        GLY  44  -6.338  -3.320   0.297
  332    HA2  GLY  44           HA2      GLY  44  -8.096  -1.013   0.852
  333    HA3  GLY  44           HA3      GLY  44  -6.560  -0.747   0.127
  334    H    ARG  45           H        ARG  45  -8.107   0.127  -1.491
  335    HA   ARG  45           HA       ARG  45  -8.598  -1.883  -3.647
  336    HB2  ARG  45           HB2      ARG  45 -10.783  -1.267  -2.433
  337    HB3  ARG  45           HB3      ARG  45 -10.395   0.431  -2.717
  338    HG2  ARG  45           HG2      ARG  45 -10.652   0.012  -5.197
  339    HG3  ARG  45           HG3      ARG  45 -11.246  -1.604  -4.811
  340    HD2  ARG  45           HD2      ARG  45 -12.889  -0.358  -3.209
  341    HD3  ARG  45           HD3      ARG  45 -12.410   1.097  -4.067
  342    HE   ARG  45           HE       ARG  45 -13.201   0.063  -6.157
  343   HH11  ARG  45          HH11      ARG  45 -14.497  -1.330  -3.133
  344   HH12  ARG  45          HH12      ARG  45 -16.061  -1.648  -3.818
  345   HH21  ARG  45          HH21      ARG  45 -15.144  -0.806  -7.102
  346   HH22  ARG  45          HH22      ARG  45 -16.482  -1.129  -6.079
  347    H    LEU  46           H        LEU  46  -8.129  -1.166  -5.632
  348    HA   LEU  46           HA       LEU  46  -6.677   1.413  -5.832
  349    HB2  LEU  46           HB2      LEU  46  -6.909  -1.144  -7.406
  350    HB3  LEU  46           HB3      LEU  46  -6.498   0.307  -8.311
  351    HG   LEU  46           HG       LEU  46  -5.001  -0.337  -5.787
  352   HD11  LEU  46          HD11      LEU  46  -4.900  -2.329  -7.162
  353   HD12  LEU  46          HD12      LEU  46  -3.336  -1.494  -7.154
  354   HD13  LEU  46          HD13      LEU  46  -4.403  -1.366  -8.575
  355   HD21  LEU  46          HD21      LEU  46  -3.228   0.974  -6.920
  356   HD22  LEU  46          HD22      LEU  46  -4.723   1.914  -6.822
  357   HD23  LEU  46          HD23      LEU  46  -4.250   1.155  -8.354
  358    H    LEU  47           H        LEU  47  -6.975   2.758  -7.733
  359    HA   LEU  47           HA       LEU  47  -9.612   3.680  -8.048
  360    HB2  LEU  47           HB2      LEU  47  -8.704   5.132  -9.755
  361    HB3  LEU  47           HB3      LEU  47  -7.657   5.065  -8.361
  362    HG   LEU  47           HG       LEU  47  -6.610   3.037 -10.004
  363   HD11  LEU  47          HD11      LEU  47  -8.024   3.843 -11.922
  364   HD12  LEU  47          HD12      LEU  47  -6.288   4.048 -12.218
  365   HD13  LEU  47          HD13      LEU  47  -7.273   5.444 -11.762
  366   HD21  LEU  47          HD21      LEU  47  -5.723   5.906  -9.740
  367   HD22  LEU  47          HD22      LEU  47  -4.738   4.531 -10.324
  368   HD23  LEU  47          HD23      LEU  47  -5.353   4.542  -8.662
  369    H    THR  48           H        THR  48  -7.746   1.367 -10.017
  370    HA   THR  48           HA       THR  48  -9.702   1.109 -12.100
  371    HB   THR  48           HB       THR  48  -7.402   0.576 -12.535
  372    HG1  THR  48           HG1      THR  48  -9.020  -1.724 -12.514
  373   HG21  THR  48          HG21      THR  48  -7.626  -1.599 -10.398
  374   HG22  THR  48          HG22      THR  48  -6.539  -0.192 -10.400
  375   HG23  THR  48          HG23      THR  48  -6.298  -1.473 -11.568
  376    H    GLY  49           H        GLY  49 -10.162   0.451  -8.936
  377    HA2  GLY  49           HA2      GLY  49 -11.930  -0.644  -7.941
  378    HA3  GLY  49           HA3      GLY  49 -12.297  -1.422  -9.488
  379    H    HIS  50           H        HIS  50  -9.127  -2.126  -9.003
  380    HA   HIS  50           HA       HIS  50  -9.575  -4.886  -8.388
  381    HB2  HIS  50           HB2      HIS  50  -7.762  -4.120  -9.824
  382    HB3  HIS  50           HB3      HIS  50  -7.095  -3.131  -8.533
  383    HD1  HIS  50           HD1      HIS  50  -7.912  -6.973  -8.346
  384    HD2  HIS  50           HD2      HIS  50  -4.757  -4.178  -8.351
  385    HE1  HIS  50           HE1      HIS  50  -5.824  -8.252  -7.710
  386    H    VAL  51           H        VAL  51  -9.180  -6.031  -6.403
  387    HA   VAL  51           HA       VAL  51  -8.517  -4.425  -4.005
  388    HB   VAL  51           HB       VAL  51 -10.224  -5.622  -2.738
  389   HG11  VAL  51          HG11      VAL  51 -11.455  -4.123  -5.080
  390   HG12  VAL  51          HG12      VAL  51 -12.043  -4.256  -3.410
  391   HG13  VAL  51          HG13      VAL  51 -10.559  -3.375  -3.733
  392   HG21  VAL  51          HG21      VAL  51 -10.617  -7.629  -4.156
  393   HG22  VAL  51          HG22      VAL  51 -12.118  -6.758  -3.785
  394   HG23  VAL  51          HG23      VAL  51 -11.380  -6.598  -5.377
  395    H    GLY  52           H        GLY  52  -7.564  -5.572  -2.292
  396    HA2  GLY  52           HA2      GLY  52  -7.138  -8.219  -1.931
  397    HA3  GLY  52           HA3      GLY  52  -5.880  -7.785  -3.117
  398    H    LEU  53           H        LEU  53  -4.332  -8.230  -1.311
  399    HA   LEU  53           HA       LEU  53  -4.248  -6.216   0.884
  400    HB2  LEU  53           HB2      LEU  53  -3.316  -9.013   0.452
  401    HB3  LEU  53           HB3      LEU  53  -2.108  -7.964   1.146
  402    HG   LEU  53           HG       LEU  53  -4.843  -8.466   2.330
  403   HD11  LEU  53          HD11      LEU  53  -2.039  -9.318   3.194
  404   HD12  LEU  53          HD12      LEU  53  -3.191 -10.362   2.380
  405   HD13  LEU  53          HD13      LEU  53  -3.581  -9.703   3.991
  406   HD21  LEU  53          HD21      LEU  53  -2.529  -6.765   3.313
  407   HD22  LEU  53          HD22      LEU  53  -3.802  -7.388   4.384
  408   HD23  LEU  53          HD23      LEU  53  -4.231  -6.310   3.079
  409    H    TYR  54           H        TYR  54  -2.398  -4.783   0.970
  410    HA   TYR  54           HA       TYR  54  -0.599  -4.831  -1.367
  411    HB2  TYR  54           HB2      TYR  54  -0.802  -2.595  -1.753
  412    HB3  TYR  54           HB3      TYR  54  -2.423  -3.129  -1.595
  413    HD1  TYR  54           HD1      TYR  54  -3.844  -2.253   0.294
  414    HD2  TYR  54           HD2      TYR  54   0.325  -1.179  -0.016
  415    HE1  TYR  54           HE1      TYR  54  -4.222  -0.349   1.805
  416    HE2  TYR  54           HE2      TYR  54  -0.053   0.613   1.645
  417    HH   TYR  54           HH       TYR  54  -1.502   1.711   3.001
  418    HA   PRO  55           HA       PRO  55   2.147  -4.494   2.225
  419    HB2  PRO  55           HB2      PRO  55   4.558  -4.080   1.047
  420    HB3  PRO  55           HB3      PRO  55   3.679  -5.633   1.006
  421    HG2  PRO  55           HG2      PRO  55   3.841  -3.558  -1.173
  422    HG3  PRO  55           HG3      PRO  55   3.985  -5.324  -1.313
  423    HD2  PRO  55           HD2      PRO  55   1.597  -4.032  -1.828
  424    HD3  PRO  55           HD3      PRO  55   1.715  -5.672  -1.114
  425    H    ALA  56           H        ALA  56   1.814  -2.722   3.467
  426    HA   ALA  56           HA       ALA  56   1.632  -0.037   2.616
  427    HB1  ALA  56           HB1      ALA  56   2.307  -0.910   5.454
  428    HB2  ALA  56           HB2      ALA  56   1.374   0.490   4.933
  429    HB3  ALA  56           HB3      ALA  56   0.695  -1.128   4.777
  430    H    ASN  57           H        ASN  57   4.330  -1.979   3.726
  431    HA   ASN  57           HA       ASN  57   6.275   0.020   4.225
  432    HB2  ASN  57           HB2      ASN  57   6.612  -2.790   3.059
  433    HB3  ASN  57           HB3      ASN  57   7.933  -1.772   3.617
  434   HD21  ASN  57          HD21      ASN  57   6.106  -4.353   4.546
  435   HD22  ASN  57          HD22      ASN  57   6.258  -4.160   6.280
  436    H    TYR  58           H        TYR  58   4.859  -0.889   1.164
  437    HA   TYR  58           HA       TYR  58   7.172   0.186  -0.325
  438    HB2  TYR  58           HB2      TYR  58   4.923  -1.719  -0.944
  439    HB3  TYR  58           HB3      TYR  58   5.756  -0.920  -2.258
  440    HD1  TYR  58           HD1      TYR  58   6.517  -3.075   0.762
  441    HD2  TYR  58           HD2      TYR  58   7.584  -1.935  -3.259
  442    HE1  TYR  58           HE1      TYR  58   8.288  -4.780   0.736
  443    HE2  TYR  58           HE2      TYR  58   9.397  -3.544  -3.248
  444    HH   TYR  58           HH       TYR  58  10.156  -5.706  -0.512
  445    H    VAL  59           H        VAL  59   4.361   1.489   0.920
  446    HA   VAL  59           HA       VAL  59   4.215   3.396  -1.349
  447    HB   VAL  59           HB       VAL  59   1.863   3.355  -1.416
  448   HG11  VAL  59          HG11      VAL  59   1.222   1.160  -2.084
  449   HG12  VAL  59          HG12      VAL  59   2.943   1.246  -2.460
  450   HG13  VAL  59          HG13      VAL  59   2.409   0.385  -1.018
  451   HG21  VAL  59          HG21      VAL  59   1.886   1.576   1.040
  452   HG22  VAL  59          HG22      VAL  59   1.323   3.254   0.975
  453   HG23  VAL  59          HG23      VAL  59   0.451   2.014   0.068
  454    H    GLU  60           H        GLU  60   2.989   5.447  -0.637
  455    HA   GLU  60           HA       GLU  60   3.184   5.955   2.242
  456    HB2  GLU  60           HB2      GLU  60   4.673   7.796   2.003
  457    HB3  GLU  60           HB3      GLU  60   5.458   6.341   1.333
  458    HG2  GLU  60           HG2      GLU  60   5.165   7.113  -0.911
  459    HG3  GLU  60           HG3      GLU  60   4.089   8.418  -0.404
  460    H    LYS  61           H        LYS  61   2.288   8.194   2.745
  461    HA   LYS  61           HA       LYS  61  -0.177   8.525   1.259
  462    HB2  LYS  61           HB2      LYS  61   0.280   8.750   3.760
  463    HB3  LYS  61           HB3      LYS  61   1.023  10.313   3.410
  464    HG2  LYS  61           HG2      LYS  61  -1.081  11.230   2.681
  465    HG3  LYS  61           HG3      LYS  61  -1.848   9.620   2.636
  466    HD2  LYS  61           HD2      LYS  61  -1.645   9.363   5.039
  467    HD3  LYS  61           HD3      LYS  61  -0.650  10.832   5.162
  468    HE2  LYS  61           HE2      LYS  61  -2.573  12.166   4.346
  469    HE3  LYS  61           HE3      LYS  61  -3.582  10.700   4.353
  470    HZ1  LYS  61           HZ1      LYS  61  -2.237  11.936   6.671
  471    HZ2  LYS  61           HZ2      LYS  61  -3.125  10.524   6.731
  472    HZ3  LYS  61           HZ3      LYS  61  -3.869  11.933   6.394
  473    H    VAL  62           H        VAL  62  -0.852  10.576   0.226
  474    HA   VAL  62           HA       VAL  62   1.292  12.337  -0.696
  475    HB   VAL  62           HB       VAL  62   1.300  10.351  -2.194
  476   HG11  VAL  62          HG11      VAL  62  -1.604  11.063  -2.686
  477   HG12  VAL  62          HG12      VAL  62  -0.670  10.101  -3.810
  478   HG13  VAL  62          HG13      VAL  62  -0.921   9.515  -2.151
  479   HG21  VAL  62          HG21      VAL  62   1.349  11.463  -4.287
  480   HG22  VAL  62          HG22      VAL  62   0.268  12.742  -3.740
  481   HG23  VAL  62          HG23      VAL  62   1.916  12.609  -3.068
  482    H    GLY  63           H        GLY  63   0.182  14.129  -2.103
  483    HA2  GLY  63           HA2      GLY  63  -1.516  15.611  -2.520
  484    HA3  GLY  63           HA3      GLY  63  -2.615  14.532  -1.654
  485    H    LEU  64           H        LEU  64  -1.428  14.377   0.733
  486    HA   LEU  64           HA       LEU  64  -2.299  16.921   1.941
  487    HB2  LEU  64           HB2      LEU  64  -1.873  14.137   2.911
  488    HB3  LEU  64           HB3      LEU  64  -1.425  15.369   4.086
  489    HG   LEU  64           HG       LEU  64  -4.092  15.411   2.631
  490   HD11  LEU  64          HD11      LEU  64  -5.026  14.530   4.783
  491   HD12  LEU  64          HD12      LEU  64  -3.371  14.178   5.309
  492   HD13  LEU  64          HD13      LEU  64  -4.082  13.380   3.858
  493   HD21  LEU  64          HD21      LEU  64  -4.763  16.877   4.502
  494   HD22  LEU  64          HD22      LEU  64  -3.462  17.592   3.579
  495   HD23  LEU  64          HD23      LEU  64  -3.095  16.825   5.138
  496    H    ALA  65           H        ALA  65  -1.044  17.960   3.732
  497    HA   ALA  65           HA       ALA  65   1.416  18.900   2.762
  498    HB1  ALA  65           HB1      ALA  65   0.298  18.983   5.605
  499    HB2  ALA  65           HB2      ALA  65   1.636  19.972   4.985
  500    HB3  ALA  65           HB3      ALA  65   0.014  20.178   4.314
  501    H    ALA  66           H        ALA  66   3.558  18.609   3.404
  502    HA   ALA  66           HA       ALA  66   4.353  15.915   3.881
  503    HB1  ALA  66           HB1      ALA  66   5.980  18.489   3.901
  504    HB2  ALA  66           HB2      ALA  66   6.624  16.841   3.808
  505    HB3  ALA  66           HB3      ALA  66   5.628  17.478   2.485
  506    H    ALA  67           H        ALA  67   3.955  15.034   5.839
  507    HA   ALA  67           HA       ALA  67   4.361  16.549   8.318
  508    HB1  ALA  67           HB1      ALA  67   3.723  14.487   9.452
  509    HB2  ALA  67           HB2      ALA  67   2.530  14.869   8.202
  510    HB3  ALA  67           HB3      ALA  67   3.739  13.579   7.939
  511    H1   THR 101           H        THR 101  -1.627 -13.264  11.089
  512    HA   THR 101           HA       THR 101  -2.537 -11.663   9.696
  513    HB   THR 101           HB       THR 101  -0.749 -10.010  10.270
  514    HG1  THR 101           HG1      THR 101  -2.190  -9.250   8.899
  515   HG21  THR 101          HG21      THR 101   1.094  -9.658   8.759
  516   HG22  THR 101          HG22      THR 101   0.697 -11.111   7.820
  517   HG23  THR 101          HG23      THR 101   1.270 -11.246   9.497
  518    H    LYS 102           H        LYS 102  -2.214 -11.389   7.194
  519    HA   LYS 102           HA       LYS 102  -2.331 -14.035   6.052
  520    HB2  LYS 102           HB2      LYS 102  -2.454 -11.224   4.990
  521    HB3  LYS 102           HB3      LYS 102  -2.610 -12.606   3.910
  522    HG2  LYS 102           HG2      LYS 102  -4.445 -12.539   6.295
  523    HG3  LYS 102           HG3      LYS 102  -4.728 -11.363   5.012
  524    HD2  LYS 102           HD2      LYS 102  -4.719 -13.229   3.348
  525    HD3  LYS 102           HD3      LYS 102  -4.695 -14.382   4.687
  526    HE2  LYS 102           HE2      LYS 102  -6.835 -13.479   5.531
  527    HE3  LYS 102           HE3      LYS 102  -6.771 -12.192   4.316
  528    HZ1  LYS 102           HZ1      LYS 102  -8.174 -13.757   3.365
  529    HZ2  LYS 102           HZ2      LYS 102  -7.291 -15.041   3.873
  530    HZ3  LYS 102           HZ3      LYS 102  -6.757 -14.087   2.645
  531    H    GLY 103           H        GLY 103  -0.213 -14.830   6.493
  532    HA2  GLY 103           HA2      GLY 103   1.879 -15.457   5.896
  533    HA3  GLY 103           HA3      GLY 103   1.548 -14.754   4.316
  534    HA   PRO 104           HA       PRO 104   4.955 -12.302   6.389
  535    HB2  PRO 104           HB2      PRO 104   7.145 -13.285   5.193
  536    HB3  PRO 104           HB3      PRO 104   6.341 -14.188   6.507
  537    HG2  PRO 104           HG2      PRO 104   6.135 -14.683   3.533
  538    HG3  PRO 104           HG3      PRO 104   6.311 -15.874   4.836
  539    HD2  PRO 104           HD2      PRO 104   3.871 -15.135   3.687
  540    HD3  PRO 104           HD3      PRO 104   4.061 -15.857   5.304
  541    H    ALA 105           H        ALA 105   4.386 -10.362   5.404
  542    HA   ALA 105           HA       ALA 105   4.025  -9.897   2.651
  543    HB1  ALA 105           HB1      ALA 105   3.782  -7.616   3.338
  544    HB2  ALA 105           HB2      ALA 105   3.324  -8.520   4.747
  545    HB3  ALA 105           HB3      ALA 105   4.938  -7.820   4.677
  546    HA   PRO 106           HA       PRO 106   8.133  -9.451   1.093
  547    HB2  PRO 106           HB2      PRO 106   8.155  -7.109  -0.450
  548    HB3  PRO 106           HB3      PRO 106   7.475  -8.693  -0.891
  549    HG2  PRO 106           HG2      PRO 106   6.100  -6.218   0.109
  550    HG3  PRO 106           HG3      PRO 106   5.513  -7.400  -1.092
  551    HD2  PRO 106           HD2      PRO 106   4.800  -7.274   1.597
  552    HD3  PRO 106           HD3      PRO 106   4.566  -8.698   0.595
  553    H    ASN 107           H        ASN 107   9.736  -9.125   2.465
  554    HA   ASN 107           HA       ASN 107  10.430  -6.548   3.475
  555    HB2  ASN 107           HB2      ASN 107  10.187  -6.832   5.792
  556    HB3  ASN 107           HB3      ASN 107   8.651  -7.365   5.155
  557   HD21  ASN 107          HD21      ASN 107   8.494  -9.865   4.819
  558   HD22  ASN 107          HD22      ASN 107   9.345 -10.870   5.984
  559    HA   PRO 108           HA       PRO 108  12.192  -6.025   5.407
  560    HB2  PRO 108           HB2      PRO 108  14.688  -5.002   4.782
  561    HB3  PRO 108           HB3      PRO 108  14.377  -6.156   6.106
  562    HG2  PRO 108           HG2      PRO 108  15.361  -6.727   3.323
  563    HG3  PRO 108           HG3      PRO 108  15.999  -7.354   4.868
  564    HD2  PRO 108           HD2      PRO 108  14.295  -8.817   3.308
  565    HD3  PRO 108           HD3      PRO 108  14.169  -8.862   5.094
  566    HA   PRO 109           HA       PRO 109  11.033  -3.475   2.033
  567    HB2  PRO 109           HB2      PRO 109  11.600  -0.883   2.850
  568    HB3  PRO 109           HB3      PRO 109  10.230  -1.863   3.450
  569    HG2  PRO 109           HG2      PRO 109  12.948  -1.485   4.724
  570    HG3  PRO 109           HG3      PRO 109  11.330  -1.396   5.500
  571    HD2  PRO 109           HD2      PRO 109  12.881  -3.629   5.635
  572    HD3  PRO 109           HD3      PRO 109  11.105  -3.748   5.474
  573    HA   PRO 110           HA       PRO 110  14.777  -2.740  -0.283
  574    HB2  PRO 110           HB2      PRO 110  13.794  -1.739  -2.603
  575    HB3  PRO 110           HB3      PRO 110  13.205  -3.309  -1.987
  576    HG2  PRO 110           HG2      PRO 110  11.987  -0.571  -1.573
  577    HG3  PRO 110           HG3      PRO 110  11.175  -2.019  -2.252
  578    HD2  PRO 110           HD2      PRO 110  11.027  -1.334   0.409
  579    HD3  PRO 110           HD3      PRO 110  11.031  -3.035  -0.142
  580    H    ILE 111           H        ILE 111  15.091  -0.476  -2.071
  581    HA   ILE 111           HA       ILE 111  16.390   1.397  -0.402
  582    HB   ILE 111           HB       ILE 111  16.697   2.655  -2.444
  583   HG12  ILE 111          HG12      ILE 111  14.383   1.071  -3.641
  584   HG13  ILE 111          HG13      ILE 111  14.498   2.811  -3.356
  585   HG21  ILE 111          HG21      ILE 111  17.890   0.440  -2.177
  586   HG22  ILE 111          HG22      ILE 111  16.725  -0.267  -3.308
  587   HG23  ILE 111          HG23      ILE 111  17.801   1.049  -3.826
  588   HD11  ILE 111          HD11      ILE 111  16.340   2.928  -5.046
  589   HD12  ILE 111          HD12      ILE 111  15.966   1.229  -5.443
  590   HD13  ILE 111          HD13      ILE 111  14.730   2.483  -5.658
  591    H    LEU 112           H        LEU 112  15.713   3.512   0.261
  592    HA   LEU 112           HA       LEU 112  13.689   5.075  -0.516
  593    HB2  LEU 112           HB2      LEU 112  12.400   2.883   0.832
  594    HB3  LEU 112           HB3      LEU 112  12.369   4.192   1.947
  595    HG   LEU 112           HG       LEU 112  10.382   3.943   0.423
  596   HD11  LEU 112          HD11      LEU 112  10.803   6.019   1.653
  597   HD12  LEU 112          HD12      LEU 112   9.993   6.315   0.117
  598   HD13  LEU 112          HD13      LEU 112  11.718   6.671   0.258
  599   HD21  LEU 112          HD21      LEU 112  10.334   4.767  -1.834
  600   HD22  LEU 112          HD22      LEU 112  11.592   3.584  -1.781
  601   HD23  LEU 112          HD23      LEU 112  12.012   5.303  -1.771
  602    H    LYS 113           H        LYS 113  12.932   6.438   1.704
  603    HA   LYS 113           HA       LYS 113  14.870   6.826   3.699
  604    HB2  LYS 113           HB2      LYS 113  15.874   8.951   2.928
  605    HB3  LYS 113           HB3      LYS 113  16.320   7.651   1.845
  606    HG2  LYS 113           HG2      LYS 113  14.554   8.353   0.231
  607    HG3  LYS 113           HG3      LYS 113  14.104   9.681   1.318
  608    HD2  LYS 113           HD2      LYS 113  16.456  10.534   1.159
  609    HD3  LYS 113           HD3      LYS 113  16.788   9.308  -0.080
  610    HE2  LYS 113           HE2      LYS 113  14.612  11.462  -0.210
  611    HE3  LYS 113           HE3      LYS 113  16.162  11.558  -1.024
  612    HZ1  LYS 113           HZ1      LYS 113  15.561   9.621  -2.343
  613    HZ2  LYS 113           HZ2      LYS 113  14.374  10.769  -2.457
  614    HZ3  LYS 113           HZ3      LYS 113  14.141   9.451  -1.531
  615    H    VAL 114           H        VAL 114  14.381   9.597   4.165
  616    HA   VAL 114           HA       VAL 114  11.462   9.934   3.984
  617    HB   VAL 114           HB       VAL 114  11.856   8.949   6.141
  618   HG11  VAL 114          HG11      VAL 114  13.251   9.942   7.889
  619   HG12  VAL 114          HG12      VAL 114  14.235   9.393   6.535
  620   HG13  VAL 114          HG13      VAL 114  13.895  11.125   6.733
  621   HG21  VAL 114          HG21      VAL 114  10.921  10.660   7.593
  622   HG22  VAL 114          HG22      VAL 114  11.455  11.942   6.476
  623   HG23  VAL 114          HG23      VAL 114  10.203  10.777   5.982
  624    H    TRP 115           H        TRP 115  10.968  11.985   3.380
  625    HA   TRP 115           HA       TRP 115  11.215  13.999   2.440
  626    HB2  TRP 115           HB2      TRP 115  12.919  14.299   4.921
  627    HB3  TRP 115           HB3      TRP 115  12.656  15.600   3.797
  628    HD1  TRP 115           HD1      TRP 115   9.819  13.271   5.070
  629    HE1  TRP 115           HE1      TRP 115   8.039  14.766   6.230
  630    HE3  TRP 115           HE3      TRP 115  12.224  17.761   4.727
  631    HZ2  TRP 115           HZ2      TRP 115   7.669  17.571   6.719
  632    HZ3  TRP 115           HZ3      TRP 115  11.076  19.853   5.389
  633    HH2  TRP 115           HH2      TRP 115   8.777  19.774   6.322
  Start of MODEL    9
    1    H1   MET   1           H        MET   1 -19.085   2.768  11.987
    2    HA   MET   1           HA       MET   1 -17.260   1.991  10.564
    3    HB2  MET   1           HB2      MET   1 -19.428   2.123   8.414
    4    HB3  MET   1           HB3      MET   1 -17.693   2.006   8.098
    5    HG2  MET   1           HG2      MET   1 -17.657  -0.157   9.339
    6    HG3  MET   1           HG3      MET   1 -19.406  -0.049   9.529
    7    HE1  MET   1           HE1      MET   1 -16.368  -0.433   7.139
    8    HE2  MET   1           HE2      MET   1 -17.106  -0.754   5.555
    9    HE3  MET   1           HE3      MET   1 -17.197   0.861   6.258
   10    H    LYS   2           H        LYS   2 -16.028   3.885  10.708
   11    HA   LYS   2           HA       LYS   2 -16.999   6.294   9.258
   12    HB2  LYS   2           HB2      LYS   2 -16.210   6.189  12.208
   13    HB3  LYS   2           HB3      LYS   2 -16.364   7.674  11.246
   14    HG2  LYS   2           HG2      LYS   2 -18.722   7.207  10.801
   15    HG3  LYS   2           HG3      LYS   2 -18.638   5.715  11.764
   16    HD2  LYS   2           HD2      LYS   2 -18.171   6.914  13.782
   17    HD3  LYS   2           HD3      LYS   2 -17.969   8.448  12.898
   18    HE2  LYS   2           HE2      LYS   2 -20.291   8.467  12.216
   19    HE3  LYS   2           HE3      LYS   2 -20.548   6.826  12.830
   20    HZ1  LYS   2           HZ1      LYS   2 -21.415   8.415  14.344
   21    HZ2  LYS   2           HZ2      LYS   2 -19.927   9.178  14.492
   22    HZ3  LYS   2           HZ3      LYS   2 -20.156   7.631  15.036
   23    H    VAL   3           H        VAL   3 -15.148   4.692   8.113
   24    HA   VAL   3           HA       VAL   3 -12.662   6.197   8.655
   25    HB   VAL   3           HB       VAL   3 -12.488   4.184   9.851
   26   HG11  VAL   3          HG11      VAL   3 -12.316   1.970   8.823
   27   HG12  VAL   3          HG12      VAL   3 -13.944   2.638   8.686
   28   HG13  VAL   3          HG13      VAL   3 -12.872   2.626   7.274
   29   HG21  VAL   3          HG21      VAL   3 -10.515   5.196   9.002
   30   HG22  VAL   3          HG22      VAL   3 -10.333   3.434   8.919
   31   HG23  VAL   3          HG23      VAL   3 -10.672   4.373   7.449
   32    HA   PRO   4           HA       PRO   4 -13.487   6.706   4.211
   33    HB2  PRO   4           HB2      PRO   4 -11.967   8.922   3.811
   34    HB3  PRO   4           HB3      PRO   4 -13.533   9.000   4.676
   35    HG2  PRO   4           HG2      PRO   4 -10.738   8.919   5.838
   36    HG3  PRO   4           HG3      PRO   4 -12.119   9.967   6.302
   37    HD2  PRO   4           HD2      PRO   4 -11.436   7.626   7.599
   38    HD3  PRO   4           HD3      PRO   4 -13.106   8.282   7.553
   39    H    GLY   5           H        GLY   5 -12.131   6.192   2.282
   40    HA2  GLY   5           HA2      GLY   5  -9.787   4.662   2.929
   41    HA3  GLY   5           HA3      GLY   5 -10.454   5.035   1.314
   42    H    VAL   6           H        VAL   6  -7.637   5.364   2.604
   43    HA   VAL   6           HA       VAL   6  -7.296   8.299   2.213
   44    HB   VAL   6           HB       VAL   6  -5.030   7.858   3.164
   45   HG11  VAL   6          HG11      VAL   6  -6.007   7.901   5.529
   46   HG12  VAL   6          HG12      VAL   6  -6.755   9.040   4.401
   47   HG13  VAL   6          HG13      VAL   6  -7.580   7.529   4.815
   48   HG21  VAL   6          HG21      VAL   6  -6.273   5.268   4.175
   49   HG22  VAL   6          HG22      VAL   6  -4.890   5.436   3.051
   50   HG23  VAL   6          HG23      VAL   6  -4.750   5.992   4.711
   51    H    ARG   7           H        ARG   7  -6.581   8.993   0.344
   52    HA   ARG   7           HA       ARG   7  -5.805   7.150  -1.736
   53    HB2  ARG   7           HB2      ARG   7  -5.708   9.040  -3.146
   54    HB3  ARG   7           HB3      ARG   7  -7.070   9.269  -2.095
   55    HG2  ARG   7           HG2      ARG   7  -4.418  10.749  -1.972
   56    HG3  ARG   7           HG3      ARG   7  -5.986  11.359  -2.487
   57    HD2  ARG   7           HD2      ARG   7  -6.835  10.888  -0.128
   58    HD3  ARG   7           HD3      ARG   7  -5.140  10.625   0.328
   59    HE   ARG   7           HE       ARG   7  -5.666  13.144  -1.054
   60   HH11  ARG   7          HH11      ARG   7  -5.124  11.560   2.067
   61   HH12  ARG   7          HH12      ARG   7  -5.161  12.994   3.008
   62   HH21  ARG   7          HH21      ARG   7  -5.790  15.114   0.221
   63   HH22  ARG   7          HH22      ARG   7  -5.437  15.077   1.910
   64    H    VAL   8           H        VAL   8  -3.805   6.402  -2.187
   65    HA   VAL   8           HA       VAL   8  -1.454   7.922  -1.276
   66    HB   VAL   8           HB       VAL   8  -0.332   6.066  -0.289
   67   HG11  VAL   8          HG11      VAL   8  -1.743   7.263   1.226
   68   HG12  VAL   8          HG12      VAL   8  -3.123   6.233   0.883
   69   HG13  VAL   8          HG13      VAL   8  -1.709   5.552   1.692
   70   HG21  VAL   8          HG21      VAL   8  -1.419   3.841   0.056
   71   HG22  VAL   8          HG22      VAL   8  -2.624   4.363  -1.164
   72   HG23  VAL   8          HG23      VAL   8  -0.915   4.223  -1.593
   73    H    ARG   9           H        ARG   9   0.542   7.074  -2.434
   74    HA   ARG   9           HA       ARG   9  -0.140   5.881  -5.094
   75    HB2  ARG   9           HB2      ARG   9   0.036   8.473  -4.931
   76    HB3  ARG   9           HB3      ARG   9   1.773   8.219  -4.782
   77    HG2  ARG   9           HG2      ARG   9   1.855   7.217  -7.003
   78    HG3  ARG   9           HG3      ARG   9   0.088   7.040  -7.046
   79    HD2  ARG   9           HD2      ARG   9  -0.033   9.617  -6.871
   80    HD3  ARG   9           HD3      ARG   9   1.703   9.612  -7.229
   81    HE   ARG   9           HE       ARG   9  -0.104   8.106  -9.035
   82   HH11  ARG   9          HH11      ARG   9   1.492  11.247  -8.682
   83   HH12  ARG   9          HH12      ARG   9   1.774  11.430 -10.386
   84   HH21  ARG   9          HH21      ARG   9   0.105   8.427 -11.274
   85   HH22  ARG   9          HH22      ARG   9   1.243   9.617 -11.813
   86    H    ALA  10           H        ALA  10   1.482   4.644  -5.936
   87    HA   ALA  10           HA       ALA  10   3.346   3.581  -3.925
   88    HB1  ALA  10           HB1      ALA  10   2.858   2.538  -6.730
   89    HB2  ALA  10           HB2      ALA  10   3.696   1.757  -5.397
   90    HB3  ALA  10           HB3      ALA  10   1.941   2.034  -5.289
   91    H    LEU  11           H        LEU  11   5.439   3.886  -3.844
   92    HA   LEU  11           HA       LEU  11   6.615   5.716  -5.863
   93    HB2  LEU  11           HB2      LEU  11   7.490   4.895  -3.087
   94    HB3  LEU  11           HB3      LEU  11   8.559   5.693  -4.221
   95    HG   LEU  11           HG       LEU  11   6.499   7.400  -4.467
   96   HD11  LEU  11          HD11      LEU  11   5.480   7.812  -2.252
   97   HD12  LEU  11          HD12      LEU  11   6.251   6.327  -1.630
   98   HD13  LEU  11          HD13      LEU  11   5.010   6.245  -2.905
   99   HD21  LEU  11          HD21      LEU  11   7.609   8.830  -2.755
  100   HD22  LEU  11          HD22      LEU  11   8.737   8.097  -3.905
  101   HD23  LEU  11          HD23      LEU  11   8.597   7.439  -2.264
  102    H    TYR  12           H        TYR  12   6.249   2.429  -5.634
  103    HA   TYR  12           HA       TYR  12   8.528   1.896  -7.398
  104    HB2  TYR  12           HB2      TYR  12   7.901  -0.024  -5.117
  105    HB3  TYR  12           HB3      TYR  12   9.314   0.025  -6.148
  106    HD1  TYR  12           HD1      TYR  12   7.716   1.479  -3.091
  107    HD2  TYR  12           HD2      TYR  12  11.126   1.823  -5.768
  108    HE1  TYR  12           HE1      TYR  12   8.629   3.234  -1.743
  109    HE2  TYR  12           HE2      TYR  12  11.893   3.692  -4.514
  110    HH   TYR  12           HH       TYR  12  11.341   5.250  -2.788
  111    H    ASP  13           H        ASP  13   8.079  -0.383  -8.405
  112    HA   ASP  13           HA       ASP  13   5.123  -0.732  -8.768
  113    HB2  ASP  13           HB2      ASP  13   5.697  -1.807 -10.968
  114    HB3  ASP  13           HB3      ASP  13   5.806  -0.060 -10.835
  115    H    TYR  14           H        TYR  14   4.587  -2.211  -7.314
  116    HA   TYR  14           HA       TYR  14   5.857  -4.892  -7.484
  117    HB2  TYR  14           HB2      TYR  14   5.736  -3.077  -5.105
  118    HB3  TYR  14           HB3      TYR  14   5.213  -4.715  -4.809
  119    HD1  TYR  14           HD1      TYR  14   6.861  -6.345  -4.113
  120    HD2  TYR  14           HD2      TYR  14   8.077  -2.881  -6.448
  121    HE1  TYR  14           HE1      TYR  14   9.126  -7.228  -4.274
  122    HE2  TYR  14           HE2      TYR  14  10.361  -3.741  -6.527
  123    HH   TYR  14           HH       TYR  14  11.797  -5.433  -5.806
  124    H    THR  15           H        THR  15   4.412  -6.621  -7.317
  125    HA   THR  15           HA       THR  15   1.525  -5.858  -7.081
  126    HB   THR  15           HB       THR  15   2.939  -7.998  -8.711
  127    HG1  THR  15           HG1      THR  15   2.581  -5.802  -9.578
  128   HG21  THR  15          HG21      THR  15   0.500  -8.578  -9.427
  129   HG22  THR  15          HG22      THR  15   0.031  -7.772  -7.913
  130   HG23  THR  15          HG23      THR  15   1.076  -9.176  -7.875
  131    H    GLY  16           H        GLY  16   1.639  -6.042  -4.812
  132    HA2  GLY  16           HA2      GLY  16   1.699  -7.189  -2.791
  133    HA3  GLY  16           HA3      GLY  16   0.973  -8.400  -3.828
  134    H    GLN  17           H        GLN  17   1.877  -9.998  -2.449
  135    HA   GLN  17           HA       GLN  17   4.542 -10.733  -3.188
  136    HB2  GLN  17           HB2      GLN  17   4.955  -9.532  -1.057
  137    HB3  GLN  17           HB3      GLN  17   3.845 -10.613  -0.213
  138    HG2  GLN  17           HG2      GLN  17   6.158 -11.149   0.286
  139    HG3  GLN  17           HG3      GLN  17   5.399 -12.490  -0.557
  140   HE21  GLN  17          HE21      GLN  17   5.862 -12.654  -2.947
  141   HE22  GLN  17          HE22      GLN  17   7.370 -12.060  -3.584
  142    H    GLU  18           H        GLU  18   1.328 -11.565  -2.411
  143    HA   GLU  18           HA       GLU  18   1.809 -14.476  -2.655
  144    HB2  GLU  18           HB2      GLU  18   0.698 -13.103  -0.479
  145    HB3  GLU  18           HB3      GLU  18  -0.702 -13.357  -1.455
  146    HG2  GLU  18           HG2      GLU  18  -0.866 -15.320  -0.406
  147    HG3  GLU  18           HG3      GLU  18   0.294 -15.890  -1.583
  148    H    ALA  19           H        ALA  19  -0.820 -15.229  -3.193
  149    HA   ALA  19           HA       ALA  19  -1.314 -14.157  -5.876
  150    HB1  ALA  19           HB1      ALA  19  -2.683 -16.163  -6.138
  151    HB2  ALA  19           HB2      ALA  19  -1.069 -16.596  -5.537
  152    HB3  ALA  19           HB3      ALA  19  -2.462 -16.577  -4.425
  153    H    ASP  20           H        ASP  20  -2.433 -13.320  -2.833
  154    HA   ASP  20           HA       ASP  20  -5.203 -12.671  -3.739
  155    HB2  ASP  20           HB2      ASP  20  -4.429 -13.056  -0.846
  156    HB3  ASP  20           HB3      ASP  20  -6.033 -13.067  -1.559
  157    H    GLU  21           H        GLU  21  -2.953 -10.962  -4.091
  158    HA   GLU  21           HA       GLU  21  -3.423  -8.728  -2.195
  159    HB2  GLU  21           HB2      GLU  21  -1.007  -8.164  -3.059
  160    HB3  GLU  21           HB3      GLU  21  -1.283  -9.316  -1.770
  161    HG2  GLU  21           HG2      GLU  21   0.348 -10.226  -3.385
  162    HG3  GLU  21           HG3      GLU  21  -1.051 -11.206  -3.253
  163    H    LEU  22           H        LEU  22  -2.599  -6.622  -3.247
  164    HA   LEU  22           HA       LEU  22  -4.299  -6.065  -5.627
  165    HB2  LEU  22           HB2      LEU  22  -3.050  -4.398  -3.384
  166    HB3  LEU  22           HB3      LEU  22  -3.493  -3.660  -4.915
  167    HG   LEU  22           HG       LEU  22  -5.404  -5.015  -3.044
  168   HD11  LEU  22          HD11      LEU  22  -4.623  -2.825  -2.240
  169   HD12  LEU  22          HD12      LEU  22  -6.324  -2.776  -2.728
  170   HD13  LEU  22          HD13      LEU  22  -5.095  -2.087  -3.787
  171   HD21  LEU  22          HD21      LEU  22  -6.296  -5.378  -5.183
  172   HD22  LEU  22          HD22      LEU  22  -5.741  -3.819  -5.793
  173   HD23  LEU  22          HD23      LEU  22  -7.097  -3.906  -4.637
  174    H    SER  23           H        SER  23  -3.353  -4.892  -7.379
  175    HA   SER  23           HA       SER  23  -0.379  -5.144  -7.467
  176    HB2  SER  23           HB2      SER  23  -0.851  -5.253  -9.947
  177    HB3  SER  23           HB3      SER  23  -1.389  -6.634  -8.997
  178    HG   SER  23           HG       SER  23  -3.061  -6.278 -10.259
  179    H    PHE  24           H        PHE  24   0.772  -3.221  -7.571
  180    HA   PHE  24           HA       PHE  24  -0.700  -0.901  -8.736
  181    HB2  PHE  24           HB2      PHE  24   0.256   0.597  -7.149
  182    HB3  PHE  24           HB3      PHE  24  -0.845  -0.562  -6.426
  183    HD1  PHE  24           HD1      PHE  24   2.825  -0.181  -7.144
  184    HD2  PHE  24           HD2      PHE  24  -0.212  -1.352  -4.334
  185    HE1  PHE  24           HE1      PHE  24   4.588  -0.711  -5.444
  186    HE2  PHE  24           HE2      PHE  24   1.518  -1.680  -2.598
  187    HZ   PHE  24           HZ       PHE  24   3.913  -1.417  -3.177
  188    H    LYS  25           H        LYS  25   0.820   0.736  -9.500
  189    HA   LYS  25           HA       LYS  25   3.437  -0.267 -10.424
  190    HB2  LYS  25           HB2      LYS  25   1.067   0.061 -12.093
  191    HB3  LYS  25           HB3      LYS  25   2.139   1.408 -12.440
  192    HG2  LYS  25           HG2      LYS  25   2.791  -0.246 -13.947
  193    HG3  LYS  25           HG3      LYS  25   4.005  -0.326 -12.677
  194    HD2  LYS  25           HD2      LYS  25   3.558  -2.503 -12.487
  195    HD3  LYS  25           HD3      LYS  25   1.996  -2.135 -11.798
  196    HE2  LYS  25           HE2      LYS  25   2.395  -2.208 -14.815
  197    HE3  LYS  25           HE3      LYS  25   2.143  -3.683 -13.900
  198    HZ1  LYS  25           HZ1      LYS  25   0.218  -1.465 -14.122
  199    HZ2  LYS  25           HZ2      LYS  25   0.050  -2.777 -13.089
  200    HZ3  LYS  25           HZ3      LYS  25   0.114  -2.980 -14.708
  201    H    ALA  26           H        ALA  26   4.694   1.654 -11.318
  202    HA   ALA  26           HA       ALA  26   4.743   3.764  -9.402
  203    HB1  ALA  26           HB1      ALA  26   6.691   3.114 -10.802
  204    HB2  ALA  26           HB2      ALA  26   5.828   3.649 -12.267
  205    HB3  ALA  26           HB3      ALA  26   6.296   4.833 -11.028
  206    H    GLY  27           H        GLY  27   3.207   5.347  -9.198
  207    HA2  GLY  27           HA2      GLY  27   2.060   7.202  -9.993
  208    HA3  GLY  27           HA3      GLY  27   1.890   6.504 -11.597
  209    H    GLU  28           H        GLU  28   0.988   3.838 -10.146
  210    HA   GLU  28           HA       GLU  28  -1.843   4.286 -10.351
  211    HB2  GLU  28           HB2      GLU  28  -0.183   2.027  -9.111
  212    HB3  GLU  28           HB3      GLU  28  -1.925   1.979  -9.174
  213    HG2  GLU  28           HG2      GLU  28  -0.271   2.292 -11.710
  214    HG3  GLU  28           HG3      GLU  28  -0.676   0.734 -10.969
  215    H    GLU  29           H        GLU  29  -3.249   4.990  -8.861
  216    HA   GLU  29           HA       GLU  29  -2.321   5.455  -6.100
  217    HB2  GLU  29           HB2      GLU  29  -4.779   6.411  -7.636
  218    HB3  GLU  29           HB3      GLU  29  -4.485   6.732  -5.920
  219    HG2  GLU  29           HG2      GLU  29  -2.322   7.812  -6.486
  220    HG3  GLU  29           HG3      GLU  29  -2.644   7.598  -8.203
  221    H    LEU  30           H        LEU  30  -3.792   4.837  -4.322
  222    HA   LEU  30           HA       LEU  30  -5.682   2.651  -4.800
  223    HB2  LEU  30           HB2      LEU  30  -4.462   1.297  -2.956
  224    HB3  LEU  30           HB3      LEU  30  -3.845   1.184  -4.637
  225    HG   LEU  30           HG       LEU  30  -2.553   3.288  -3.011
  226   HD11  LEU  30          HD11      LEU  30  -2.886   1.654  -1.225
  227   HD12  LEU  30          HD12      LEU  30  -1.181   1.674  -1.710
  228   HD13  LEU  30          HD13      LEU  30  -2.234   0.361  -2.251
  229   HD21  LEU  30          HD21      LEU  30  -1.350   0.990  -4.575
  230   HD22  LEU  30          HD22      LEU  30  -0.519   2.442  -3.990
  231   HD23  LEU  30          HD23      LEU  30  -1.740   2.577  -5.259
  232    H    MET  31           H        MET  31  -6.934   2.194  -2.894
  233    HA   MET  31           HA       MET  31  -6.733   4.327  -0.793
  234    HB2  MET  31           HB2      MET  31  -9.438   3.158  -1.546
  235    HB3  MET  31           HB3      MET  31  -8.985   4.489  -0.510
  236    HG2  MET  31           HG2      MET  31  -7.959   5.573  -2.611
  237    HG3  MET  31           HG3      MET  31  -8.957   4.430  -3.514
  238    HE1  MET  31           HE1      MET  31  -8.786   7.910  -2.078
  239    HE2  MET  31           HE2      MET  31 -10.178   8.055  -0.985
  240    HE3  MET  31           HE3      MET  31  -8.858   6.930  -0.604
  241    H    LYS  32           H        LYS  32  -6.026   3.409   0.933
  242    HA   LYS  32           HA       LYS  32  -6.165   0.662   1.647
  243    HB2  LYS  32           HB2      LYS  32  -4.509   1.953   2.583
  244    HB3  LYS  32           HB3      LYS  32  -5.545   3.348   2.839
  245    HG2  LYS  32           HG2      LYS  32  -6.715   2.297   4.712
  246    HG3  LYS  32           HG3      LYS  32  -5.661   0.912   4.618
  247    HD2  LYS  32           HD2      LYS  32  -3.831   1.924   5.493
  248    HD3  LYS  32           HD3      LYS  32  -4.155   3.473   4.708
  249    HE2  LYS  32           HE2      LYS  32  -5.991   3.890   6.353
  250    HE3  LYS  32           HE3      LYS  32  -5.575   2.370   7.154
  251    HZ1  LYS  32           HZ1      LYS  32  -4.447   4.089   8.292
  252    HZ2  LYS  32           HZ2      LYS  32  -3.907   4.812   6.923
  253    HZ3  LYS  32           HZ3      LYS  32  -3.270   3.379   7.396
  254    H    ILE  33           H        ILE  33  -7.687  -0.427   3.005
  255    HA   ILE  33           HA       ILE  33  -9.925   1.277   3.876
  256    HB   ILE  33           HB       ILE  33 -11.547  -0.058   3.216
  257   HG12  ILE  33          HG12      ILE  33  -9.602  -2.119   2.103
  258   HG13  ILE  33          HG13      ILE  33 -10.580  -2.303   3.551
  259   HG21  ILE  33          HG21      ILE  33 -11.584   0.200   0.831
  260   HG22  ILE  33          HG22      ILE  33 -10.602   1.501   1.489
  261   HG23  ILE  33          HG23      ILE  33  -9.819   0.104   0.736
  262   HD11  ILE  33          HD11      ILE  33 -11.603  -3.532   1.774
  263   HD12  ILE  33          HD12      ILE  33 -12.641  -2.129   2.108
  264   HD13  ILE  33          HD13      ILE  33 -11.569  -2.147   0.682
  265    H    SER  34           H        SER  34  -7.576  -0.772   4.997
  266    HA   SER  34           HA       SER  34  -9.055  -1.150   7.539
  267    HB2  SER  34           HB2      SER  34  -7.119  -3.124   6.250
  268    HB3  SER  34           HB3      SER  34  -7.924  -3.295   7.808
  269    HG   SER  34           HG       SER  34  -8.857  -4.532   6.333
  270    H    GLU  35           H        GLU  35  -7.086  -1.878   9.192
  271    HA   GLU  35           HA       GLU  35  -5.150   0.348   9.052
  272    HB2  GLU  35           HB2      GLU  35  -4.608  -0.232  11.312
  273    HB3  GLU  35           HB3      GLU  35  -6.356  -0.181  11.140
  274    HG2  GLU  35           HG2      GLU  35  -5.627  -2.893  10.578
  275    HG3  GLU  35           HG3      GLU  35  -4.626  -2.412  11.950
  276    H    GLU  36           H        GLU  36  -2.808  -0.232   9.736
  277    HA   GLU  36           HA       GLU  36  -1.717  -2.094   7.847
  278    HB2  GLU  36           HB2      GLU  36  -0.918   0.167   8.332
  279    HB3  GLU  36           HB3      GLU  36  -0.548  -0.317  10.000
  280    HG2  GLU  36           HG2      GLU  36   1.222  -1.749   9.287
  281    HG3  GLU  36           HG3      GLU  36   0.711  -1.651   7.592
  282    H    ASP  37           H        ASP  37  -1.048  -4.068   8.290
  283    HA   ASP  37           HA       ASP  37  -1.514  -5.321  10.901
  284    HB2  ASP  37           HB2      ASP  37  -1.909  -6.157   8.346
  285    HB3  ASP  37           HB3      ASP  37  -0.290  -6.805   8.621
  286    H    GLU  38           H        GLU  38   0.220  -6.951  11.607
  287    HA   GLU  38           HA       GLU  38   2.516  -5.709  12.507
  288    HB2  GLU  38           HB2      GLU  38   1.316  -7.932  13.135
  289    HB3  GLU  38           HB3      GLU  38   2.327  -8.682  11.918
  290    HG2  GLU  38           HG2      GLU  38   3.694  -9.035  13.705
  291    HG3  GLU  38           HG3      GLU  38   4.298  -7.435  13.312
  292    H    GLN  39           H        GLN  39   2.135  -7.417   9.445
  293    HA   GLN  39           HA       GLN  39   5.039  -7.356   8.853
  294    HB2  GLN  39           HB2      GLN  39   2.601  -8.755   7.849
  295    HB3  GLN  39           HB3      GLN  39   3.717  -8.292   6.598
  296    HG2  GLN  39           HG2      GLN  39   4.442 -10.093   8.950
  297    HG3  GLN  39           HG3      GLN  39   4.084 -10.553   7.319
  298   HE21  GLN  39          HE21      GLN  39   6.631  -8.945   9.358
  299   HE22  GLN  39          HE22      GLN  39   7.771  -8.973   8.002
  300    H    GLY  40           H        GLY  40   2.943  -4.890   8.945
  301    HA2  GLY  40           HA2      GLY  40   2.907  -2.862   7.906
  302    HA3  GLY  40           HA3      GLY  40   4.294  -3.361   6.917
  303    H    TRP  41           H        TRP  41   1.301  -5.206   7.169
  304    HA   TRP  41           HA       TRP  41   0.899  -5.092   4.238
  305    HB2  TRP  41           HB2      TRP  41   0.089  -6.871   6.517
  306    HB3  TRP  41           HB3      TRP  41  -1.124  -6.640   5.289
  307    HD1  TRP  41           HD1      TRP  41   1.114  -9.082   6.147
  308    HE1  TRP  41           HE1      TRP  41   1.974 -10.484   4.183
  309    HE3  TRP  41           HE3      TRP  41  -0.074  -5.901   2.343
  310    HZ2  TRP  41           HZ2      TRP  41   2.265 -10.166   1.332
  311    HZ3  TRP  41           HZ3      TRP  41   0.454  -6.528  -0.021
  312    HH2  TRP  41           HH2      TRP  41   1.543  -8.592  -0.539
  313    H    CYS  42           H        CYS  42  -0.945  -4.137   3.330
  314    HA   CYS  42           HA       CYS  42  -2.899  -2.954   5.194
  315    HB2  CYS  42           HB2      CYS  42  -1.011  -1.662   3.292
  316    HB3  CYS  42           HB3      CYS  42  -2.677  -1.163   3.148
  317    HG   CYS  42           HG       CYS  42  -1.178   0.488   4.648
  318    H    LYS  43           H        LYS  43  -4.921  -3.490   4.607
  319    HA   LYS  43           HA       LYS  43  -5.446  -4.881   2.056
  320    HB2  LYS  43           HB2      LYS  43  -6.033  -5.596   4.645
  321    HB3  LYS  43           HB3      LYS  43  -7.530  -4.780   4.220
  322    HG2  LYS  43           HG2      LYS  43  -6.223  -6.941   2.521
  323    HG3  LYS  43           HG3      LYS  43  -7.400  -7.293   3.788
  324    HD2  LYS  43           HD2      LYS  43  -9.134  -6.079   2.604
  325    HD3  LYS  43           HD3      LYS  43  -7.969  -5.444   1.438
  326    HE2  LYS  43           HE2      LYS  43  -9.062  -7.233   0.347
  327    HE3  LYS  43           HE3      LYS  43  -7.411  -7.766   0.721
  328    HZ1  LYS  43           HZ1      LYS  43  -9.664  -8.443   2.500
  329    HZ2  LYS  43           HZ2      LYS  43  -8.240  -9.257   2.300
  330    HZ3  LYS  43           HZ3      LYS  43  -9.367  -9.286   1.120
  331    H    GLY  44           H        GLY  44  -6.007  -3.481   0.479
  332    HA2  GLY  44           HA2      GLY  44  -7.916  -1.261   1.105
  333    HA3  GLY  44           HA3      GLY  44  -6.485  -1.006   0.152
  334    H    ARG  45           H        ARG  45  -8.241  -0.165  -1.249
  335    HA   ARG  45           HA       ARG  45  -9.183  -2.213  -3.147
  336    HB2  ARG  45           HB2      ARG  45 -10.967  -1.072  -1.577
  337    HB3  ARG  45           HB3      ARG  45 -10.718   0.321  -2.633
  338    HG2  ARG  45           HG2      ARG  45 -11.081  -1.895  -4.384
  339    HG3  ARG  45           HG3      ARG  45 -12.223  -2.178  -3.079
  340    HD2  ARG  45           HD2      ARG  45 -11.990   0.263  -4.873
  341    HD3  ARG  45           HD3      ARG  45 -13.270  -0.964  -4.900
  342    HE   ARG  45           HE       ARG  45 -13.641  -0.150  -2.445
  343   HH11  ARG  45          HH11      ARG  45 -13.112   1.842  -5.364
  344   HH12  ARG  45          HH12      ARG  45 -13.924   3.224  -4.751
  345   HH21  ARG  45          HH21      ARG  45 -14.704   1.709  -1.597
  346   HH22  ARG  45          HH22      ARG  45 -14.938   3.101  -2.613
  347    H    LEU  46           H        LEU  46  -8.424  -1.841  -5.139
  348    HA   LEU  46           HA       LEU  46  -6.733   0.434  -5.726
  349    HB2  LEU  46           HB2      LEU  46  -6.971  -2.198  -6.657
  350    HB3  LEU  46           HB3      LEU  46  -7.707  -1.285  -7.955
  351    HG   LEU  46           HG       LEU  46  -5.584   0.188  -7.906
  352   HD11  LEU  46          HD11      LEU  46  -4.405  -2.146  -6.399
  353   HD12  LEU  46          HD12      LEU  46  -4.856  -0.611  -5.623
  354   HD13  LEU  46          HD13      LEU  46  -3.607  -0.639  -6.893
  355   HD21  LEU  46          HD21      LEU  46  -4.260  -1.423  -9.212
  356   HD22  LEU  46          HD22      LEU  46  -5.942  -1.520  -9.666
  357   HD23  LEU  46          HD23      LEU  46  -5.263  -2.762  -8.600
  358    H    LEU  47           H        LEU  47  -7.131   1.791  -7.772
  359    HA   LEU  47           HA       LEU  47  -9.617   3.157  -7.521
  360    HB2  LEU  47           HB2      LEU  47  -7.254   3.255  -9.334
  361    HB3  LEU  47           HB3      LEU  47  -8.723   3.959  -9.961
  362    HG   LEU  47           HG       LEU  47  -7.076   5.493  -8.755
  363   HD11  LEU  47          HD11      LEU  47  -8.878   6.894  -7.845
  364   HD12  LEU  47          HD12      LEU  47  -9.979   5.496  -7.853
  365   HD13  LEU  47          HD13      LEU  47  -9.372   6.153  -9.373
  366   HD21  LEU  47          HD21      LEU  47  -6.704   4.032  -6.772
  367   HD22  LEU  47          HD22      LEU  47  -8.327   4.433  -6.198
  368   HD23  LEU  47          HD23      LEU  47  -7.103   5.707  -6.387
  369    H    THR  48           H        THR  48  -8.609   0.650  -9.847
  370    HA   THR  48           HA       THR  48 -10.979   0.755 -11.424
  371    HB   THR  48           HB       THR  48  -8.807  -0.123 -12.190
  372    HG1  THR  48           HG1      THR  48 -10.438  -0.890 -13.313
  373   HG21  THR  48          HG21      THR  48  -8.018  -2.363 -11.511
  374   HG22  THR  48          HG22      THR  48  -9.262  -2.384 -10.232
  375   HG23  THR  48          HG23      THR  48  -7.978  -1.189 -10.191
  376    H    GLY  49           H        GLY  49 -10.715  -0.286  -8.201
  377    HA2  GLY  49           HA2      GLY  49 -12.604  -1.009  -6.980
  378    HA3  GLY  49           HA3      GLY  49 -13.259  -1.799  -8.403
  379    H    HIS  50           H        HIS  50 -10.138  -2.726  -8.559
  380    HA   HIS  50           HA       HIS  50 -10.531  -5.378  -7.667
  381    HB2  HIS  50           HB2      HIS  50  -8.772  -4.274  -9.285
  382    HB3  HIS  50           HB3      HIS  50  -7.810  -4.049  -7.831
  383    HD1  HIS  50           HD1      HIS  50  -8.028  -6.282 -10.600
  384    HD2  HIS  50           HD2      HIS  50  -7.496  -6.633  -6.435
  385    HE1  HIS  50           HE1      HIS  50  -6.825  -8.505 -10.197
  386    H    VAL  51           H        VAL  51  -9.886  -6.418  -5.620
  387    HA   VAL  51           HA       VAL  51  -9.191  -4.528  -3.422
  388    HB   VAL  51           HB       VAL  51 -11.573  -5.118  -3.511
  389   HG11  VAL  51          HG11      VAL  51 -10.724  -8.016  -3.073
  390   HG12  VAL  51          HG12      VAL  51 -12.377  -7.371  -3.058
  391   HG13  VAL  51          HG13      VAL  51 -11.455  -7.366  -4.558
  392   HG21  VAL  51          HG21      VAL  51 -10.491  -4.683  -1.327
  393   HG22  VAL  51          HG22      VAL  51 -11.877  -5.770  -1.220
  394   HG23  VAL  51          HG23      VAL  51 -10.237  -6.433  -1.130
  395    H    GLY  52           H        GLY  52  -7.797  -5.423  -1.703
  396    HA2  GLY  52           HA2      GLY  52  -6.966  -7.992  -1.371
  397    HA3  GLY  52           HA3      GLY  52  -5.971  -7.424  -2.719
  398    H    LEU  53           H        LEU  53  -4.396  -8.001  -0.954
  399    HA   LEU  53           HA       LEU  53  -3.856  -5.919   1.067
  400    HB2  LEU  53           HB2      LEU  53  -2.747  -8.652   0.320
  401    HB3  LEU  53           HB3      LEU  53  -1.865  -7.597   1.389
  402    HG   LEU  53           HG       LEU  53  -4.703  -8.405   2.017
  403   HD11  LEU  53          HD11      LEU  53  -3.686 -10.106   3.508
  404   HD12  LEU  53          HD12      LEU  53  -2.070  -9.688   2.906
  405   HD13  LEU  53          HD13      LEU  53  -3.272 -10.398   1.814
  406   HD21  LEU  53          HD21      LEU  53  -2.427  -7.295   3.702
  407   HD22  LEU  53          HD22      LEU  53  -4.033  -7.772   4.314
  408   HD23  LEU  53          HD23      LEU  53  -3.873  -6.407   3.211
  409    H    TYR  54           H        TYR  54  -1.971  -4.524   0.924
  410    HA   TYR  54           HA       TYR  54  -0.234  -4.758  -1.434
  411    HB2  TYR  54           HB2      TYR  54  -0.362  -2.487  -1.977
  412    HB3  TYR  54           HB3      TYR  54  -2.003  -3.029  -1.928
  413    HD1  TYR  54           HD1      TYR  54  -3.598  -1.996  -0.309
  414    HD2  TYR  54           HD2      TYR  54   0.611  -1.043  -0.194
  415    HE1  TYR  54           HE1      TYR  54  -4.059  -0.086   1.228
  416    HE2  TYR  54           HE2      TYR  54   0.126   0.761   1.435
  417    HH   TYR  54           HH       TYR  54  -1.355   1.817   2.725
  418    HA   PRO  55           HA       PRO  55   2.618  -4.208   1.921
  419    HB2  PRO  55           HB2      PRO  55   4.946  -3.623   0.676
  420    HB3  PRO  55           HB3      PRO  55   4.139  -5.207   0.549
  421    HG2  PRO  55           HG2      PRO  55   4.011  -2.928  -1.433
  422    HG3  PRO  55           HG3      PRO  55   4.374  -4.630  -1.774
  423    HD2  PRO  55           HD2      PRO  55   1.824  -3.718  -2.117
  424    HD3  PRO  55           HD3      PRO  55   2.137  -5.306  -1.379
  425    H    ALA  56           H        ALA  56   2.096  -2.487   3.209
  426    HA   ALA  56           HA       ALA  56   1.723   0.160   2.434
  427    HB1  ALA  56           HB1      ALA  56   2.556  -0.883   5.162
  428    HB2  ALA  56           HB2      ALA  56   1.813   0.676   4.837
  429    HB3  ALA  56           HB3      ALA  56   0.893  -0.805   4.559
  430    H    ASN  57           H        ASN  57   4.731  -1.396   3.400
  431    HA   ASN  57           HA       ASN  57   6.247   0.984   3.751
  432    HB2  ASN  57           HB2      ASN  57   7.584  -1.490   2.635
  433    HB3  ASN  57           HB3      ASN  57   8.153  -0.296   3.788
  434   HD21  ASN  57          HD21      ASN  57   6.235  -3.330   3.406
  435   HD22  ASN  57          HD22      ASN  57   6.161  -3.590   5.111
  436    H    TYR  58           H        TYR  58   5.047  -0.302   0.732
  437    HA   TYR  58           HA       TYR  58   7.259   0.943  -0.822
  438    HB2  TYR  58           HB2      TYR  58   5.108  -1.068  -1.458
  439    HB3  TYR  58           HB3      TYR  58   6.126  -0.357  -2.692
  440    HD1  TYR  58           HD1      TYR  58   6.624  -2.131   0.632
  441    HD2  TYR  58           HD2      TYR  58   7.783  -1.809  -3.510
  442    HE1  TYR  58           HE1      TYR  58   8.368  -3.823   0.995
  443    HE2  TYR  58           HE2      TYR  58   9.425  -3.585  -3.179
  444    HH   TYR  58           HH       TYR  58  10.176  -5.112  -0.002
  445    H    VAL  59           H        VAL  59   4.380   2.057   0.465
  446    HA   VAL  59           HA       VAL  59   4.010   3.875  -1.861
  447    HB   VAL  59           HB       VAL  59   1.614   3.626  -1.751
  448   HG11  VAL  59          HG11      VAL  59   2.579   0.731  -1.634
  449   HG12  VAL  59          HG12      VAL  59   1.213   1.401  -2.541
  450   HG13  VAL  59          HG13      VAL  59   2.874   1.749  -3.023
  451   HG21  VAL  59          HG21      VAL  59   1.975   1.550   0.438
  452   HG22  VAL  59          HG22      VAL  59   1.430   3.196   0.727
  453   HG23  VAL  59          HG23      VAL  59   0.450   2.152  -0.283
  454    H    GLU  60           H        GLU  60   2.921   5.957  -1.230
  455    HA   GLU  60           HA       GLU  60   2.915   6.523   1.659
  456    HB2  GLU  60           HB2      GLU  60   5.220   7.006   0.260
  457    HB3  GLU  60           HB3      GLU  60   4.383   8.535   0.034
  458    HG2  GLU  60           HG2      GLU  60   4.953   7.132   2.690
  459    HG3  GLU  60           HG3      GLU  60   5.919   8.435   2.006
  460    H    LYS  61           H        LYS  61   1.918   8.675   2.049
  461    HA   LYS  61           HA       LYS  61  -0.495   9.017   0.481
  462    HB2  LYS  61           HB2      LYS  61   0.764  10.316   2.920
  463    HB3  LYS  61           HB3      LYS  61  -0.353  11.275   1.977
  464    HG2  LYS  61           HG2      LYS  61  -1.879  10.413   3.350
  465    HG3  LYS  61           HG3      LYS  61  -1.934   9.162   2.149
  466    HD2  LYS  61           HD2      LYS  61  -0.471   9.125   4.837
  467    HD3  LYS  61           HD3      LYS  61  -1.975   8.306   4.438
  468    HE2  LYS  61           HE2      LYS  61  -0.932   6.489   3.799
  469    HE3  LYS  61           HE3      LYS  61  -0.067   7.376   2.556
  470    HZ1  LYS  61           HZ1      LYS  61   0.874   7.210   5.362
  471    HZ2  LYS  61           HZ2      LYS  61   1.697   7.797   4.087
  472    HZ3  LYS  61           HZ3      LYS  61   1.378   6.202   4.134
  473    H    VAL  62           H        VAL  62  -1.078  11.071  -0.656
  474    HA   VAL  62           HA       VAL  62   1.187  12.667  -1.519
  475    HB   VAL  62           HB       VAL  62   1.069  10.591  -2.974
  476   HG11  VAL  62          HG11      VAL  62  -1.488  11.883  -4.025
  477   HG12  VAL  62          HG12      VAL  62  -0.629  10.531  -4.753
  478   HG13  VAL  62          HG13      VAL  62  -1.352  10.351  -3.147
  479   HG21  VAL  62          HG21      VAL  62   0.681  13.214  -4.480
  480   HG22  VAL  62          HG22      VAL  62   2.176  12.736  -3.637
  481   HG23  VAL  62          HG23      VAL  62   1.593  11.758  -4.974
  482    H    GLY  63           H        GLY  63   0.430  14.611  -2.642
  483    HA2  GLY  63           HA2      GLY  63  -1.748  15.691  -3.476
  484    HA3  GLY  63           HA3      GLY  63  -2.330  15.334  -1.850
  485    H    LEU  64           H        LEU  64  -0.216  15.826  -0.310
  486    HA   LEU  64           HA       LEU  64  -0.291  18.750  -0.140
  487    HB2  LEU  64           HB2      LEU  64   0.504  16.534   1.642
  488    HB3  LEU  64           HB3      LEU  64   1.701  17.791   1.661
  489    HG   LEU  64           HG       LEU  64   0.214  18.129   3.462
  490   HD11  LEU  64          HD11      LEU  64  -0.327  20.289   1.387
  491   HD12  LEU  64          HD12      LEU  64   1.160  20.121   2.347
  492   HD13  LEU  64          HD13      LEU  64  -0.375  20.445   3.153
  493   HD21  LEU  64          HD21      LEU  64  -1.805  17.054   2.627
  494   HD22  LEU  64          HD22      LEU  64  -2.035  18.354   1.445
  495   HD23  LEU  64          HD23      LEU  64  -2.154  18.695   3.188
  496    H    ALA  65           H        ALA  65   1.927  19.818   0.484
  497    HA   ALA  65           HA       ALA  65   3.913  19.340  -1.676
  498    HB1  ALA  65           HB1      ALA  65   2.662  21.463  -1.967
  499    HB2  ALA  65           HB2      ALA  65   3.054  21.934  -0.294
  500    HB3  ALA  65           HB3      ALA  65   4.342  21.783  -1.503
  501    H    ALA  66           H        ALA  66   6.129  20.247  -0.843
  502    HA   ALA  66           HA       ALA  66   7.896  20.033   0.515
  503    HB1  ALA  66           HB1      ALA  66   5.967  20.850   2.714
  504    HB2  ALA  66           HB2      ALA  66   7.727  20.812   2.838
  505    HB3  ALA  66           HB3      ALA  66   6.949  21.928   1.691
  506    H    ALA  67           H        ALA  67   7.846  17.831  -0.149
  507    HA   ALA  67           HA       ALA  67   8.294  15.963   1.917
  508    HB1  ALA  67           HB1      ALA  67   6.678  14.247   1.026
  509    HB2  ALA  67           HB2      ALA  67   5.889  15.583   1.878
  510    HB3  ALA  67           HB3      ALA  67   5.886  15.521   0.081
  511    H1   THR 101           H        THR 101  -2.281 -11.511  10.117
  512    HA   THR 101           HA       THR 101  -1.315 -10.268   7.617
  513    HB   THR 101           HB       THR 101   0.194 -11.540   9.909
  514    HG1  THR 101           HG1      THR 101  -0.042  -9.261   9.975
  515   HG21  THR 101          HG21      THR 101   1.187 -10.985   7.086
  516   HG22  THR 101          HG22      THR 101   1.126 -12.560   7.888
  517   HG23  THR 101          HG23      THR 101   2.221 -11.328   8.502
  518    H    LYS 102           H        LYS 102  -2.077 -11.479   5.906
  519    HA   LYS 102           HA       LYS 102  -2.700 -14.286   6.338
  520    HB2  LYS 102           HB2      LYS 102  -3.800 -14.284   4.395
  521    HB3  LYS 102           HB3      LYS 102  -3.835 -12.587   4.775
  522    HG2  LYS 102           HG2      LYS 102  -3.379 -12.531   2.552
  523    HG3  LYS 102           HG3      LYS 102  -1.757 -12.352   3.216
  524    HD2  LYS 102           HD2      LYS 102  -1.911 -13.804   1.219
  525    HD3  LYS 102           HD3      LYS 102  -1.265 -14.705   2.586
  526    HE2  LYS 102           HE2      LYS 102  -3.438 -15.761   2.986
  527    HE3  LYS 102           HE3      LYS 102  -4.209 -14.705   1.798
  528    HZ1  LYS 102           HZ1      LYS 102  -2.210 -16.795   1.158
  529    HZ2  LYS 102           HZ2      LYS 102  -2.971 -15.785   0.062
  530    HZ3  LYS 102           HZ3      LYS 102  -3.838 -16.845   0.898
  531    H    GLY 103           H        GLY 103   0.291 -12.735   5.354
  532    HA2  GLY 103           HA2      GLY 103   1.753 -15.132   5.470
  533    HA3  GLY 103           HA3      GLY 103   1.492 -14.666   3.768
  534    HA   PRO 104           HA       PRO 104   4.809 -11.966   5.924
  535    HB2  PRO 104           HB2      PRO 104   7.104 -12.951   4.782
  536    HB3  PRO 104           HB3      PRO 104   6.407 -13.545   6.324
  537    HG2  PRO 104           HG2      PRO 104   6.155 -14.769   3.575
  538    HG3  PRO 104           HG3      PRO 104   6.459 -15.584   5.134
  539    HD2  PRO 104           HD2      PRO 104   3.964 -15.419   3.952
  540    HD3  PRO 104           HD3      PRO 104   4.184 -15.459   5.727
  541    H    ALA 105           H        ALA 105   5.027 -10.126   4.959
  542    HA   ALA 105           HA       ALA 105   4.419  -9.570   2.213
  543    HB1  ALA 105           HB1      ALA 105   4.118  -7.413   3.070
  544    HB2  ALA 105           HB2      ALA 105   3.855  -8.344   4.495
  545    HB3  ALA 105           HB3      ALA 105   5.445  -7.594   4.273
  546    HA   PRO 106           HA       PRO 106   8.586  -9.011   0.732
  547    HB2  PRO 106           HB2      PRO 106   8.489  -6.895  -0.955
  548    HB3  PRO 106           HB3      PRO 106   7.284  -8.218  -0.981
  549    HG2  PRO 106           HG2      PRO 106   6.974  -5.607   0.471
  550    HG3  PRO 106           HG3      PRO 106   5.991  -6.196  -0.895
  551    HD2  PRO 106           HD2      PRO 106   5.449  -6.660   1.743
  552    HD3  PRO 106           HD3      PRO 106   5.016  -7.896   0.527
  553    H    ASN 107           H        ASN 107   7.601  -7.094   2.939
  554    HA   ASN 107           HA       ASN 107   9.336  -4.862   3.208
  555    HB2  ASN 107           HB2      ASN 107   8.656  -4.493   5.342
  556    HB3  ASN 107           HB3      ASN 107   7.283  -5.407   4.686
  557   HD21  ASN 107          HD21      ASN 107   8.375  -4.889   7.507
  558   HD22  ASN 107          HD22      ASN 107   8.388  -6.471   8.217
  559    HA   PRO 108           HA       PRO 108  10.746  -3.641   5.093
  560    HB2  PRO 108           HB2      PRO 108  13.312  -2.691   4.705
  561    HB3  PRO 108           HB3      PRO 108  12.774  -3.544   6.181
  562    HG2  PRO 108           HG2      PRO 108  14.178  -4.703   3.764
  563    HG3  PRO 108           HG3      PRO 108  14.645  -4.853   5.491
  564    HD2  PRO 108           HD2      PRO 108  13.202  -6.795   4.276
  565    HD3  PRO 108           HD3      PRO 108  12.778  -6.289   5.944
  566    HA   PRO 109           HA       PRO 109  10.367  -2.108   0.957
  567    HB2  PRO 109           HB2      PRO 109  10.731   0.604   1.105
  568    HB3  PRO 109           HB3      PRO 109   9.368  -0.266   1.850
  569    HG2  PRO 109           HG2      PRO 109  11.949   0.624   3.151
  570    HG3  PRO 109           HG3      PRO 109  10.280   0.916   3.745
  571    HD2  PRO 109           HD2      PRO 109  11.849  -1.142   4.634
  572    HD3  PRO 109           HD3      PRO 109  10.082  -1.310   4.501
  573    HA   PRO 110           HA       PRO 110  14.291  -1.845  -1.018
  574    HB2  PRO 110           HB2      PRO 110  13.816  -0.260  -3.258
  575    HB3  PRO 110           HB3      PRO 110  13.257  -1.948  -3.062
  576    HG2  PRO 110           HG2      PRO 110  11.707   0.600  -2.558
  577    HG3  PRO 110           HG3      PRO 110  11.194  -0.852  -3.478
  578    HD2  PRO 110           HD2      PRO 110  10.435  -0.521  -0.912
  579    HD3  PRO 110           HD3      PRO 110  10.969  -2.126  -1.500
  580    H    ILE 111           H        ILE 111  12.871   1.485  -1.266
  581    HA   ILE 111           HA       ILE 111  15.248   2.504   0.212
  582    HB   ILE 111           HB       ILE 111  15.528   4.271  -1.431
  583   HG12  ILE 111          HG12      ILE 111  13.424   2.863  -3.169
  584   HG13  ILE 111          HG13      ILE 111  13.271   4.438  -2.345
  585   HG21  ILE 111          HG21      ILE 111  16.613   2.947  -3.130
  586   HG22  ILE 111          HG22      ILE 111  16.753   2.074  -1.606
  587   HG23  ILE 111          HG23      ILE 111  15.578   1.561  -2.839
  588   HD11  ILE 111          HD11      ILE 111  15.086   3.741  -4.673
  589   HD12  ILE 111          HD12      ILE 111  13.780   4.934  -4.612
  590   HD13  ILE 111          HD13      ILE 111  15.272   5.228  -3.715
  591    H    LEU 112           H        LEU 112  11.839   2.568   0.111
  592    HA   LEU 112           HA       LEU 112  11.439   5.282   0.864
  593    HB2  LEU 112           HB2      LEU 112   9.797   3.408   0.018
  594    HB3  LEU 112           HB3      LEU 112   9.611   3.013   1.713
  595    HG   LEU 112           HG       LEU 112   8.754   5.321   2.145
  596   HD11  LEU 112          HD11      LEU 112   8.849   5.671  -0.880
  597   HD12  LEU 112          HD12      LEU 112   9.871   6.553   0.263
  598   HD13  LEU 112          HD13      LEU 112   8.131   6.801   0.286
  599   HD21  LEU 112          HD21      LEU 112   7.376   3.676  -0.051
  600   HD22  LEU 112          HD22      LEU 112   6.612   5.067   0.761
  601   HD23  LEU 112          HD23      LEU 112   7.075   3.669   1.707
  602    H    LYS 113           H        LYS 113  11.265   6.341   2.868
  603    HA   LYS 113           HA       LYS 113  11.753   4.759   5.339
  604    HB2  LYS 113           HB2      LYS 113  13.565   6.577   4.029
  605    HB3  LYS 113           HB3      LYS 113  12.977   7.410   5.443
  606    HG2  LYS 113           HG2      LYS 113  14.579   6.322   6.560
  607    HG3  LYS 113           HG3      LYS 113  13.562   4.884   6.469
  608    HD2  LYS 113           HD2      LYS 113  14.714   4.286   4.277
  609    HD3  LYS 113           HD3      LYS 113  15.734   5.713   4.480
  610    HE2  LYS 113           HE2      LYS 113  17.001   3.832   5.234
  611    HE3  LYS 113           HE3      LYS 113  16.571   4.801   6.652
  612    HZ1  LYS 113           HZ1      LYS 113  16.274   2.401   6.944
  613    HZ2  LYS 113           HZ2      LYS 113  15.093   2.402   5.782
  614    HZ3  LYS 113           HZ3      LYS 113  14.909   3.243   7.212
  615    H    VAL 114           H        VAL 114  11.627   6.580   7.260
  616    HA   VAL 114           HA       VAL 114   9.129   8.151   6.969
  617    HB   VAL 114           HB       VAL 114   9.709   5.895   8.927
  618   HG11  VAL 114          HG11      VAL 114   8.754   7.548  10.398
  619   HG12  VAL 114          HG12      VAL 114   7.491   7.942   9.202
  620   HG13  VAL 114          HG13      VAL 114   7.507   6.368  10.023
  621   HG21  VAL 114          HG21      VAL 114   7.497   5.074   8.158
  622   HG22  VAL 114          HG22      VAL 114   7.340   6.476   7.103
  623   HG23  VAL 114          HG23      VAL 114   8.599   5.256   6.796
  624    H    TRP 115           H        TRP 115  12.433   8.353   7.729
  625    HA   TRP 115           HA       TRP 115  12.016  10.806   9.129
  626    HB2  TRP 115           HB2      TRP 115  12.008   8.980  10.933
  627    HB3  TRP 115           HB3      TRP 115  13.658   8.631  10.463
  628    HD1  TRP 115           HD1      TRP 115  14.520   9.085  12.808
  629    HE1  TRP 115           HE1      TRP 115  14.955  11.135  14.258
  630    HE3  TRP 115           HE3      TRP 115  12.109  12.670   9.980
  631    HZ2  TRP 115           HZ2      TRP 115  14.404  13.943  14.198
  632    HZ3  TRP 115           HZ3      TRP 115  12.208  15.015  10.653
  633    HH2  TRP 115           HH2      TRP 115  13.373  15.696  12.739
  Start of MODEL   10
    1    H1   MET   1           H        MET   1 -14.668   7.380  14.363
    2    HA   MET   1           HA       MET   1 -16.578   7.657  12.871
    3    HB2  MET   1           HB2      MET   1 -15.064   9.556  13.669
    4    HB3  MET   1           HB3      MET   1 -14.342   9.545  12.061
    5    HG2  MET   1           HG2      MET   1 -16.596   9.990  11.093
    6    HG3  MET   1           HG3      MET   1 -17.306   9.878  12.706
    7    HE1  MET   1           HE1      MET   1 -15.316  11.976  10.135
    8    HE2  MET   1           HE2      MET   1 -14.679  13.325  11.100
    9    HE3  MET   1           HE3      MET   1 -14.019  11.694  11.314
   10    H    LYS   2           H        LYS   2 -16.121   5.432  11.747
   11    HA   LYS   2           HA       LYS   2 -16.253   4.229   9.915
   12    HB2  LYS   2           HB2      LYS   2 -17.653   6.211   9.231
   13    HB3  LYS   2           HB3      LYS   2 -16.307   6.742   8.216
   14    HG2  LYS   2           HG2      LYS   2 -16.772   5.212   6.606
   15    HG3  LYS   2           HG3      LYS   2 -17.101   3.927   7.775
   16    HD2  LYS   2           HD2      LYS   2 -19.119   4.512   6.475
   17    HD3  LYS   2           HD3      LYS   2 -19.297   4.732   8.221
   18    HE2  LYS   2           HE2      LYS   2 -18.803   7.225   7.822
   19    HE3  LYS   2           HE3      LYS   2 -18.958   6.885   6.092
   20    HZ1  LYS   2           HZ1      LYS   2 -21.048   7.649   7.056
   21    HZ2  LYS   2           HZ2      LYS   2 -21.059   6.379   8.125
   22    HZ3  LYS   2           HZ3      LYS   2 -21.218   6.130   6.525
   23    H    VAL   3           H        VAL   3 -15.128   3.996   7.541
   24    HA   VAL   3           HA       VAL   3 -12.211   4.438   7.930
   25    HB   VAL   3           HB       VAL   3 -13.522   1.941   6.789
   26   HG11  VAL   3          HG11      VAL   3 -11.267   0.974   7.050
   27   HG12  VAL   3          HG12      VAL   3 -11.200   2.394   5.999
   28   HG13  VAL   3          HG13      VAL   3 -10.665   2.523   7.688
   29   HG21  VAL   3          HG21      VAL   3 -14.068   2.002   9.177
   30   HG22  VAL   3          HG22      VAL   3 -12.828   0.803   8.865
   31   HG23  VAL   3          HG23      VAL   3 -12.377   2.373   9.576
   32    HA   PRO   4           HA       PRO   4 -13.702   6.108   3.846
   33    HB2  PRO   4           HB2      PRO   4 -12.343   8.478   3.850
   34    HB3  PRO   4           HB3      PRO   4 -13.916   8.269   4.677
   35    HG2  PRO   4           HG2      PRO   4 -11.144   8.185   5.891
   36    HG3  PRO   4           HG3      PRO   4 -12.593   9.039   6.504
   37    HD2  PRO   4           HD2      PRO   4 -11.772   6.573   7.411
   38    HD3  PRO   4           HD3      PRO   4 -13.499   7.054   7.364
   39    H    GLY   5           H        GLY   5 -12.399   5.887   1.899
   40    HA2  GLY   5           HA2      GLY   5 -10.074   4.352   2.115
   41    HA3  GLY   5           HA3      GLY   5 -10.629   5.226   0.672
   42    H    VAL   6           H        VAL   6  -7.869   4.903   2.138
   43    HA   VAL   6           HA       VAL   6  -7.238   7.809   2.496
   44    HB   VAL   6           HB       VAL   6  -5.453   5.413   3.070
   45   HG11  VAL   6          HG11      VAL   6  -4.271   7.541   2.702
   46   HG12  VAL   6          HG12      VAL   6  -5.236   8.290   3.979
   47   HG13  VAL   6          HG13      VAL   6  -4.120   6.968   4.365
   48   HG21  VAL   6          HG21      VAL   6  -7.327   5.191   4.598
   49   HG22  VAL   6          HG22      VAL   6  -5.975   5.909   5.505
   50   HG23  VAL   6          HG23      VAL   6  -7.303   6.927   4.937
   51    H    ARG   7           H        ARG   7  -6.590   8.756   0.659
   52    HA   ARG   7           HA       ARG   7  -5.873   7.232  -1.711
   53    HB2  ARG   7           HB2      ARG   7  -7.190   9.257  -1.921
   54    HB3  ARG   7           HB3      ARG   7  -6.033  10.197  -0.997
   55    HG2  ARG   7           HG2      ARG   7  -4.785   8.936  -3.362
   56    HG3  ARG   7           HG3      ARG   7  -6.155   9.961  -3.803
   57    HD2  ARG   7           HD2      ARG   7  -3.935  10.892  -1.939
   58    HD3  ARG   7           HD3      ARG   7  -3.840  11.014  -3.682
   59    HE   ARG   7           HE       ARG   7  -5.919  12.361  -2.002
   60   HH11  ARG   7          HH11      ARG   7  -4.274  12.188  -5.153
   61   HH12  ARG   7          HH12      ARG   7  -4.451  13.894  -5.459
   62   HH21  ARG   7          HH21      ARG   7  -6.170  14.602  -2.450
   63   HH22  ARG   7          HH22      ARG   7  -5.689  15.251  -3.970
   64    H    VAL   8           H        VAL   8  -3.911   6.358  -1.942
   65    HA   VAL   8           HA       VAL   8  -1.525   7.921  -1.108
   66    HB   VAL   8           HB       VAL   8  -0.516   5.966  -0.133
   67   HG11  VAL   8          HG11      VAL   8  -1.742   5.689   1.853
   68   HG12  VAL   8          HG12      VAL   8  -2.123   7.316   1.293
   69   HG13  VAL   8          HG13      VAL   8  -3.289   6.012   1.067
   70   HG21  VAL   8          HG21      VAL   8  -1.346   4.102  -1.375
   71   HG22  VAL   8          HG22      VAL   8  -1.886   3.871   0.291
   72   HG23  VAL   8          HG23      VAL   8  -3.039   4.451  -0.910
   73    H    ARG   9           H        ARG   9   0.041   7.999  -2.750
   74    HA   ARG   9           HA       ARG   9  -0.699   6.587  -5.290
   75    HB2  ARG   9           HB2      ARG   9  -0.502   9.128  -5.209
   76    HB3  ARG   9           HB3      ARG   9   1.233   8.910  -4.991
   77    HG2  ARG   9           HG2      ARG   9   1.168   7.495  -7.151
   78    HG3  ARG   9           HG3      ARG   9  -0.512   7.987  -7.327
   79    HD2  ARG   9           HD2      ARG   9   0.774   9.471  -8.697
   80    HD3  ARG   9           HD3      ARG   9   0.293  10.414  -7.269
   81    HE   ARG   9           HE       ARG   9   2.880   8.962  -7.285
   82   HH11  ARG   9          HH11      ARG   9   1.501  12.253  -7.487
   83   HH12  ARG   9          HH12      ARG   9   2.860  12.941  -6.640
   84   HH21  ARG   9          HH21      ARG   9   4.558   9.829  -6.380
   85   HH22  ARG   9          HH22      ARG   9   4.790  11.545  -6.199
   86    H    ALA  10           H        ALA  10   0.446   4.746  -5.648
   87    HA   ALA  10           HA       ALA  10   2.554   3.875  -3.976
   88    HB1  ALA  10           HB1      ALA  10   2.948   2.238  -5.892
   89    HB2  ALA  10           HB2      ALA  10   1.290   2.281  -5.242
   90    HB3  ALA  10           HB3      ALA  10   1.667   3.097  -6.772
   91    H    LEU  11           H        LEU  11   4.699   4.080  -4.012
   92    HA   LEU  11           HA       LEU  11   5.899   6.089  -5.812
   93    HB2  LEU  11           HB2      LEU  11   6.732   4.677  -3.269
   94    HB3  LEU  11           HB3      LEU  11   7.846   5.714  -4.154
   95    HG   LEU  11           HG       LEU  11   5.140   6.712  -3.176
   96   HD11  LEU  11          HD11      LEU  11   6.342   7.659  -1.235
   97   HD12  LEU  11          HD12      LEU  11   7.820   6.815  -1.730
   98   HD13  LEU  11          HD13      LEU  11   6.392   5.890  -1.225
   99   HD21  LEU  11          HD21      LEU  11   6.359   8.054  -4.940
  100   HD22  LEU  11          HD22      LEU  11   7.728   8.183  -3.828
  101   HD23  LEU  11          HD23      LEU  11   6.148   8.901  -3.403
  102    H    TYR  12           H        TYR  12   6.034   2.583  -5.273
  103    HA   TYR  12           HA       TYR  12   8.112   2.431  -7.380
  104    HB2  TYR  12           HB2      TYR  12   8.051   0.297  -5.302
  105    HB3  TYR  12           HB3      TYR  12   9.403   0.961  -6.199
  106    HD1  TYR  12           HD1      TYR  12   7.187   1.350  -3.318
  107    HD2  TYR  12           HD2      TYR  12  10.636   3.000  -5.287
  108    HE1  TYR  12           HE1      TYR  12   7.577   2.880  -1.369
  109    HE2  TYR  12           HE2      TYR  12  11.034   4.459  -3.349
  110    HH   TYR  12           HH       TYR  12   8.942   4.451  -0.414
  111    H    ASP  13           H        ASP  13   8.195   0.346  -8.373
  112    HA   ASP  13           HA       ASP  13   5.491  -0.620  -9.156
  113    HB2  ASP  13           HB2      ASP  13   8.244  -0.977 -10.381
  114    HB3  ASP  13           HB3      ASP  13   6.756  -1.665 -11.050
  115    H    TYR  14           H        TYR  14   4.948  -2.097  -7.414
  116    HA   TYR  14           HA       TYR  14   6.407  -4.691  -7.495
  117    HB2  TYR  14           HB2      TYR  14   5.927  -2.865  -5.147
  118    HB3  TYR  14           HB3      TYR  14   5.681  -4.575  -4.913
  119    HD1  TYR  14           HD1      TYR  14   7.502  -5.988  -4.317
  120    HD2  TYR  14           HD2      TYR  14   8.297  -2.230  -6.306
  121    HE1  TYR  14           HE1      TYR  14   9.917  -6.503  -4.342
  122    HE2  TYR  14           HE2      TYR  14  10.705  -2.728  -6.302
  123    HH   TYR  14           HH       TYR  14  12.354  -4.261  -5.758
  124    H    THR  15           H        THR  15   5.090  -6.510  -6.889
  125    HA   THR  15           HA       THR  15   2.179  -5.972  -6.602
  126    HB   THR  15           HB       THR  15   2.725  -6.262  -8.940
  127    HG1  THR  15           HG1      THR  15   1.541  -8.415  -9.157
  128   HG21  THR  15          HG21      THR  15   4.845  -7.653  -8.712
  129   HG22  THR  15          HG22      THR  15   3.710  -8.154  -9.966
  130   HG23  THR  15          HG23      THR  15   3.807  -9.061  -8.449
  131    H    GLY  16           H        GLY  16   2.482  -6.414  -4.371
  132    HA2  GLY  16           HA2      GLY  16   2.653  -7.715  -2.486
  133    HA3  GLY  16           HA3      GLY  16   1.771  -8.830  -3.506
  134    H    GLN  17           H        GLN  17   2.649 -10.474  -2.181
  135    HA   GLN  17           HA       GLN  17   5.270 -11.435  -3.007
  136    HB2  GLN  17           HB2      GLN  17   5.186 -10.319  -0.546
  137    HB3  GLN  17           HB3      GLN  17   4.603 -11.906  -0.095
  138    HG2  GLN  17           HG2      GLN  17   7.201 -11.377  -1.621
  139    HG3  GLN  17           HG3      GLN  17   7.102 -11.448   0.129
  140   HE21  GLN  17          HE21      GLN  17   7.983 -13.319  -2.531
  141   HE22  GLN  17          HE22      GLN  17   7.711 -14.881  -1.809
  142    H    GLU  18           H        GLU  18   1.885 -12.091  -2.707
  143    HA   GLU  18           HA       GLU  18   2.455 -14.988  -2.877
  144    HB2  GLU  18           HB2      GLU  18   1.690 -13.878  -0.552
  145    HB3  GLU  18           HB3      GLU  18   0.098 -13.958  -1.287
  146    HG2  GLU  18           HG2      GLU  18   0.329 -16.409  -1.498
  147    HG3  GLU  18           HG3      GLU  18   1.998 -16.324  -0.915
  148    H    ALA  19           H        ALA  19  -0.021 -15.980  -3.268
  149    HA   ALA  19           HA       ALA  19  -0.773 -14.871  -5.875
  150    HB1  ALA  19           HB1      ALA  19  -2.037 -16.926  -6.126
  151    HB2  ALA  19           HB2      ALA  19  -0.388 -17.287  -5.618
  152    HB3  ALA  19           HB3      ALA  19  -1.729 -17.373  -4.437
  153    H    ASP  20           H        ASP  20  -1.774 -14.049  -2.772
  154    HA   ASP  20           HA       ASP  20  -4.460 -13.368  -3.803
  155    HB2  ASP  20           HB2      ASP  20  -4.522 -15.509  -2.437
  156    HB3  ASP  20           HB3      ASP  20  -4.181 -14.502  -1.018
  157    H    GLU  21           H        GLU  21  -2.326 -11.659  -3.637
  158    HA   GLU  21           HA       GLU  21  -2.989  -9.619  -1.633
  159    HB2  GLU  21           HB2      GLU  21  -0.618  -8.811  -2.410
  160    HB3  GLU  21           HB3      GLU  21  -0.812 -10.075  -1.200
  161    HG2  GLU  21           HG2      GLU  21   0.951 -10.613  -2.785
  162    HG3  GLU  21           HG3      GLU  21  -0.321 -11.800  -2.787
  163    H    LEU  22           H        LEU  22  -2.256  -7.419  -2.772
  164    HA   LEU  22           HA       LEU  22  -3.964  -7.021  -5.128
  165    HB2  LEU  22           HB2      LEU  22  -4.163  -5.839  -2.783
  166    HB3  LEU  22           HB3      LEU  22  -2.685  -5.018  -3.212
  167    HG   LEU  22           HG       LEU  22  -3.752  -3.770  -4.897
  168   HD11  LEU  22          HD11      LEU  22  -5.937  -5.871  -4.740
  169   HD12  LEU  22          HD12      LEU  22  -5.031  -5.307  -6.134
  170   HD13  LEU  22          HD13      LEU  22  -6.269  -4.270  -5.431
  171   HD21  LEU  22          HD21      LEU  22  -4.321  -3.067  -2.606
  172   HD22  LEU  22          HD22      LEU  22  -5.737  -4.136  -2.602
  173   HD23  LEU  22          HD23      LEU  22  -5.682  -2.739  -3.674
  174    H    SER  23           H        SER  23  -3.035  -5.444  -6.791
  175    HA   SER  23           HA       SER  23  -0.052  -5.431  -6.849
  176    HB2  SER  23           HB2      SER  23  -2.072  -5.989  -9.075
  177    HB3  SER  23           HB3      SER  23  -0.307  -6.025  -9.227
  178    HG   SER  23           HG       SER  23  -0.209  -7.814  -8.042
  179    H    PHE  24           H        PHE  24   0.818  -3.331  -7.307
  180    HA   PHE  24           HA       PHE  24  -0.972  -1.393  -8.672
  181    HB2  PHE  24           HB2      PHE  24  -0.405   0.336  -7.087
  182    HB3  PHE  24           HB3      PHE  24  -1.346  -0.948  -6.360
  183    HD1  PHE  24           HD1      PHE  24   2.245   0.111  -6.835
  184    HD2  PHE  24           HD2      PHE  24  -0.666  -1.722  -4.211
  185    HE1  PHE  24           HE1      PHE  24   3.955  -0.066  -5.071
  186    HE2  PHE  24           HE2      PHE  24   1.063  -1.765  -2.406
  187    HZ   PHE  24           HZ       PHE  24   3.347  -1.003  -2.851
  188    H    LYS  25           H        LYS  25   0.437   0.518  -9.451
  189    HA   LYS  25           HA       LYS  25   3.265  -0.314  -9.946
  190    HB2  LYS  25           HB2      LYS  25   1.185   0.730 -11.912
  191    HB3  LYS  25           HB3      LYS  25   2.906   1.002 -12.146
  192    HG2  LYS  25           HG2      LYS  25   2.425  -0.875 -13.420
  193    HG3  LYS  25           HG3      LYS  25   3.316  -1.465 -12.022
  194    HD2  LYS  25           HD2      LYS  25   1.343  -2.433 -11.058
  195    HD3  LYS  25           HD3      LYS  25   0.273  -1.604 -12.193
  196    HE2  LYS  25           HE2      LYS  25   2.428  -3.610 -13.000
  197    HE3  LYS  25           HE3      LYS  25   0.764  -4.076 -12.620
  198    HZ1  LYS  25           HZ1      LYS  25  -0.026  -2.755 -14.398
  199    HZ2  LYS  25           HZ2      LYS  25   1.144  -3.757 -14.974
  200    HZ3  LYS  25           HZ3      LYS  25   1.458  -2.155 -14.767
  201    H    ALA  26           H        ALA  26   4.707   1.558 -10.305
  202    HA   ALA  26           HA       ALA  26   4.276   3.545  -8.327
  203    HB1  ALA  26           HB1      ALA  26   6.541   2.887  -9.172
  204    HB2  ALA  26           HB2      ALA  26   6.196   3.714 -10.694
  205    HB3  ALA  26           HB3      ALA  26   6.272   4.634  -9.187
  206    H    GLY  27           H        GLY  27   2.953   5.218  -8.386
  207    HA2  GLY  27           HA2      GLY  27   2.282   7.326  -9.355
  208    HA3  GLY  27           HA3      GLY  27   2.225   6.550 -10.939
  209    H    GLU  28           H        GLU  28   0.904   4.122  -9.313
  210    HA   GLU  28           HA       GLU  28  -1.770   4.917  -9.995
  211    HB2  GLU  28           HB2      GLU  28  -0.564   2.567 -10.104
  212    HB3  GLU  28           HB3      GLU  28  -0.985   2.440  -8.404
  213    HG2  GLU  28           HG2      GLU  28  -2.784   1.403  -9.492
  214    HG3  GLU  28           HG3      GLU  28  -3.421   3.024  -9.217
  215    H    GLU  29           H        GLU  29  -3.361   5.776  -8.653
  216    HA   GLU  29           HA       GLU  29  -2.680   6.237  -5.806
  217    HB2  GLU  29           HB2      GLU  29  -4.829   7.314  -7.663
  218    HB3  GLU  29           HB3      GLU  29  -4.866   7.543  -5.908
  219    HG2  GLU  29           HG2      GLU  29  -2.671   8.656  -5.965
  220    HG3  GLU  29           HG3      GLU  29  -2.646   8.513  -7.736
  221    H    LEU  30           H        LEU  30  -3.194   4.580  -4.508
  222    HA   LEU  30           HA       LEU  30  -5.654   2.958  -5.030
  223    HB2  LEU  30           HB2      LEU  30  -4.628   1.500  -3.206
  224    HB3  LEU  30           HB3      LEU  30  -3.901   1.378  -4.832
  225    HG   LEU  30           HG       LEU  30  -2.690   3.310  -2.898
  226   HD11  LEU  30          HD11      LEU  30  -3.117   1.438  -1.387
  227   HD12  LEU  30          HD12      LEU  30  -1.397   1.558  -1.739
  228   HD13  LEU  30          HD13      LEU  30  -2.357   0.303  -2.545
  229   HD21  LEU  30          HD21      LEU  30  -0.592   2.537  -3.853
  230   HD22  LEU  30          HD22      LEU  30  -1.723   2.904  -5.164
  231   HD23  LEU  30          HD23      LEU  30  -1.419   1.222  -4.711
  232    H    MET  31           H        MET  31  -6.965   2.424  -3.238
  233    HA   MET  31           HA       MET  31  -7.000   4.535  -1.140
  234    HB2  MET  31           HB2      MET  31  -9.472   2.949  -1.822
  235    HB3  MET  31           HB3      MET  31  -9.257   4.442  -0.948
  236    HG2  MET  31           HG2      MET  31  -8.223   5.113  -3.435
  237    HG3  MET  31           HG3      MET  31  -9.528   4.001  -3.838
  238    HE1  MET  31           HE1      MET  31  -8.509   7.527  -3.201
  239    HE2  MET  31           HE2      MET  31  -9.765   8.261  -2.179
  240    HE3  MET  31           HE3      MET  31  -8.642   7.069  -1.484
  241    H    LYS  32           H        LYS  32  -6.193   3.782   0.741
  242    HA   LYS  32           HA       LYS  32  -6.013   0.942   1.355
  243    HB2  LYS  32           HB2      LYS  32  -4.517   2.704   2.238
  244    HB3  LYS  32           HB3      LYS  32  -5.878   3.375   3.175
  245    HG2  LYS  32           HG2      LYS  32  -6.144   1.194   4.388
  246    HG3  LYS  32           HG3      LYS  32  -4.695   0.615   3.566
  247    HD2  LYS  32           HD2      LYS  32  -3.975   1.266   5.683
  248    HD3  LYS  32           HD3      LYS  32  -3.455   2.593   4.636
  249    HE2  LYS  32           HE2      LYS  32  -5.499   3.881   5.403
  250    HE3  LYS  32           HE3      LYS  32  -5.899   2.516   6.465
  251    HZ1  LYS  32           HZ1      LYS  32  -3.687   2.881   7.511
  252    HZ2  LYS  32           HZ2      LYS  32  -4.761   4.065   7.800
  253    HZ3  LYS  32           HZ3      LYS  32  -3.551   4.304   6.720
  254    H    ILE  33           H        ILE  33  -7.440  -0.329   2.776
  255    HA   ILE  33           HA       ILE  33  -9.807   1.136   3.775
  256    HB   ILE  33           HB       ILE  33 -11.306  -0.335   2.957
  257   HG12  ILE  33          HG12      ILE  33  -9.777  -2.125   1.202
  258   HG13  ILE  33          HG13      ILE  33  -9.403  -2.379   2.906
  259   HG21  ILE  33          HG21      ILE  33  -9.577   0.185   0.546
  260   HG22  ILE  33          HG22      ILE  33 -11.326  -0.066   0.587
  261   HG23  ILE  33          HG23      ILE  33 -10.622   1.377   1.338
  262   HD11  ILE  33          HD11      ILE  33 -11.198  -3.814   2.222
  263   HD12  ILE  33          HD12      ILE  33 -11.836  -2.622   3.369
  264   HD13  ILE  33          HD13      ILE  33 -12.154  -2.445   1.619
  265    H    SER  34           H        SER  34  -7.233  -0.550   4.847
  266    HA   SER  34           HA       SER  34  -8.663  -1.556   7.214
  267    HB2  SER  34           HB2      SER  34  -8.339  -3.429   5.609
  268    HB3  SER  34           HB3      SER  34  -6.608  -3.101   5.571
  269    HG   SER  34           HG       SER  34  -6.388  -4.252   7.246
  270    H    GLU  35           H        GLU  35  -6.605  -2.356   8.666
  271    HA   GLU  35           HA       GLU  35  -5.124   0.093   9.368
  272    HB2  GLU  35           HB2      GLU  35  -4.671  -1.189  11.400
  273    HB3  GLU  35           HB3      GLU  35  -6.383  -1.333  11.000
  274    HG2  GLU  35           HG2      GLU  35  -5.673  -3.576   9.784
  275    HG3  GLU  35           HG3      GLU  35  -4.204  -3.439  10.744
  276    H    GLU  36           H        GLU  36  -2.678  -0.316  10.103
  277    HA   GLU  36           HA       GLU  36  -1.127  -1.510   8.020
  278    HB2  GLU  36           HB2      GLU  36  -0.538   0.711   9.067
  279    HB3  GLU  36           HB3      GLU  36  -0.691   0.013  10.645
  280    HG2  GLU  36           HG2      GLU  36   1.525  -0.039  10.631
  281    HG3  GLU  36           HG3      GLU  36   1.350  -1.549   9.763
  282    H    ASP  37           H        ASP  37  -0.673  -3.714   8.243
  283    HA   ASP  37           HA       ASP  37  -1.151  -5.046  10.850
  284    HB2  ASP  37           HB2      ASP  37  -0.577  -5.959   8.044
  285    HB3  ASP  37           HB3      ASP  37  -0.236  -7.048   9.366
  286    H    GLU  38           H        GLU  38   0.640  -6.450  11.717
  287    HA   GLU  38           HA       GLU  38   2.944  -5.004  12.220
  288    HB2  GLU  38           HB2      GLU  38   3.810  -6.989  13.273
  289    HB3  GLU  38           HB3      GLU  38   2.091  -6.786  13.633
  290    HG2  GLU  38           HG2      GLU  38   1.563  -8.528  11.894
  291    HG3  GLU  38           HG3      GLU  38   3.295  -8.721  11.593
  292    H    GLN  39           H        GLN  39   2.523  -7.215   9.549
  293    HA   GLN  39           HA       GLN  39   5.415  -7.145   8.926
  294    HB2  GLN  39           HB2      GLN  39   3.491  -9.091   8.730
  295    HB3  GLN  39           HB3      GLN  39   3.551  -8.535   7.060
  296    HG2  GLN  39           HG2      GLN  39   4.970 -10.481   7.457
  297    HG3  GLN  39           HG3      GLN  39   5.954  -9.132   6.974
  298   HE21  GLN  39          HE21      GLN  39   7.484  -8.192   8.664
  299   HE22  GLN  39          HE22      GLN  39   7.661  -9.034  10.186
  300    H    GLY  40           H        GLY  40   3.235  -4.858   8.675
  301    HA2  GLY  40           HA2      GLY  40   3.182  -2.987   7.437
  302    HA3  GLY  40           HA3      GLY  40   4.455  -3.609   6.376
  303    H    TRP  41           H        TRP  41   1.440  -5.429   7.050
  304    HA   TRP  41           HA       TRP  41   0.784  -5.362   4.192
  305    HB2  TRP  41           HB2      TRP  41   0.230  -7.130   6.549
  306    HB3  TRP  41           HB3      TRP  41  -1.079  -6.968   5.406
  307    HD1  TRP  41           HD1      TRP  41   1.136  -9.346   6.171
  308    HE1  TRP  41           HE1      TRP  41   1.937 -10.789   4.181
  309    HE3  TRP  41           HE3      TRP  41  -0.081  -6.157   2.431
  310    HZ2  TRP  41           HZ2      TRP  41   2.133 -10.461   1.298
  311    HZ3  TRP  41           HZ3      TRP  41   0.407  -6.742   0.060
  312    HH2  TRP  41           HH2      TRP  41   1.349  -8.788  -0.533
  313    H    CYS  42           H        CYS  42  -0.995  -4.252   3.369
  314    HA   CYS  42           HA       CYS  42  -2.925  -3.124   5.319
  315    HB2  CYS  42           HB2      CYS  42  -1.253  -1.738   3.217
  316    HB3  CYS  42           HB3      CYS  42  -2.946  -1.267   3.401
  317    HG   CYS  42           HG       CYS  42  -1.546   0.459   4.612
  318    H    LYS  43           H        LYS  43  -4.949  -3.765   4.770
  319    HA   LYS  43           HA       LYS  43  -5.352  -4.991   2.106
  320    HB2  LYS  43           HB2      LYS  43  -6.357  -5.593   4.636
  321    HB3  LYS  43           HB3      LYS  43  -7.725  -4.774   3.875
  322    HG2  LYS  43           HG2      LYS  43  -6.181  -6.998   2.442
  323    HG3  LYS  43           HG3      LYS  43  -7.446  -7.341   3.634
  324    HD2  LYS  43           HD2      LYS  43  -9.141  -6.211   2.332
  325    HD3  LYS  43           HD3      LYS  43  -7.917  -5.567   1.223
  326    HE2  LYS  43           HE2      LYS  43  -8.940  -7.448   0.138
  327    HE3  LYS  43           HE3      LYS  43  -7.283  -7.872   0.577
  328    HZ1  LYS  43           HZ1      LYS  43  -8.858  -9.605   1.014
  329    HZ2  LYS  43           HZ2      LYS  43  -9.673  -8.691   2.113
  330    HZ3  LYS  43           HZ3      LYS  43  -8.095  -9.145   2.397
  331    H    GLY  44           H        GLY  44  -6.265  -3.871   0.392
  332    HA2  GLY  44           HA2      GLY  44  -7.832  -1.434   0.945
  333    HA3  GLY  44           HA3      GLY  44  -6.303  -1.200   0.153
  334    H    ARG  45           H        ARG  45  -7.877  -0.285  -1.435
  335    HA   ARG  45           HA       ARG  45  -8.573  -2.320  -3.450
  336    HB2  ARG  45           HB2      ARG  45 -10.616  -1.655  -2.103
  337    HB3  ARG  45           HB3      ARG  45 -10.403  -0.003  -2.698
  338    HG2  ARG  45           HG2      ARG  45 -10.731  -0.794  -5.023
  339    HG3  ARG  45           HG3      ARG  45 -10.751  -2.457  -4.479
  340    HD2  ARG  45           HD2      ARG  45 -13.004  -1.859  -4.861
  341    HD3  ARG  45           HD3      ARG  45 -12.809  -1.923  -3.101
  342    HE   ARG  45           HE       ARG  45 -12.266   0.720  -3.850
  343   HH11  ARG  45          HH11      ARG  45 -15.085  -1.418  -4.249
  344   HH12  ARG  45          HH12      ARG  45 -16.185  -0.082  -4.473
  345   HH21  ARG  45          HH21      ARG  45 -13.820   2.448  -3.812
  346   HH22  ARG  45          HH22      ARG  45 -15.461   2.097  -4.164
  347    H    LEU  46           H        LEU  46  -8.234  -1.611  -5.588
  348    HA   LEU  46           HA       LEU  46  -6.518   0.796  -5.914
  349    HB2  LEU  46           HB2      LEU  46  -7.311  -1.559  -7.675
  350    HB3  LEU  46           HB3      LEU  46  -6.901  -0.056  -8.444
  351    HG   LEU  46           HG       LEU  46  -4.715  -0.139  -7.003
  352   HD11  LEU  46          HD11      LEU  46  -5.427  -2.091  -5.744
  353   HD12  LEU  46          HD12      LEU  46  -3.869  -2.269  -6.568
  354   HD13  LEU  46          HD13      LEU  46  -5.315  -3.058  -7.240
  355   HD21  LEU  46          HD21      LEU  46  -4.829  -0.159  -9.491
  356   HD22  LEU  46          HD22      LEU  46  -5.094  -1.915  -9.437
  357   HD23  LEU  46          HD23      LEU  46  -3.567  -1.215  -8.852
  358    H    LEU  47           H        LEU  47  -7.117   2.220  -7.843
  359    HA   LEU  47           HA       LEU  47  -9.781   3.287  -7.519
  360    HB2  LEU  47           HB2      LEU  47  -9.275   4.723  -9.396
  361    HB3  LEU  47           HB3      LEU  47  -7.949   4.692  -8.246
  362    HG   LEU  47           HG       LEU  47  -7.266   2.681 -10.126
  363   HD11  LEU  47          HD11      LEU  47  -9.051   3.502 -11.663
  364   HD12  LEU  47          HD12      LEU  47  -7.427   3.760 -12.317
  365   HD13  LEU  47          HD13      LEU  47  -8.326   5.121 -11.612
  366   HD21  LEU  47          HD21      LEU  47  -5.502   4.209 -10.755
  367   HD22  LEU  47          HD22      LEU  47  -5.797   4.229  -9.005
  368   HD23  LEU  47          HD23      LEU  47  -6.384   5.570  -9.998
  369    H    THR  48           H        THR  48  -8.385   0.825  -9.654
  370    HA   THR  48           HA       THR  48 -10.499   0.689 -11.582
  371    HB   THR  48           HB       THR  48  -9.321  -1.508 -12.044
  372    HG1  THR  48           HG1      THR  48  -7.417  -1.919 -10.876
  373   HG21  THR  48          HG21      THR  48  -7.426   0.878 -11.794
  374   HG22  THR  48          HG22      THR  48  -8.557   0.587 -13.133
  375   HG23  THR  48          HG23      THR  48  -7.221  -0.539 -12.836
  376    H    GLY  49           H        GLY  49 -10.321  -0.107  -8.297
  377    HA2  GLY  49           HA2      GLY  49 -12.093  -0.984  -7.024
  378    HA3  GLY  49           HA3      GLY  49 -12.754  -1.767  -8.470
  379    H    HIS  50           H        HIS  50  -9.491  -2.551  -8.534
  380    HA   HIS  50           HA       HIS  50  -9.960  -5.281  -7.844
  381    HB2  HIS  50           HB2      HIS  50  -8.354  -4.517  -9.524
  382    HB3  HIS  50           HB3      HIS  50  -7.439  -3.653  -8.304
  383    HD1  HIS  50           HD1      HIS  50  -8.426  -7.396  -7.671
  384    HD2  HIS  50           HD2      HIS  50  -5.223  -4.921  -8.920
  385    HE1  HIS  50           HE1      HIS  50  -6.349  -8.808  -7.587
  386    H    VAL  51           H        VAL  51  -9.591  -6.371  -5.838
  387    HA   VAL  51           HA       VAL  51  -8.769  -4.687  -3.510
  388    HB   VAL  51           HB       VAL  51 -10.231  -6.232  -2.204
  389   HG11  VAL  51          HG11      VAL  51 -10.953  -3.965  -2.759
  390   HG12  VAL  51          HG12      VAL  51 -11.694  -4.564  -4.271
  391   HG13  VAL  51          HG13      VAL  51 -12.321  -5.079  -2.696
  392   HG21  VAL  51          HG21      VAL  51 -11.480  -7.025  -4.863
  393   HG22  VAL  51          HG22      VAL  51 -10.539  -8.098  -3.797
  394   HG23  VAL  51          HG23      VAL  51 -12.072  -7.429  -3.247
  395    H    GLY  52           H        GLY  52  -7.446  -5.626  -1.853
  396    HA2  GLY  52           HA2      GLY  52  -6.820  -8.236  -1.467
  397    HA3  GLY  52           HA3      GLY  52  -5.690  -7.717  -2.727
  398    H    LEU  53           H        LEU  53  -4.296  -8.373  -0.812
  399    HA   LEU  53           HA       LEU  53  -3.857  -6.376   1.316
  400    HB2  LEU  53           HB2      LEU  53  -3.010  -9.197   0.641
  401    HB3  LEU  53           HB3      LEU  53  -1.788  -8.211   1.383
  402    HG   LEU  53           HG       LEU  53  -4.479  -8.857   2.604
  403   HD11  LEU  53          HD11      LEU  53  -2.783 -10.688   2.486
  404   HD12  LEU  53          HD12      LEU  53  -3.106 -10.176   4.161
  405   HD13  LEU  53          HD13      LEU  53  -1.620  -9.675   3.345
  406   HD21  LEU  53          HD21      LEU  53  -3.962  -6.685   3.446
  407   HD22  LEU  53          HD22      LEU  53  -2.234  -7.057   3.543
  408   HD23  LEU  53          HD23      LEU  53  -3.386  -7.802   4.679
  409    H    TYR  54           H        TYR  54  -2.224  -4.803   1.058
  410    HA   TYR  54           HA       TYR  54  -0.345  -5.093  -1.188
  411    HB2  TYR  54           HB2      TYR  54  -0.640  -2.941  -1.933
  412    HB3  TYR  54           HB3      TYR  54  -2.252  -3.524  -1.733
  413    HD1  TYR  54           HD1      TYR  54  -3.802  -2.451  -0.216
  414    HD2  TYR  54           HD2      TYR  54   0.368  -1.355  -0.203
  415    HE1  TYR  54           HE1      TYR  54  -4.313  -0.510   1.234
  416    HE2  TYR  54           HE2      TYR  54  -0.140   0.550   1.261
  417    HH   TYR  54           HH       TYR  54  -1.760   1.567   2.628
  418    HA   PRO  55           HA       PRO  55   2.456  -4.284   2.133
  419    HB2  PRO  55           HB2      PRO  55   4.767  -3.804   0.822
  420    HB3  PRO  55           HB3      PRO  55   3.888  -5.354   0.740
  421    HG2  PRO  55           HG2      PRO  55   3.781  -3.146  -1.322
  422    HG3  PRO  55           HG3      PRO  55   4.078  -4.895  -1.573
  423    HD2  PRO  55           HD2      PRO  55   1.601  -3.859  -1.841
  424    HD3  PRO  55           HD3      PRO  55   1.912  -5.500  -1.196
  425    H    ALA  56           H        ALA  56   1.792  -2.509   3.262
  426    HA   ALA  56           HA       ALA  56   1.486   0.136   2.480
  427    HB1  ALA  56           HB1      ALA  56   0.753  -0.869   4.670
  428    HB2  ALA  56           HB2      ALA  56   2.426  -0.757   5.239
  429    HB3  ALA  56           HB3      ALA  56   1.518   0.709   4.850
  430    H    ASN  57           H        ASN  57   4.459  -1.462   3.453
  431    HA   ASN  57           HA       ASN  57   6.197   0.717   3.891
  432    HB2  ASN  57           HB2      ASN  57   6.711  -2.014   2.614
  433    HB3  ASN  57           HB3      ASN  57   7.972  -0.901   3.097
  434   HD21  ASN  57          HD21      ASN  57   6.351  -3.681   4.124
  435   HD22  ASN  57          HD22      ASN  57   6.629  -3.383   5.841
  436    H    TYR  58           H        TYR  58   4.911  -0.456   0.807
  437    HA   TYR  58           HA       TYR  58   6.946   0.984  -0.754
  438    HB2  TYR  58           HB2      TYR  58   4.878  -1.117  -1.386
  439    HB3  TYR  58           HB3      TYR  58   5.794  -0.307  -2.637
  440    HD1  TYR  58           HD1      TYR  58   6.300  -2.261   0.526
  441    HD2  TYR  58           HD2      TYR  58   7.760  -1.390  -3.424
  442    HE1  TYR  58           HE1      TYR  58   8.151  -3.865   0.873
  443    HE2  TYR  58           HE2      TYR  58   9.538  -3.082  -3.127
  444    HH   TYR  58           HH       TYR  58  10.659  -4.508  -1.587
  445    H    VAL  59           H        VAL  59   4.246   2.023   0.782
  446    HA   VAL  59           HA       VAL  59   3.429   3.787  -1.460
  447    HB   VAL  59           HB       VAL  59   1.318   3.061  -1.452
  448   HG11  VAL  59          HG11      VAL  59   2.112   0.648   0.073
  449   HG12  VAL  59          HG12      VAL  59   0.777   0.870  -1.077
  450   HG13  VAL  59          HG13      VAL  59   2.425   0.934  -1.657
  451   HG21  VAL  59          HG21      VAL  59  -0.085   2.557   0.449
  452   HG22  VAL  59          HG22      VAL  59   1.319   2.617   1.551
  453   HG23  VAL  59          HG23      VAL  59   0.733   4.076   0.706
  454    H    GLU  60           H        GLU  60   2.356   5.783  -0.688
  455    HA   GLU  60           HA       GLU  60   2.721   6.662   2.042
  456    HB2  GLU  60           HB2      GLU  60   5.009   7.005   1.010
  457    HB3  GLU  60           HB3      GLU  60   4.250   8.057  -0.204
  458    HG2  GLU  60           HG2      GLU  60   3.436   9.547   1.626
  459    HG3  GLU  60           HG3      GLU  60   4.160   8.481   2.818
  460    H    LYS  61           H        LYS  61   1.384   8.493   2.410
  461    HA   LYS  61           HA       LYS  61  -0.870   8.888   0.680
  462    HB2  LYS  61           HB2      LYS  61   0.220  10.048   3.243
  463    HB3  LYS  61           HB3      LYS  61  -0.742  11.137   2.271
  464    HG2  LYS  61           HG2      LYS  61  -2.636   9.541   2.264
  465    HG3  LYS  61           HG3      LYS  61  -1.675   8.420   3.255
  466    HD2  LYS  61           HD2      LYS  61  -3.223   9.676   4.666
  467    HD3  LYS  61           HD3      LYS  61  -1.543  10.062   5.049
  468    HE2  LYS  61           HE2      LYS  61  -1.832  12.121   3.500
  469    HE3  LYS  61           HE3      LYS  61  -3.567  11.762   3.518
  470    HZ1  LYS  61           HZ1      LYS  61  -3.486  12.038   5.914
  471    HZ2  LYS  61           HZ2      LYS  61  -2.943  13.383   5.187
  472    HZ3  LYS  61           HZ3      LYS  61  -1.857  12.342   5.861
  473    H    VAL  62           H        VAL  62  -1.477  10.759  -0.452
  474    HA   VAL  62           HA       VAL  62   0.659  12.657  -1.077
  475    HB   VAL  62           HB       VAL  62   0.553  10.648  -2.658
  476   HG11  VAL  62          HG11      VAL  62  -0.973  11.118  -4.658
  477   HG12  VAL  62          HG12      VAL  62  -1.754  10.466  -3.201
  478   HG13  VAL  62          HG13      VAL  62  -1.883  12.196  -3.637
  479   HG21  VAL  62          HG21      VAL  62   0.499  13.460  -3.821
  480   HG22  VAL  62          HG22      VAL  62   1.891  12.692  -3.024
  481   HG23  VAL  62          HG23      VAL  62   1.252  12.026  -4.530
  482    H    GLY  63           H        GLY  63  -0.500  14.643  -2.332
  483    HA2  GLY  63           HA2      GLY  63  -2.626  15.695  -2.723
  484    HA3  GLY  63           HA3      GLY  63  -3.265  14.985  -1.245
  485    H    LEU  64           H        LEU  64  -1.822  15.577   0.832
  486    HA   LEU  64           HA       LEU  64  -1.879  18.482   0.909
  487    HB2  LEU  64           HB2      LEU  64  -1.773  16.251   2.851
  488    HB3  LEU  64           HB3      LEU  64  -0.785  17.605   3.350
  489    HG   LEU  64           HG       LEU  64  -3.645  17.996   2.428
  490   HD11  LEU  64          HD11      LEU  64  -4.271  18.017   4.831
  491   HD12  LEU  64          HD12      LEU  64  -2.631  17.472   5.244
  492   HD13  LEU  64          HD13      LEU  64  -3.704  16.430   4.281
  493   HD21  LEU  64          HD21      LEU  64  -1.772  19.689   4.155
  494   HD22  LEU  64          HD22      LEU  64  -3.457  20.077   3.804
  495   HD23  LEU  64          HD23      LEU  64  -2.282  20.057   2.491
  496    H    ALA  65           H        ALA  65  -0.144  19.672   2.088
  497    HA   ALA  65           HA       ALA  65   2.595  18.978   1.164
  498    HB1  ALA  65           HB1      ALA  65   2.868  21.368   0.633
  499    HB2  ALA  65           HB2      ALA  65   1.567  20.636  -0.339
  500    HB3  ALA  65           HB3      ALA  65   1.171  21.665   1.052
  501    H    ALA  66           H        ALA  66   2.145  18.056   3.504
  502    HA   ALA  66           HA       ALA  66   3.548  19.800   5.362
  503    HB1  ALA  66           HB1      ALA  66   1.860  19.575   7.177
  504    HB2  ALA  66           HB2      ALA  66   1.269  20.556   5.834
  505    HB3  ALA  66           HB3      ALA  66   0.694  18.888   6.015
  506    H    ALA  67           H        ALA  67   1.392  16.958   5.919
  507    HA   ALA  67           HA       ALA  67   3.479  15.005   5.798
  508    HB1  ALA  67           HB1      ALA  67   3.743  16.075   8.172
  509    HB2  ALA  67           HB2      ALA  67   2.155  15.333   8.514
  510    HB3  ALA  67           HB3      ALA  67   3.528  14.331   8.068
  511    H1   THR 101           H        THR 101   0.665 -13.655  11.186
  512    HA   THR 101           HA       THR 101  -0.650 -11.681  10.440
  513    HB   THR 101           HB       THR 101   1.394 -10.281  10.043
  514    HG1  THR 101           HG1      THR 101  -0.696  -9.852   9.033
  515   HG21  THR 101          HG21      THR 101   3.005 -11.429   8.844
  516   HG22  THR 101          HG22      THR 101   2.247 -10.532   7.534
  517   HG23  THR 101          HG23      THR 101   1.832 -12.210   7.750
  518    H    LYS 102           H        LYS 102  -1.052 -11.569   7.719
  519    HA   LYS 102           HA       LYS 102  -2.297 -14.042   7.125
  520    HB2  LYS 102           HB2      LYS 102  -2.751 -11.612   6.258
  521    HB3  LYS 102           HB3      LYS 102  -1.474 -11.914   5.101
  522    HG2  LYS 102           HG2      LYS 102  -3.112 -12.684   3.760
  523    HG3  LYS 102           HG3      LYS 102  -3.060 -14.151   4.708
  524    HD2  LYS 102           HD2      LYS 102  -4.886 -11.755   5.140
  525    HD3  LYS 102           HD3      LYS 102  -5.370 -13.306   4.439
  526    HE2  LYS 102           HE2      LYS 102  -5.203 -14.454   6.511
  527    HE3  LYS 102           HE3      LYS 102  -4.177 -13.198   7.217
  528    HZ1  LYS 102           HZ1      LYS 102  -6.002 -11.707   7.275
  529    HZ2  LYS 102           HZ2      LYS 102  -6.289 -13.044   8.136
  530    HZ3  LYS 102           HZ3      LYS 102  -7.066 -12.850   6.694
  531    H    GLY 103           H        GLY 103   0.649 -12.546   5.623
  532    HA2  GLY 103           HA2      GLY 103   2.012 -15.092   5.481
  533    HA3  GLY 103           HA3      GLY 103   1.503 -14.424   3.923
  534    HA   PRO 104           HA       PRO 104   5.490 -12.404   5.637
  535    HB2  PRO 104           HB2      PRO 104   7.373 -13.472   3.950
  536    HB3  PRO 104           HB3      PRO 104   6.799 -14.316   5.424
  537    HG2  PRO 104           HG2      PRO 104   5.837 -14.712   2.596
  538    HG3  PRO 104           HG3      PRO 104   6.373 -15.961   3.767
  539    HD2  PRO 104           HD2      PRO 104   3.742 -15.350   3.420
  540    HD3  PRO 104           HD3      PRO 104   4.391 -15.721   5.049
  541    H    ALA 105           H        ALA 105   4.810 -10.456   4.988
  542    HA   ALA 105           HA       ALA 105   4.341  -9.639   2.341
  543    HB1  ALA 105           HB1      ALA 105   4.095  -7.465   3.299
  544    HB2  ALA 105           HB2      ALA 105   3.717  -8.528   4.656
  545    HB3  ALA 105           HB3      ALA 105   5.321  -7.803   4.549
  546    HA   PRO 106           HA       PRO 106   8.285  -8.593   0.502
  547    HB2  PRO 106           HB3      PRO 106   7.085  -5.792   0.277
  548    HB3  PRO 106           HB2      PRO 106   8.037  -6.677  -0.883
  549    HG2  PRO 106           HG2      PRO 106   5.346  -6.692  -1.117
  550    HG3  PRO 106           HG3      PRO 106   6.141  -8.299  -1.131
  551    HD2  PRO 106           HD2      PRO 106   5.078  -6.806   1.313
  552    HD3  PRO 106           HD3      PRO 106   4.579  -8.403   0.746
  553    H    ASN 107           H        ASN 107   7.300  -6.828   3.126
  554    HA   ASN 107           HA       ASN 107   9.021  -4.770   3.710
  555    HB2  ASN 107           HB2      ASN 107   8.465  -4.947   5.982
  556    HB3  ASN 107           HB3      ASN 107   7.073  -5.589   5.121
  557   HD21  ASN 107          HD21      ASN 107   8.113  -8.389   4.703
  558   HD22  ASN 107          HD22      ASN 107   8.172  -9.019   6.325
  559    HA   PRO 108           HA       PRO 108  10.427  -3.875   5.800
  560    HB2  PRO 108           HB2      PRO 108  12.943  -2.777   5.656
  561    HB3  PRO 108           HB3      PRO 108  12.453  -3.943   6.893
  562    HG2  PRO 108           HG2      PRO 108  13.890  -4.420   4.251
  563    HG3  PRO 108           HG3      PRO 108  14.407  -4.967   5.880
  564    HD2  PRO 108           HD2      PRO 108  13.040  -6.617   4.244
  565    HD3  PRO 108           HD3      PRO 108  12.668  -6.571   5.983
  566    HA   PRO 109           HA       PRO 109   9.985  -1.161   2.374
  567    HB2  PRO 109           HB2      PRO 109  10.974   1.333   3.111
  568    HB3  PRO 109           HB3      PRO 109   9.418   0.674   3.640
  569    HG2  PRO 109           HG2      PRO 109  12.055   0.626   5.099
  570    HG3  PRO 109           HG3      PRO 109  10.427   1.031   5.740
  571    HD2  PRO 109           HD2      PRO 109  11.507  -1.391   6.135
  572    HD3  PRO 109           HD3      PRO 109   9.782  -1.237   5.774
  573    HA   PRO 110           HA       PRO 110  13.805  -1.848   0.244
  574    HB2  PRO 110           HB2      PRO 110  13.220  -0.918  -2.255
  575    HB3  PRO 110           HB3      PRO 110  12.448  -2.356  -1.526
  576    HG2  PRO 110           HG2      PRO 110  11.343   0.488  -1.536
  577    HG3  PRO 110           HG3      PRO 110  10.554  -0.996  -2.104
  578    HD2  PRO 110           HD2      PRO 110  10.130  -0.111   0.414
  579    HD3  PRO 110           HD3      PRO 110  10.367  -1.846   0.130
  580    H    ILE 111           H        ILE 111  12.825   1.300  -1.187
  581    HA   ILE 111           HA       ILE 111  15.273   2.621  -0.250
  582    HB   ILE 111           HB       ILE 111  15.652   3.482  -2.509
  583   HG12  ILE 111          HG12      ILE 111  13.474   1.602  -3.585
  584   HG13  ILE 111          HG13      ILE 111  13.250   3.317  -3.328
  585   HG21  ILE 111          HG21      ILE 111  16.819   1.411  -1.794
  586   HG22  ILE 111          HG22      ILE 111  15.533   0.424  -2.505
  587   HG23  ILE 111          HG23      ILE 111  16.554   1.384  -3.545
  588   HD11  ILE 111          HD11      ILE 111  15.272   2.131  -5.237
  589   HD12  ILE 111          HD12      ILE 111  13.736   2.912  -5.644
  590   HD13  ILE 111          HD13      ILE 111  15.038   3.866  -4.911
  591    H    LEU 112           H        LEU 112  14.964   4.938  -0.275
  592    HA   LEU 112           HA       LEU 112  13.928   6.922   0.046
  593    HB2  LEU 112           HB2      LEU 112  11.748   5.724  -1.679
  594    HB3  LEU 112           HB3      LEU 112  11.581   7.277  -0.929
  595    HG   LEU 112           HG       LEU 112  13.284   8.261  -2.228
  596   HD11  LEU 112          HD11      LEU 112  14.999   6.516  -2.361
  597   HD12  LEU 112          HD12      LEU 112  14.555   7.057  -3.977
  598   HD13  LEU 112          HD13      LEU 112  13.927   5.515  -3.374
  599   HD21  LEU 112          HD21      LEU 112  11.032   7.865  -3.296
  600   HD22  LEU 112          HD22      LEU 112  11.684   6.410  -4.079
  601   HD23  LEU 112          HD23      LEU 112  12.348   8.008  -4.471
  602    H    LYS 113           H        LYS 113  12.764   7.838   1.717
  603    HA   LYS 113           HA       LYS 113  11.953   7.727   3.893
  604    HB2  LYS 113           HB2      LYS 113   9.574   6.857   2.207
  605    HB3  LYS 113           HB3      LYS 113   9.465   7.561   3.812
  606    HG2  LYS 113           HG2      LYS 113  10.627   8.959   1.362
  607    HG3  LYS 113           HG3      LYS 113   9.002   9.179   1.969
  608    HD2  LYS 113           HD2      LYS 113  11.523   9.837   3.568
  609    HD3  LYS 113           HD3      LYS 113  10.641  11.000   2.605
  610    HE2  LYS 113           HE2      LYS 113   9.424   9.459   4.933
  611    HE3  LYS 113           HE3      LYS 113  10.114  11.079   5.046
  612    HZ1  LYS 113           HZ1      LYS 113   7.745  10.323   3.432
  613    HZ2  LYS 113           HZ2      LYS 113   8.450  11.795   3.384
  614    HZ3  LYS 113           HZ3      LYS 113   7.792  11.268   4.783
  615    H    VAL 114           H        VAL 114  13.475   5.666   3.875
  616    HA   VAL 114           HA       VAL 114  12.481   3.086   4.288
  617    HB   VAL 114           HB       VAL 114  14.891   4.149   5.778
  618   HG11  VAL 114          HG11      VAL 114  15.897   2.011   5.064
  619   HG12  VAL 114          HG12      VAL 114  14.376   1.754   5.936
  620   HG13  VAL 114          HG13      VAL 114  14.415   1.621   4.153
  621   HG21  VAL 114          HG21      VAL 114  15.200   5.280   3.669
  622   HG22  VAL 114          HG22      VAL 114  16.307   3.924   3.759
  623   HG23  VAL 114          HG23      VAL 114  14.853   3.790   2.757
  624    H    TRP 115           H        TRP 115  12.344   5.860   6.334
  625    HA   TRP 115           HA       TRP 115  10.835   4.601   8.423
  626    HB2  TRP 115           HB2      TRP 115  12.301   5.523  10.170
  627    HB3  TRP 115           HB3      TRP 115  13.138   4.265   9.262
  628    HD1  TRP 115           HD1      TRP 115  15.317   4.975   7.960
  629    HE1  TRP 115           HE1      TRP 115  16.728   7.112   7.856
  630    HE3  TRP 115           HE3      TRP 115  12.173   8.120  10.454
  631    HZ2  TRP 115           HZ2      TRP 115  16.304   9.964   8.411
  632    HZ3  TRP 115           HZ3      TRP 115  12.682  10.538  10.646
  633    HH2  TRP 115           HH2      TRP 115  14.732  11.471   9.570