*HEADER   TOXIN                                   08-MAY-96   1WKT    
*TITLE    WILLIOPSIS MRAKII KILLER TOXIN, NMR SOLUTION STRUCTURE      
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: YEAST KILLER TOXIN;                              
*COMPND  3 CHAIN: NULL                                                
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: WILLIOPSIS MRAKII;                    
*SOURCE  3 ORGANISM_COMMON: YEAST                                     
*KEYWDS   YEAST KILLER TOXIN, NMR, WILLIOPSIS MRAKII                  
*EXPDTA   NMR, 20 STRUCTURES                                          
*AUTHOR   W.ANTUCH,P.GUNTERT,K.WUTHRICH                               
*REVDAT  1   08-NOV-96 1WKT    0                                      


Upper limits for distances:

  1 GLY  
         HA1     2 ASP- HN      3.40
         HA2     2 ASP- HN      3.40
  2 ASP- 
         HN      2 ASP- HB2     4.10
         HN      2 ASP- HB3     4.10
         HN      2 ASP- QB      3.85
         HN      3 GLY  HN      3.70
         HA      3 GLY  HN      3.60
         HB2     3 GLY  HN      5.00
         HB3     3 GLY  HN      5.00
         QB      3 GLY  HN      4.27
  3 GLY  
         HN     42 SER  HA      5.50
         HN     42 SER  QB      6.28
         HA1     4 TYR  HN      2.80
         HA2     4 TYR  HN      2.80
  4 TYR  
         HN      4 TYR  HB3     3.70
         HN      4 TYR  QE      6.50
         HN     40 GLY  HN      3.50
         HA      4 TYR  HB2     2.80
         HA      4 TYR  HB3     2.80
         HA      5 LEU  HN      2.60
         HB2     5 LEU  HN      3.00
         HB2     6 ILE  QG2     5.70
         HB2    20 TRP  HZ3     4.60
         HB3     5 LEU  HN      3.40
         HB3    20 TRP  HZ3     5.40
         QD      5 LEU  HN      6.20
         QD      5 LEU  HA      7.00
         QD      6 ILE  HN      7.10
         QD      6 ILE  QG2     7.50
         QD      6 ILE  HG12    7.50
         QD      6 ILE  HG13    7.50
         QD      6 ILE  QG1     6.92
         QD      6 ILE  QD1     8.30
         QD     20 TRP  HH2     7.50
         QD     38 VAL  QG1     8.50
         QD     39 THR  HA      7.40
         QD     41 GLY  HA1     7.50
         QD     41 GLY  HA2     7.50
         QD     41 GLY  QA      7.30
         QE      5 LEU  HA      7.50
         QE      6 ILE  HN      7.50
         QE      6 ILE  QG2     8.50
         QE      6 ILE  HG12    7.50
         QE      6 ILE  HG13    7.50
         QE      6 ILE  QG1     7.01
         QE      6 ILE  QD1     7.50
         QE     13 PRO  HB3     7.50
         QE     13 PRO  QG      8.38
         QE     20 TRP  HH2     7.50
         QE     38 VAL  HB      7.50
         QE     38 VAL  QG1     7.00
         QE     39 THR  HA      7.50
         QE     40 GLY  HN      5.80
         QE     40 GLY  QA      8.38
         QE     41 GLY  HN      7.50
         QE     41 GLY  HA1     7.50
         QE     41 GLY  HA2     7.50
         QE     41 GLY  QA      7.35
  5 LEU  
         HN      5 LEU  HG      5.50
         HN      5 LEU  QD1     6.50
         HN      5 LEU  QD2     6.50
         HN      6 ILE  QG2     6.50
         HN     23 ASN  QD2     5.07
         HA      5 LEU  HG      3.10
         HA      5 LEU  QD1     6.40
         HA      5 LEU  QD2     6.40
         HA      6 ILE  HN      2.50
         HA     39 THR  HA      2.90
         HA     40 GLY  HN      4.10
         HG      6 ILE  HN      4.10
         QD1     6 ILE  HN      6.50
         QD1    49 CYSS HA      6.50
         QD2     6 ILE  HN      6.50
         QD2    49 CYSS HA      6.50
         QQD    49 CYSS HA      6.21
         QQD    86 ARG+ HE      8.07
  6 ILE  
         HN      6 ILE  HG12    3.60
         HN      6 ILE  HG13    3.60
         HN      6 ILE  QG1     3.20
         HN      6 ILE  QD1     6.50
         HN     39 THR  HA      3.60
         HA      6 ILE  HB      2.90
         HA      6 ILE  QG2     3.60
         HA      7 MET  HN      2.60
         HA     84 TYR  QE      7.50
         HB     18 CYSS HB3     3.40
         QG2    18 CYSS HB3     6.50
         QG2    19 ASP- HN      6.50
         QG2    20 TRP  HN      4.70
         QG2    20 TRP  HA      4.20
         QG2    20 TRP  HB3     6.50
         QG2    20 TRP  HD1     6.50
         QG2    20 TRP  HE3     5.30
         QG2    20 TRP  HE1     6.50
         QG2    20 TRP  HZ3     6.50
         QG2    20 TRP  HH2     6.50
         QG2    21 LYS+ HN      6.50
         QD1    18 CYSS HN      6.50
         QD1    18 CYSS HB2     4.90
         QD1    19 ASP- HN      6.50
         QD1    20 TRP  HN      6.50
         QD1    20 TRP  HD1     5.10
         QD1    20 TRP  HE1     6.50
         QD1    20 TRP  HZ3     6.50
         QD1    20 TRP  HH2     6.40
         QD1    38 VAL  HN      6.50
         QD1    38 VAL  HB      4.90
  7 MET  
         HN      7 MET  HB2     3.70
         HN      7 MET  HB3     3.50
         HN      7 MET  HG2     5.10
         HN      7 MET  HG3     5.10
         HN      7 MET  QG      4.29
         HA      7 MET  HB2     2.80
         HA      7 MET  HB3     2.80
         HA      8 CYSS HN      2.50
         HA     37 MET  HA      2.70
         HA     38 VAL  HN      3.30
         HB2     8 CYSS HN      3.60
         HB3     8 CYSS HN      4.40
         HB3    19 ASP- HN      5.50
         HB3    84 TYR  QE      7.50
         HG2    84 TYR  QE      7.30
         HG3    84 TYR  QE      7.30
         QG     84 TYR  QE      6.72
         QG     84 TYR  HH      6.38
  8 CYSS 
         HN      8 CYSS HB2     3.20
         HN      8 CYSS HB3     3.70
         HN     34 VAL  QQG     6.56
         HN     36 TRP  HN      3.60
         HN     36 TRP  HB2     4.90
         HN     36 TRP  HB3     5.50
         HN     37 MET  HA      3.40
         HN     38 VAL  QG2     6.50
         HN     75 ILE  QD1     6.50
         HA      8 CYSS HB3     2.90
         HA      9 LYS+ HN      2.60
         HA     10 ASN  HN      4.30
         HA     18 CYSS HA      2.60
         HA     18 CYSS HB2     5.50
         HA     18 CYSS HB3     4.40
         HA     19 ASP- HN      3.50
         HB2     9 LYS+ HN      4.10
         HB2    10 ASN  HN      3.20
         HB2    36 TRP  HB2     3.30
         HB2    36 TRP  HD1     5.50
         HB3     9 LYS+ HN      3.00
         HB3    10 ASN  HN      2.70
         HB3    36 TRP  HB2     5.50
  9 LYS+ 
         HN      9 LYS+ HB2     3.60
         HN      9 LYS+ HB3     3.60
         HN      9 LYS+ QB      3.10
         HN      9 LYS+ QG      5.28
         HN      9 LYS+ QD      4.38
         HN     10 ASN  HN      3.10
         HN     18 CYSS HA      3.50
         HN     34 VAL  QQG     7.86
         HA      9 LYS+ QD      6.38
         HA     34 VAL  HN      4.70
         HA     34 VAL  HA      2.70
         HA     35 HIS  HN      3.50
         HA     35 HIS  HD2     5.50
         HA     36 TRP  HD1     5.10
         HB2    10 ASN  HN      4.10
         HB3    10 ASN  HN      4.10
         QB     10 ASN  HN      3.85
         QG     34 VAL  HA      4.58
         QD     10 ASN  HN      6.38
         QD     34 VAL  HA      5.78
 10 ASN  
         HN     16 GLY  HA1     4.80
         HN     16 GLY  HA2     3.40
         HN     34 VAL  QQG     8.06
         HN     36 TRP  HB2     5.50
         HN     36 TRP  HD1     5.20
         HN     38 VAL  QG2     6.50
         HA     10 ASN  HB2     2.80
         HA     10 ASN  HB3     2.70
         HA     11 CYSS HN      3.20
         HA     36 TRP  HD1     3.40
         HA     36 TRP  HE1     4.20
         HB2    11 CYSS HN      2.80
         HB2    12 ASP- HN      4.00
         HB3    10 ASN  QD2     3.56
         HB3    11 CYSS HN      3.50
         HB3    12 ASP- HN      4.30
         QD2    15 THR  QG2     7.37
         QD2    16 GLY  HA2     6.37
 11 CYSS 
         HN     11 CYSS HB2     3.50
         HN     11 CYSS HB3     2.90
         HA     11 CYSS HB2     2.80
         HA     12 ASP- HN      3.20
         HA     38 VAL  QG2     4.30
         HB2    12 ASP- HN      4.30
         HB3    12 ASP- HN      4.70
 12 ASP- 
         HN     12 ASP- HB2     3.00
         HN     12 ASP- HB3     2.90
         HN     38 VAL  QG1     6.50
         HA     12 ASP- HB2     3.00
         HA     13 PRO  HD2     2.70
         HA     13 PRO  HD3     2.70
         HB3    15 THR  HN      3.80
         HB3    16 GLY  HN      4.10
 13 PRO  
         HB2    14 ASN  HN      3.70
         HB2    20 TRP  HE1     5.50
         HB2    20 TRP  HZ2     4.00
         HB2    20 TRP  HH2     5.20
         HB3    20 TRP  HZ2     3.80
         HD2    14 ASN  HN      5.40
         HD3    14 ASN  HN      5.40
         QD     38 VAL  QG1     6.48
 14 ASN  
         HN     14 ASN  HB2     3.00
         HN     14 ASN  HB3     2.90
         HN     14 ASN  QD2     6.37
         HN     15 THR  HN      4.00
         HN     15 THR  QG2     6.50
         HA     14 ASN  HB2     2.90
         HA     15 THR  HN      3.50
         HB2    15 THR  QG2     5.80
         HB3    15 THR  HN      3.40
         HB3    15 THR  QG2     6.00
 15 THR  
         HN     15 THR  QG2     4.60
         HN     16 GLY  HN      2.50
         HA     16 GLY  HN      3.10
         QG2    16 GLY  HN      6.50
 16 GLY  
         HN     16 GLY  HA1     2.90
         HN     16 GLY  HA2     2.90
         HA2    17 SER  HN      3.10
 17 SER  
         HA     18 CYSS HN      2.70
         HB2    18 CYSS HN      4.30
         HB3    18 CYSS HN      4.30
         QB     18 CYSS HN      4.01
 18 CYSS 
         HN     18 CYSS HB2     3.00
         HN     18 CYSS HB3     3.50
         HN     20 TRP  HD1     5.50
         HN     20 TRP  HE1     5.50
         HA     18 CYSS HB3     2.80
         HA     19 ASP- HN      2.60
         HB2    20 TRP  HD1     3.50
         HB2    20 TRP  HE1     4.10
         HB3    19 ASP- HN      3.10
         HB3    20 TRP  HE1     4.80
 19 ASP- 
         HN     19 ASP- HB2     3.60
         HN     19 ASP- HB3     3.00
         HA     19 ASP- HB2     2.80
         HA     19 ASP- HB3     2.80
         HA     20 TRP  HN      3.20
         HB2    20 TRP  HN      4.10
         HB2    21 LYS+ HN      4.50
         HB3    20 TRP  HN      4.20
 20 TRP  
         HN     20 TRP  HB2     3.50
         HN     20 TRP  HB3     3.90
         HN     20 TRP  HD1     4.60
         HN     21 LYS+ HN      3.20
         HA     20 TRP  HB3     2.70
         HA     20 TRP  HD1     5.50
         HA     20 TRP  HE3     3.30
         HA     21 LYS+ HN      2.80
         HB2    20 TRP  HD1     3.30
         HB2    20 TRP  HE3     4.10
         HB3    20 TRP  HE3     3.30
         HB3    21 LYS+ HN      5.20
 21 LYS+ 
         HN     21 LYS+ HB2     3.50
         HN     21 LYS+ HB3     3.50
         HN     21 LYS+ QB      3.14
         HN     21 LYS+ HG2     5.50
         HN     21 LYS+ HG3     5.50
         HN     21 LYS+ QG      4.90
         HN     21 LYS+ HD2     5.50
         HN     21 LYS+ HD3     5.50
         HN     21 LYS+ QD      4.90
         HA     21 LYS+ QG      3.89
         HA     21 LYS+ HD2     3.40
         HA     21 LYS+ HD3     3.40
         HA     21 LYS+ QD      3.18
         HA     22 GLN  HN      2.60
         QB     21 LYS+ QE      7.25
         QB     22 GLN  HN      5.40
         QG     22 GLN  HN      5.50
 22 GLN  
         HN     22 GLN  HB2     3.10
         HN     22 GLN  HB3     2.90
         HN     22 GLN  QG      6.40
         HA     22 GLN  QE2     5.57
         HA     23 ASN  HN      2.50
         HB2    22 GLN  HE21    5.50
         HB2    23 ASN  HN      4.10
         HB3    23 ASN  HN      3.70
         QG     23 ASN  HN      5.90
         QG     24 TRP  HN      6.50
         QG     24 TRP  HD1     6.50
         HE21   26 THR  QG2     6.50
         HE22   26 THR  QG2     6.50
         QE2    24 TRP  HN      5.97
 23 ASN  
         HN     23 ASN  HB2     4.00
         HN     23 ASN  HB3     4.00
         HN     23 ASN  QB      3.75
         HN     24 TRP  HN      2.80
         HN     28 VAL  QG2     6.50
         HA     24 TRP  HN      3.50
         HB2    84 TYR  QE      7.50
         HB2    86 ARG+ HN      5.50
         HB3    84 TYR  QE      7.50
         HB3    86 ARG+ HN      5.50
         QB     84 TYR  QE      7.20
         QB     86 ARG+ HN      5.13
         HD21   84 TYR  HH      5.50
         HD22   84 TYR  HH      5.50
         QD2    84 TYR  QE      6.67
 24 TRP  
         HN     24 TRP  HB2     3.30
         HN     24 TRP  HB3     3.30
         HN     24 TRP  QB      2.98
         HN     24 TRP  HD1     3.80
         HN     25 ASN  HN      4.30
         HN     26 THR  HN      5.00
         HA     24 TRP  HD1     5.50
         HA     24 TRP  HE3     3.70
         HA     25 ASN  HN      2.80
         HA     26 THR  HN      4.60
         HA     86 ARG+ HN      3.40
         HA     86 ARG+ QB      4.68
         HE3    87 VAL  HA      5.50
         HZ3    87 VAL  HA      4.40
         HZ2    88 GLU- HA      5.50
         HH2    88 GLU- HA      3.00
 25 ASN  
         HN     25 ASN  HB2     4.10
         HN     25 ASN  HB3     4.10
         HN     25 ASN  QB      3.90
         HN     26 THR  HN      3.50
         HA     26 THR  HN      3.50
         HB2    26 THR  HN      4.60
         HB3    26 THR  HN      4.60
 26 THR  
         HN     26 THR  HB      3.60
         HN     26 THR  QG2     4.90
         HN     27 CYSS HN      4.70
         HN     85 ARG+ QB      4.88
         HN     85 ARG+ HD2     4.60
         HN     85 ARG+ HD3     4.60
         HA     26 THR  HB      3.00
         HA     27 CYSS HN      2.70
         HB     27 CYSS HN      3.80
         HB     28 VAL  QG2     6.50
         QG2    27 CYSS HN      5.30
 27 CYSS 
         HN     27 CYSS HA      2.80
         HN     27 CYSS HB2     3.20
         HN     27 CYSS HB3     3.10
         HA     27 CYSS HB2     2.90
         HA     28 VAL  HN      2.50
         HB2    28 VAL  HN      5.40
         HB2    58 CYSS HB2     5.50
 28 VAL  
         HN     28 VAL  HB      2.90
         HN     84 TYR  HN      3.40
         HN     84 TYR  QD      7.50
         HA     28 VAL  QG1     3.70
         HA     29 GLY  HN      2.40
         HB     29 GLY  HN      4.40
         HB     84 TYR  HN      5.00
         HB     84 TYR  QD      6.60
         HB     84 TYR  QE      6.30
         QG1    29 GLY  HN      4.10
         QG1    29 GLY  QA      7.38
         QG1    83 SER  HA      6.50
         QG1    84 TYR  HN      6.50
         QG1    84 TYR  QD      8.50
         QG1    84 TYR  QE      6.30
         QG1    84 TYR  HH      6.50
         QG2    29 GLY  HN      6.50
         QG2    84 TYR  HN      6.50
 29 GLY  
         HN     29 GLY  HA1     2.80
         HN     29 GLY  HA2     2.80
         HA1    30 ILE  HN      3.00
         HA2    30 ILE  HN      3.00
         QA     30 ILE  HN      2.72
         QA     83 SER  HA      4.68
         QA     84 TYR  HN      6.38
 30 ILE  
         HN     30 ILE  HB      2.90
         HN     30 ILE  QG1     4.28
         HN     30 ILE  QD1     6.50
         HN     31 GLY  HN      5.50
         HN     82 ARG+ HA      3.70
         HN     83 SER  HA      3.20
         HA     30 ILE  HG12    4.00
         HA     30 ILE  HG13    4.00
         HA     30 ILE  QG1     3.65
         HA     31 GLY  HN      2.40
         HA     84 TYR  QE      7.50
         HB     31 GLY  HN      4.70
         HB     82 ARG+ HA      3.20
         HB     83 SER  HA      5.30
         QG2    31 GLY  HN      4.50
         QG2    34 VAL  HN      6.50
         QG2    82 ARG+ HA      6.50
         HG12   84 TYR  HN      5.50
         HG12   84 TYR  QD      5.40
         HG13   84 TYR  HN      5.50
         HG13   84 TYR  QD      5.40
         QG1    83 SER  HA      3.88
         QG1    84 TYR  HN      5.28
         QG1    84 TYR  QE      7.18
         QD1    31 GLY  HN      6.50
         QD1    82 ARG+ HA      6.50
         QD1    83 SER  HA      5.90
         QD1    84 TYR  HN      6.50
 31 GLY  
         HN     31 GLY  QA      2.64
         HN     32 ALA  HN      4.20
         HN     34 VAL  HB      3.70
         HN     34 VAL  QQG     6.26
         HA1    32 ALA  HN      2.90
         HA2    32 ALA  HN      2.90
         QA     32 ALA  HN      2.66
         QA     32 ALA  QB      7.38
         QA     33 ASN  HN      5.28
         QA     34 VAL  QQG     8.34
 32 ALA  
         HN     32 ALA  HA      2.50
         HN     32 ALA  QB      3.40
         HN     33 ASN  HN      3.70
         HN     34 VAL  QQG     8.06
         HA     33 ASN  HN      2.40
         HA     34 VAL  HN      3.70
         HA     80 TYR  QE      7.50
         QB     33 ASN  HN      4.40
         QB     33 ASN  HD21    6.50
         QB     33 ASN  HD22    6.50
         QB     33 ASN  QD2     6.34
         QB     34 VAL  HN      6.50
 33 ASN  
         HN     33 ASN  HA      2.50
         HN     34 VAL  HN      2.90
         HA     33 ASN  HD21    5.50
         HA     34 VAL  HN      3.20
         HA     35 HIS  HD2     4.80
         QB     35 HIS  HD2     6.50
 34 VAL  
         HN     34 VAL  HB      2.50
         HN     34 VAL  QQG     4.10
         HA     35 HIS  HN      2.70
         HA     35 HIS  HD2     5.50
         HA     36 TRP  HN      3.50
         HA     36 TRP  HD1     5.50
         QQG    35 HIS  HN      6.16
         QQG    36 TRP  HN      5.96
         QQG    36 TRP  HD1     8.06
 35 HIS  
         HN     35 HIS  HD2     3.70
         HN     36 TRP  HN      2.50
         HA     35 HIS  HB3     2.90
         HA     36 TRP  HN      3.30
         HA     75 ILE  HB      3.80
         HA     75 ILE  QD1     5.30
         HB2    36 TRP  HD1     4.50
         HB2    36 TRP  HE1     4.90
         HB2    75 ILE  QG1     5.98
         HB3    36 TRP  HD1     5.50
         HB3    36 TRP  HE1     5.50
         HB3    74 ASN  QD2     6.50
         HE1    36 TRP  HZ2     5.50
 36 TRP  
         HN     36 TRP  HB2     2.90
         HN     36 TRP  HD1     4.40
         HN     75 ILE  QD1     5.90
         HA     36 TRP  HB3     2.70
         HA     36 TRP  HD1     5.50
         HA     36 TRP  HE3     3.80
         HA     37 MET  HN      2.50
         HA     74 ASN  HA      2.70
         HA     75 ILE  HN      3.40
         HB2    36 TRP  HD1     3.70
         HB2    37 MET  HN      4.20
         HB3    36 TRP  HE3     3.30
         HB3    36 TRP  HZ3     5.50
         HB3    37 MET  HN      3.50
         HE3    37 MET  HN      5.50
         HE3    38 VAL  QG1     6.50
         HE3    72 CYSS HA      5.50
         HE3    72 CYSS HB2     5.50
         HE3    72 CYSS HB3     4.80
         HE3    73 CYSS HN      5.50
         HE3    74 ASN  HA      3.80
         HE3    74 ASN  QB      6.50
         HE1    74 ASN  QD2     6.50
         HZ3    73 CYSS HA      4.70
         HZ3    74 ASN  HA      4.80
         HZ3    74 ASN  QB      4.70
         HZ2    74 ASN  QB      6.50
         HH2    74 ASN  QB      6.10
 37 MET  
         HN     37 MET  HB2     3.20
         HN     37 MET  HB3     2.90
         HN     37 MET  HG2     4.70
         HN     37 MET  HG3     5.50
         HN     73 CYSS HN      3.50
         HN     74 ASN  HA      4.20
         HN     75 ILE  HN      4.50
         HN     75 ILE  QG2     6.10
         HN     75 ILE  QD1     6.40
         HA     37 MET  HB2     2.70
         HA     37 MET  HG2     3.90
         HA     37 MET  HG3     3.30
         HA     38 VAL  HN      2.50
         HB2    38 VAL  HN      4.30
         HB3    38 VAL  HN      4.40
         HB3    73 CYSS HN      5.20
         HG2    38 VAL  HN      4.80
         HG3    38 VAL  HN      4.70
 38 VAL  
         HN     38 VAL  HB      3.00
         HN     38 VAL  QG2     4.60
         HA     39 THR  HN      2.50
         HA     72 CYSS HA      2.60
         HA     73 CYSS HN      3.70
         QG1    39 THR  HN      4.70
         QG1    71 THR  HN      6.50
         QG1    73 CYSS HN      6.50
         QG2    39 THR  HN      6.40
         QG2    72 CYSS HA      4.30
         QG2    72 CYSS HB2     4.80
         QG2    73 CYSS HN      6.50
 39 THR  
         HN     39 THR  HB      4.10
         HN     71 THR  HN      3.40
         HN     72 CYSS HA      3.60
         HA     39 THR  HB      2.80
         HA     39 THR  QG2     3.80
         HA     40 GLY  HN      2.70
         QG2    40 GLY  HN      5.90
         QG2    48 GLY  HN      4.80
         QG2    67 CYSS HN      6.50
         QG2    67 CYSS HB3     4.20
         QG2    70 ASN  HN      6.50
         QG2    71 THR  HN      6.50
 40 GLY  
         HN     41 GLY  HN      5.50
         HA1    41 GLY  HN      2.90
         HA1    42 SER  HN      4.60
         HA2    41 GLY  HN      2.90
         HA2    42 SER  HN      4.60
         QA     42 SER  HN      4.22
         QA     70 ASN  HN      4.78
 41 GLY  
         HN     42 SER  HN      3.20
         HN     69 ALA  QB      6.50
 42 SER  
         HN     42 SER  HB2     3.40
         HN     42 SER  HB3     3.40
         HN     42 SER  QB      3.18
         HN     70 ASN  QD2     5.27
         HA     43 THR  HN      3.50
         HB2    43 THR  HN      4.80
         HB3    43 THR  HN      4.80
         QB     43 THR  HN      4.28
         QB     44 ASP- HN      4.58
         QB     69 ALA  QB      6.48
         QB     70 ASN  QD2     7.24
 43 THR  
         HN     44 ASP- HN      3.00
         HN     45 GLY  HN      5.50
         HB     44 ASP- HN      4.40
 44 ASP- 
         HN     44 ASP- HB2     3.40
         HN     44 ASP- HB3     3.40
         HA     45 GLY  HN      2.80
         QB     46 LYS+ HN      5.78
 45 GLY  
         HN     45 GLY  HA1     2.90
         HN     45 GLY  HA2     2.90
         HN     45 GLY  QA      2.61
         HN     46 LYS+ HN      2.50
         HA1    46 LYS+ HN      3.40
         HA2    46 LYS+ HN      3.40
         QA     69 ALA  QB      5.38
 46 LYS+ 
         HN     46 LYS+ QB      3.70
         HN     46 LYS+ HG2     3.50
         HN     46 LYS+ HG3     3.50
         HN     46 LYS+ QG      3.14
         HN     46 LYS+ QD      5.98
         HN     46 LYS+ QE      6.38
         HN     69 ALA  QB      5.20
         HA     46 LYS+ HG2     3.70
         HA     46 LYS+ HG3     3.70
         HA     46 LYS+ QG      3.44
         HA     46 LYS+ QD      4.98
         HA     46 LYS+ QE      5.88
         HA     47 GLN  HN      2.70
         QB     46 LYS+ QE      5.38
         QB     47 GLN  HN      3.90
         HG2    47 GLN  HN      5.50
         HG3    47 GLN  HN      5.50
         QG     47 GLN  HN      5.09
         QD     47 GLN  HN      6.38
 47 GLN  
         HN     47 GLN  HB2     4.10
         HN     47 GLN  HB3     2.60
         HN     47 GLN  HG2     2.80
         HN     47 GLN  HG3     3.80
         HN     68 PRO  HA      3.90
         HN     69 ALA  QB      5.70
         HA     47 GLN  HB2     2.70
         HA     47 GLN  HB3     2.70
         HA     48 GLY  HN      2.50
         HA     68 PRO  HA      2.70
         HA     69 ALA  HN      3.10
         HB2    48 GLY  HN      2.90
         HB3    47 GLN  HE21    5.50
         HG2    47 GLN  QE2     3.74
         HG3    48 GLY  HN      5.50
 48 GLY  
         HN     48 GLY  HA2     2.80
         HN     67 CYSS HN      3.40
         HN     68 PRO  HA      3.60
         HA1    49 CYSS HN      2.80
         HA2    49 CYSS HN      3.10
 49 CYSS 
         HN     49 CYSS HB2     3.40
         HN     49 CYSS HB3     3.70
         HN     86 ARG+ HE      5.50
         HN     87 VAL  HN      3.70
         HN     88 GLU- HN      3.20
         HN     88 GLU- HA      5.30
         HN     88 GLU- QB      4.58
         HA     49 CYSS HB3     2.70
         HA     50 ALA  HN      2.50
         HA     50 ALA  QB      6.50
         HA     66 CYSS HA      2.60
         HA     66 CYSS HB3     5.40
         HA     67 CYSS HN      3.20
         HB2    50 ALA  HN      3.60
         HB2    66 CYSS HA      5.50
         HB2    88 GLU- HN      5.50
         HB3    50 ALA  HN      3.00
         HB3    66 CYSS HA      4.30
         HB3    88 GLU- HN      5.30
 50 ALA  
         HN     65 MET  HN      3.40
         HN     66 CYSS HA      3.30
         HA     51 THR  HN      2.50
         HA     86 ARG+ HA      2.70
         HA     87 VAL  HN      2.90
         HA     87 VAL  QG1     6.00
         HA     87 VAL  QG2     4.70
         HA     88 GLU- HN      4.50
         QB     51 THR  HN      4.00
         QB     65 MET  HN      6.50
         QB     84 TYR  HA      6.50
         QB     84 TYR  HB2     6.10
         QB     84 TYR  HB3     5.20
         QB     84 TYR  QD      6.00
         QB     84 TYR  QE      8.50
         QB     86 ARG+ HA      5.30
         QB     87 VAL  HN      6.50
 51 THR  
         HN     51 THR  HB      2.80
         HN     86 ARG+ HA      3.60
         HN     87 VAL  QG1     4.70
         HN     87 VAL  QG2     5.30
         HA     51 THR  QG2     3.80
         HA     52 ILE  HN      2.50
         HA     64 THR  HA      2.70
         HA     65 MET  HN      3.20
         HB     52 ILE  HN      5.00
         HB     53 TRP  HE3     5.50
         HB     53 TRP  HH2     3.40
         QG2    52 ILE  HN      4.50
         QG2    52 ILE  HB      6.50
         QG2    53 TRP  HA      6.50
         QG2    53 TRP  HD1     6.50
         QG2    53 TRP  HE3     6.50
         QG2    53 TRP  HE1     6.50
         QG2    53 TRP  HZ3     6.00
         QG2    53 TRP  HZ2     4.70
         QG2    53 TRP  HH2     5.30
         QG2    62 SER  HA      6.50
         QG2    62 SER  HB2     4.10
         QG2    62 SER  HB3     5.40
         QG2    63 THR  HN      5.60
         QG2    64 THR  HA      6.50
         QG2    65 MET  HN      6.50
 52 ILE  
         HN     52 ILE  HB      2.70
         HN     52 ILE  QG1     6.50
         HN     52 ILE  QD1     6.50
         HN     63 THR  HN      3.30
         HN     64 THR  HA      3.70
         HA     52 ILE  HB      3.00
         HA     52 ILE  QG2     3.60
         HA     53 TRP  HN      2.50
         HA     53 TRP  HE3     4.30
         HA     84 TYR  HA      2.70
         HA     85 ARG+ HN      3.50
         HB     53 TRP  HN      4.10
         HB     62 SER  HA      5.50
         HB     65 MET  HN      5.50
         HB     84 TYR  HA      5.50
         QG2    53 TRP  HN      4.70
         QG2    53 TRP  HE3     6.50
         QG2    62 SER  HA      6.50
         QG2    65 MET  HN      6.50
         QG2    84 TYR  HA      6.50
         QG2    84 TYR  HB2     6.40
         QG2    84 TYR  HB3     6.50
         QG1    53 TRP  HN      6.50
         QG1    53 TRP  HE3     6.50
         QG1    84 TYR  HA      6.50
         QG1    84 TYR  HB2     4.70
         QG1    84 TYR  HB3     5.10
         QD1    65 MET  HN      6.50
         QD1    84 TYR  HA      6.50
         QD1    84 TYR  HB2     6.50
         QD1    84 TYR  HB3     6.50
 53 TRP  
         HN     53 TRP  QB      3.70
         HN     53 TRP  HE3     3.20
         HN     53 TRP  HZ3     5.50
         HN     54 GLU- HN      4.90
         HN     81 ILE  HB      5.50
         HN     82 ARG+ HN      4.90
         HN     83 SER  HN      3.50
         HN     83 SER  HG      5.50
         HN     84 TYR  HA      3.40
         HN     84 TYR  HB2     5.50
         HN     84 TYR  HB3     5.50
         HA     53 TRP  HD1     4.70
         HA     53 TRP  HE3     5.50
         HA     54 GLU- HN      2.50
         HA     54 GLU- HB2     4.70
         HA     54 GLU- HB3     4.60
         HA     62 SER  HA      2.60
         HA     62 SER  HB2     4.50
         HA     62 SER  HB3     4.30
         HA     63 THR  HN      3.70
         HA     79 PHE  QD      7.40
         HA     79 PHE  QE      7.50
         QB     54 GLU- HN      4.50
         QB     55 GLY  HN      4.10
         QB     59 VAL  HN      5.70
         QB     83 SER  HN      6.50
         HD1    54 GLU- HN      5.50
         HD1    55 GLY  HN      4.80
         HD1    58 CYSS HA      4.40
         HD1    58 CYSS HB2     5.50
         HD1    59 VAL  HN      5.40
         HD1    59 VAL  HA      3.60
         HD1    59 VAL  HB      5.50
         HD1    60 GLY  HN      4.10
         HD1    60 GLY  HA1     5.50
         HD1    60 GLY  HA2     5.50
         HD1    61 ARG+ HA      5.50
         HD1    62 SER  HA      5.50
         HD1    62 SER  HB2     4.40
         HD1    62 SER  HB3     3.40
         HE3    58 CYSS HB2     5.50
         HE3    84 TYR  HA      2.60
         HE3    84 TYR  HB2     5.50
         HE3    84 TYR  HB3     4.70
         HE3    85 ARG+ HN      4.90
         HE3    85 ARG+ QB      6.38
         HE1    58 CYSS HA      5.50
         HE1    58 CYSS HB2     5.50
         HE1    59 VAL  HN      5.50
         HE1    59 VAL  HA      4.50
         HE1    60 GLY  HN      5.50
         HE1    62 SER  HA      5.50
         HE1    62 SER  HB2     5.50
         HE1    62 SER  HB3     4.80
         HZ3    58 CYSS HB2     5.50
         HZ3    84 TYR  HA      3.50
         HZ3    85 ARG+ HN      3.40
         HZ3    85 ARG+ HB2     3.40
         HZ3    85 ARG+ HB3     3.40
         HZ3    85 ARG+ QB      3.13
         HZ3    85 ARG+ QG      6.38
         HZ2    58 CYSS HB2     5.50
         HH2    58 CYSS HB2     5.50
         HH2    85 ARG+ QB      4.58
 54 GLU- 
         HN     54 GLU- HB2     3.90
         HN     54 GLU- HB3     3.20
         HN     54 GLU- HG2     5.50
         HN     54 GLU- HG3     5.50
         HN     55 GLY  HN      3.30
         HN     61 ARG+ HN      3.30
         HN     61 ARG+ QB      6.50
         HN     62 SER  HA      3.50
         HN     62 SER  HB2     5.50
         HN     79 PHE  QD      7.00
         HA     54 GLU- HG2     4.00
         HA     54 GLU- HG3     4.00
         HA     54 GLU- QG      3.61
         HA     79 PHE  QD      5.50
         HA     82 ARG+ HN      3.30
         HA     83 SER  HN      4.30
         HB2    54 GLU- QG      2.70
         HB2    55 GLY  HN      3.90
         HB2    79 PHE  QD      5.80
         HB3    55 GLY  HN      3.30
         HB3    61 ARG+ HN      3.80
         HB3    79 PHE  QD      7.20
         HG2    79 PHE  QD      7.50
         HG3    79 PHE  QD      7.50
         QG     55 GLY  HN      6.38
         QG     61 ARG+ HN      6.38
         QG     79 PHE  QD      6.87
         QG     80 TYR  HN      5.88
 55 GLY  
         HN     55 GLY  HA1     2.90
         HN     55 GLY  HA2     2.90
         HN     55 GLY  QA      2.66
         HN     59 VAL  HN      3.80
         HA1    56 SER  HN      3.00
         HA1    59 VAL  HN      4.30
         HA2    56 SER  HN      3.00
         HA2    59 VAL  HN      4.30
         QA     56 SER  HN      2.72
 56 SER  
         HN     56 SER  QB      3.80
         HN     57 GLY  HN      4.30
         HN     82 ARG+ QB      6.50
         HN     82 ARG+ QD      6.38
         HA     57 GLY  HN      2.60
         HA     82 ARG+ QB      5.80
         HA     82 ARG+ QG      4.48
         HA     83 SER  HG      3.10
         QB     57 GLY  HN      4.30
 57 GLY  
         HN     57 GLY  HA1     2.80
         HN     57 GLY  HA2     2.80
         HN     58 CYSS HN      3.30
         HN     59 VAL  HN      5.30
         HN     59 VAL  QQG     7.90
         HN     83 SER  HA      5.30
         HN     83 SER  HB3     4.60
 58 CYSS 
         HN     58 CYSS HA      2.60
         HN     58 CYSS HB2     4.10
         HN     58 CYSS HB3     3.70
         HN     59 VAL  HN      3.00
         HN     83 SER  HG      3.20
         HA     58 CYSS HB2     2.80
         HA     58 CYSS HB3     2.80
         HA     59 VAL  HN      2.90
         HB2    59 VAL  HN      4.50
         HB3    59 VAL  HN      5.00
 59 VAL  
         HN     59 VAL  HB      3.60
         HN     83 SER  HG      5.20
         HA     59 VAL  HB      2.60
         HA     60 GLY  HN      2.50
         HB     60 GLY  HN      2.50
         QQG    60 GLY  HN      6.60
 60 GLY  
         HN     60 GLY  HA1     2.90
         HN     60 GLY  HA2     2.90
         HN     60 GLY  QA      2.61
         HA1    61 ARG+ HN      2.90
         HA2    61 ARG+ HN      2.90
 61 ARG+ 
         HN     61 ARG+ QB      3.70
         HN     61 ARG+ QG      5.58
         HN     61 ARG+ HD2     5.50
         HN     61 ARG+ HD3     5.50
         HN     79 PHE  QD      7.50
         HA     61 ARG+ HG2     3.50
         HA     61 ARG+ HG3     3.50
         HA     61 ARG+ HD2     5.50
         HA     61 ARG+ HD3     5.50
         HA     61 ARG+ HE      5.50
         HA     62 SER  HN      2.50
         HA     62 SER  HA      4.20
         QB     61 ARG+ HE      5.60
         QB     62 SER  HA      6.50
         QB     79 PHE  QD      8.50
         HG2    62 SER  HN      4.40
         HG3    62 SER  HN      4.40
         QG     62 SER  HA      6.38
         QG     79 PHE  QD      7.98
 62 SER  
         HN     62 SER  HB2     4.20
         HN     62 SER  HB3     3.70
         HA     62 SER  HB2     2.80
         HA     62 SER  HB3     2.90
         HA     63 THR  HN      2.50
         HA     79 PHE  QD      7.50
         HA     79 PHE  QE      6.20
         HB2    63 THR  HN      2.90
         HB3    63 THR  HN      3.50
 63 THR  
         HN     63 THR  HB      3.80
         HN     63 THR  QG2     4.40
         HN     77 THR  QG2     6.50
         HN     79 PHE  QD      7.50
         HN     79 PHE  QE      6.40
         HA     63 THR  HB      2.80
         HA     64 THR  HN      3.00
         HB     79 PHE  QD      7.00
         HB     79 PHE  QE      7.50
 64 THR  
         HN     64 THR  HB      3.50
         HA     65 MET  HN      2.60
         HB     65 MET  HN      4.60
         QG2    65 MET  HN      4.90
 65 MET  
         HN     65 MET  HB2     3.30
         HN     65 MET  HB3     3.30
         HN     65 MET  QB      3.08
         HN     65 MET  HG2     5.20
         HN     65 MET  HG3     5.20
         HN     65 MET  QG      4.98
         HA     66 CYSS HN      2.50
         HB2    66 CYSS HN      4.90
         HB3    66 CYSS HN      4.90
         HG2    66 CYSS HN      5.00
         HG3    66 CYSS HN      5.00
 66 CYSS 
         HN     66 CYSS HB2     3.20
         HN     66 CYSS HB3     4.10
         HA     66 CYSS HB3     2.80
         HA     67 CYSS HN      2.50
         HB2    67 CYSS HN      4.00
         HB3    67 CYSS HN      3.10
 67 CYSS 
         HN     67 CYSS HB2     3.00
         HN     67 CYSS HB3     3.10
         HA     67 CYSS HB2     2.80
         HA     68 PRO  HD2     2.70
         HA     68 PRO  HD3     2.40
         HA     71 THR  QG2     6.50
 68 PRO  
         HA     69 ALA  HN      2.40
         HA     69 ALA  QB      5.40
         HB3    69 ALA  HN      3.10
         HD2    71 THR  QG2     4.10
         HD3    71 THR  QG2     5.10
 69 ALA  
         HN     69 ALA  QB      3.40
         HA     70 ASN  HN      2.50
         QB     70 ASN  HD21    6.30
         QB     70 ASN  HD22    6.30
         QB     70 ASN  QD2     6.09
 70 ASN  
         HN     70 ASN  QB      3.91
         HN     71 THR  HN      3.20
         HA     70 ASN  HB2     3.00
         HA     70 ASN  HB3     3.00
         HA     71 THR  HN      3.10
 71 THR  
         HN     71 THR  HB      3.20
         QG2    72 CYSS HN      4.60
         QG2    72 CYSS HA      6.50
         QG2    73 CYSS HN      6.50
 72 CYSS 
         HN     72 CYSS HB2     3.20
         HN     72 CYSS HB3     3.10
         HA     72 CYSS HB2     2.80
         HA     73 CYSS HN      2.40
         HB2    73 CYSS HN      4.20
         HB3    73 CYSS HN      4.40
 73 CYSS 
         HN     73 CYSS HB2     3.00
         HN     73 CYSS HB3     3.60
         HA     73 CYSS HB2     3.00
         HA     73 CYSS HB3     2.70
         HA     74 ASN  HN      2.50
         HA     75 ILE  QD1     5.50
 74 ASN  
         HN     74 ASN  QB      3.60
         HA     75 ILE  HN      2.50
         HA     75 ILE  HB      4.30
         HA     75 ILE  QG1     6.38
         QD2    75 ILE  HN      6.50
 75 ILE  
         HN     75 ILE  HB      2.80
         HN     75 ILE  HG12    4.70
         HN     75 ILE  HG13    4.70
         HN     75 ILE  QG1     3.88
         HN     75 ILE  QD1     6.10
         HA     75 ILE  QG2     3.40
         HA     75 ILE  HG12    3.90
         HA     75 ILE  HG13    3.90
         HA     75 ILE  QG1     3.50
         HA     76 ASN  HN      2.60
         HB     75 ILE  QG1     2.59
         QG2    76 ASN  HN      6.00
 76 ASN  
         HA     76 ASN  HD21    5.50
         HA     77 THR  HN      2.40
 77 THR  
         HN     77 THR  QG2     4.30
         HA     77 THR  HB      2.80
         HA     78 GLY  HN      3.30
         HA     79 PHE  HN      5.00
         HB     78 GLY  HN      4.70
         HB     79 PHE  HN      3.60
         HB     79 PHE  QD      5.70
         HB     79 PHE  QE      7.50
         QG2    78 GLY  HN      6.50
         QG2    79 PHE  HN      6.50
         QG2    79 PHE  QD      7.80
         QG2    79 PHE  QE      8.50
 78 GLY  
         HN     79 PHE  HN      2.90
         QA     79 PHE  QD      8.38
 79 PHE  
         HN     79 PHE  HB2     3.60
         HN     79 PHE  HB3     3.60
         HA     79 PHE  HB2     2.70
         HA     79 PHE  HB3     2.70
         HA     80 TYR  HN      2.70
         HA     80 TYR  HA      4.10
         HB2    80 TYR  HN      2.80
         HB3    80 TYR  HN      3.50
         QD     80 TYR  HA      7.50
         QD     81 ILE  HA      6.00
         QD     81 ILE  HB      7.50
         QD     81 ILE  QD1     6.40
         QD     82 ARG+ HN      7.50
         QE     81 ILE  QD1     8.50
 80 TYR  
         HN     80 TYR  HB2     2.70
         HN     80 TYR  HB3     2.80
         HA     80 TYR  HB2     2.90
         HA     81 ILE  HN      2.50
         HB2    81 ILE  HN      4.10
         HB3    81 ILE  HN      4.10
         QD     82 ARG+ HA      7.50
 81 ILE  
         HN     81 ILE  HB      3.60
         HN     81 ILE  HG12    3.30
         HN     81 ILE  HG13    3.30
         HN     81 ILE  QG1     2.84
         HN     81 ILE  QD1     3.90
         HN     82 ARG+ HN      5.50
         HA     81 ILE  HB      2.70
         HA     81 ILE  QD1     4.10
         HA     82 ARG+ HN      2.70
         HB     81 ILE  HG12    2.90
         HB     81 ILE  HG13    2.90
         HB     81 ILE  QG1     2.51
         HB     82 ARG+ HN      3.20
 82 ARG+ 
         HN     82 ARG+ QB      3.80
         HN     82 ARG+ HG2     5.10
         HN     82 ARG+ HG3     5.10
         HN     82 ARG+ QG      4.78
         HN     82 ARG+ QD      6.38
         HN     83 SER  HN      2.70
         HA     82 ARG+ HG2     3.70
         HA     82 ARG+ HG3     3.70
         HA     82 ARG+ QG      3.03
         HA     82 ARG+ QD      5.68
         HA     83 SER  HN      3.60
         QB     82 ARG+ HE      5.40
         QB     83 SER  HN      4.20
         HG2    82 ARG+ HE      4.20
         HG3    82 ARG+ HE      4.20
         QG     82 ARG+ HE      3.91
         QG     83 SER  HN      4.88
         QD     83 SER  HN      5.98
 83 SER  
         HN     83 SER  HG      4.60
         HA     83 SER  HB2     2.90
         HA     83 SER  HB3     2.70
         HA     83 SER  HG      4.00
         HA     84 TYR  HN      2.80
         HA     84 TYR  QD      7.50
         HB2    84 TYR  HN      3.20
         HB3    84 TYR  HN      4.10
 84 TYR  
         HN     84 TYR  HB2     4.00
         HN     84 TYR  QE      6.50
         HA     84 TYR  HB2     2.70
         HA     84 TYR  HB3     2.70
         HA     85 ARG+ HN      2.70
         HA     85 ARG+ QB      5.48
         HB2    85 ARG+ HN      3.30
         HB3    85 ARG+ HN      4.00
         QD     85 ARG+ HN      6.70
         QE     85 ARG+ HN      7.50
 85 ARG+ 
         HN     85 ARG+ HB2     3.40
         HN     85 ARG+ HB3     3.40
         HN     85 ARG+ QG      5.28
         HN     85 ARG+ QD      4.68
         HA     86 ARG+ HN      2.60
         QB     85 ARG+ HE      4.28
         QB     86 ARG+ HN      4.38
 86 ARG+ 
         HN     86 ARG+ QB      3.50
         HA     87 VAL  HN      2.50
 87 VAL  
         HN     87 VAL  QG2     3.70
         HA     87 VAL  HB      2.70
         QG1    88 GLU- HN      6.50
         QG2    88 GLU- HN      5.00
 88 GLU- 
         HN     88 GLU- QB      3.63
         HN     88 GLU- HG2     5.50
         HN     88 GLU- HG3     5.50
  8 CYSS SG     18 CYSS SG      2.10
  8 CYSS SG     18 CYSS CB      3.10
  8 CYSS CB     18 CYSS SG      3.10
 11 CYSS SG     72 CYSS SG      2.10
 11 CYSS SG     72 CYSS CB      3.10
 11 CYSS CB     72 CYSS SG      3.10
 27 CYSS SG     58 CYSS SG      2.10
 27 CYSS SG     58 CYSS CB      3.10
 27 CYSS CB     58 CYSS SG      3.10
 49 CYSS SG     66 CYSS SG      2.10
 49 CYSS SG     66 CYSS CB      3.10
 49 CYSS CB     66 CYSS SG      3.10
 67 CYSS SG     73 CYSS SG      2.10
 67 CYSS SG     73 CYSS CB      3.10
 67 CYSS CB     73 CYSS SG      3.10


Lower limits for distances:

  8 CYSS SG     18 CYSS SG      2.00
  8 CYSS SG     18 CYSS CB      3.00
  8 CYSS CB     18 CYSS SG      3.00
 11 CYSS SG     72 CYSS SG      2.00
 11 CYSS SG     72 CYSS CB      3.00
 11 CYSS CB     72 CYSS SG      3.00
 27 CYSS SG     58 CYSS SG      2.00
 27 CYSS SG     58 CYSS CB      3.00
 27 CYSS CB     58 CYSS SG      3.00
 49 CYSS SG     66 CYSS SG      2.00
 49 CYSS SG     66 CYSS CB      3.00
 49 CYSS CB     66 CYSS SG      3.00
 67 CYSS SG     73 CYSS SG      2.00
 67 CYSS SG     73 CYSS CB      3.00
 67 CYSS CB     73 CYSS SG      3.00


Dihedral angle constraints:

   2 ASP-  PHI      65.0   295.0
   2 ASP-  PSI    -105.0   125.0
   2 ASP-  CHI1   -115.0   165.0
   4 TYR   PHI      55.0   275.0
   4 TYR   PSI     145.0   185.0
   4 TYR   CHI1     -5.0    45.0
   5 LEU   PHI      35.0   295.0
   5 LEU   PSI      55.0   175.0
   6 ILE   PHI    -155.0   -85.0
   6 ILE   PSI      55.0   185.0
   6 ILE   CHI1     -5.0   245.0
   7 MET   PHI    -145.0   -35.0
   7 MET   PSI     115.0   175.0
   7 MET   CHI1     -5.0    95.0
   8 CYSS  PHI    -155.0   -85.0
   8 CYSS  PSI     135.0   185.0
   8 CYSS  CHI1    -95.0    95.0
   9 LYS+  PHI     -85.0   -45.0
   9 LYS+  PSI     -95.0     5.0
   9 LYS+  CHI1    -95.0    95.0
  10 ASN   PHI      35.0   305.0
  10 ASN   PSI     155.0   225.0
  10 ASN   CHI1     -5.0    95.0
  11 CYSS  PHI    -165.0   -65.0
  11 CYSS  PSI       5.0   225.0
  11 CYSS  CHI1    145.0   205.0
  12 ASP-  PHI    -145.0   -65.0
  12 ASP-  PSI    -105.0   225.0
  12 ASP-  CHI1    135.0   235.0
  14 ASN   PHI    -145.0   -65.0
  14 ASN   PSI    -145.0    -5.0
  14 ASN   CHI1    135.0   225.0
  15 THR   PHI    -155.0  -105.0
  15 THR   PSI      15.0    45.0
  17 SER   PHI      45.0   295.0
  17 SER   PSI      95.0   185.0
  18 CYSS  PHI    -135.0   -65.0
  18 CYSS  PSI     135.0   185.0
  18 CYSS  CHI1    -95.0    95.0
  19 ASP-  PHI     -95.0    55.0
  19 ASP-  PSI      95.0   225.0
  19 ASP-  CHI1     15.0   135.0
  20 TRP   PHI      35.0   275.0
  20 TRP   PSI      35.0    85.0
  20 TRP   CHI1   -215.0    15.0
  21 LYS+  PHI    -165.0    55.0
  21 LYS+  PSI      55.0   185.0
  21 LYS+  CHI1    105.0   255.0
  22 GLN   PHI    -145.0   -65.0
  22 GLN   PSI     145.0   175.0
  22 GLN   CHI1    145.0   225.0
  23 ASN   PHI    -145.0   -95.0
  23 ASN   PSI     -45.0    55.0
  23 ASN   CHI1   -165.0   165.0
  24 TRP   PHI    -155.0    45.0
  24 TRP   PSI      35.0   195.0
  24 TRP   CHI1    105.0   265.0
  25 ASN   PHI      35.0   325.0
  25 ASN   PSI    -105.0   115.0
  25 ASN   CHI1   -215.0    15.0
  26 THR   PHI      45.0   285.0
  26 THR   PSI     105.0   185.0
  26 THR   CHI1    -15.0   255.0
  27 CYSS  PHI    -165.0    45.0
  27 CYSS  PSI      55.0   175.0
  27 CYSS  CHI1    145.0   215.0
  28 VAL   PHI    -155.0   -85.0
  28 VAL   PSI      65.0   165.0
  28 VAL   CHI1    135.0   225.0
  30 ILE   PHI    -155.0   -85.0
  30 ILE   PSI      65.0   165.0
  30 ILE   CHI1   -105.0   -15.0
  32 ALA   PHI      35.0    95.0
  32 ALA   PSI      65.0   125.0
  33 ASN   PHI      35.0    95.0
  33 ASN   PSI       5.0    85.0
  33 ASN   CHI1   -165.0   165.0
  34 VAL   PHI    -135.0   -75.0
  34 VAL   PSI      45.0   185.0
  34 VAL   CHI1    135.0   195.0
  35 HIS   PHI    -145.0   -95.0
  35 HIS   PSI      -5.0    45.0
  35 HIS   CHI1   -165.0    95.0
  36 TRP   PHI    -145.0   -95.0
  36 TRP   PSI     115.0   175.0
  36 TRP   CHI1    -95.0    95.0
  37 MET   PHI    -155.0   -85.0
  37 MET   PSI     115.0   175.0
  37 MET   CHI1    145.0   215.0
  38 VAL   PHI    -155.0   -85.0
  38 VAL   PSI      55.0   175.0
  38 VAL   CHI1    135.0   225.0
  39 THR   PHI    -145.0   -95.0
  39 THR   PSI      45.0   185.0
  39 THR   CHI1     -5.0   245.0
  42 SER   PHI    -175.0    65.0
  42 SER   PSI    -265.0    15.0
  42 SER   CHI1   -275.0    35.0
  43 THR   PHI      45.0   285.0
  43 THR   PSI     -95.0    85.0
  43 THR   CHI1     -5.0   245.0
  44 ASP-  PHI    -185.0    65.0
  44 ASP-  PSI      35.0   195.0
  44 ASP-  CHI1   -285.0    35.0
  46 LYS+  PHI      35.0   295.0
  46 LYS+  PSI      45.0   185.0
  47 GLN   PHI     -85.0   -45.0
  47 GLN   PSI     145.0   175.0
  47 GLN   CHI1     45.0   115.0
  49 CYSS  PHI    -145.0   -75.0
  49 CYSS  PSI     145.0   175.0
  49 CYSS  CHI1    -75.0    -5.0
  50 ALA   PHI      35.0   285.0
  50 ALA   PSI      55.0   175.0
  51 THR   PHI    -155.0   -85.0
  51 THR   PSI      55.0   175.0
  51 THR   CHI1   -105.0   -25.0
  52 ILE   PHI    -155.0   -55.0
  52 ILE   PSI     115.0   175.0
  52 ILE   CHI1   -105.0   -35.0
  53 TRP   PHI      45.0   285.0
  53 TRP   PSI      55.0   175.0
  54 GLU-  PHI     165.0   315.0
  54 GLU-  PSI    -105.0   -35.0
  54 GLU-  CHI1   -215.0     5.0
  56 SER   PHI      35.0   315.0
  56 SER   PSI      55.0   185.0
  58 CYSS  PHI      35.0   175.0
  58 CYSS  PSI      25.0    95.0
  58 CYSS  CHI1     -5.0   135.0
  59 VAL   PHI    -125.0   -95.0
  59 VAL   PSI     155.0   175.0
  59 VAL   CHI1    -75.0   -35.0
  61 ARG+  PHI      35.0   315.0
  61 ARG+  PSI      55.0   175.0
  62 SER   PHI      55.0   275.0
  62 SER   PSI     145.0   175.0
  62 SER   CHI1    -25.0    45.0
  63 THR   PHI      45.0   285.0
  63 THR   PSI      15.0   215.0
  63 THR   CHI1     -5.0   245.0
  64 THR   PHI      35.0   325.0
  64 THR   PSI      55.0   185.0
  65 MET   PHI    -155.0   -85.0
  65 MET   PSI      55.0   175.0
  65 MET   CHI1    145.0   215.0
  66 CYSS  PHI    -155.0   -85.0
  66 CYSS  PSI     135.0   175.0
  66 CYSS  CHI1    -95.0    95.0
  67 CYSS  PHI    -155.0   -75.0
  67 CYSS  PSI    -105.0   225.0
  67 CYSS  CHI1    145.0   215.0
  69 ALA   PHI      45.0   285.0
  69 ALA   PSI      55.0   175.0
  70 ASN   PHI      35.0   275.0
  70 ASN   PSI      15.0   105.0
  70 ASN   CHI1   -165.0   135.0
  71 THR   PHI    -155.0   -85.0
  71 THR   PSI    -105.0   225.0
  71 THR   CHI1   -225.0    15.0
  72 CYSS  PHI    -165.0   -75.0
  72 CYSS  PSI     115.0   165.0
  72 CYSS  CHI1    145.0   215.0
  73 CYSS  PHI    -155.0   -85.0
  73 CYSS  PSI      55.0   175.0
  73 CYSS  CHI1   -165.0    95.0
  74 ASN   PHI      35.0   325.0
  74 ASN   PSI      55.0   175.0
  75 ILE   PHI    -165.0   -75.0
  75 ILE   PSI      55.0   185.0
  75 ILE   CHI1   -105.0   -25.0
  76 ASN   PHI      35.0   325.0
  76 ASN   PSI      65.0   165.0
  76 ASN   CHI1   -215.0    15.0
  77 THR   PHI      45.0   285.0
  77 THR   PSI      -5.0   225.0
  77 THR   CHI1     -5.0   245.0
  79 PHE   PHI    -145.0   -75.0
  79 PHE   PSI     155.0   185.0
  79 PHE   CHI1     15.0    55.0
  80 TYR   PHI     -85.0   -45.0
  80 TYR   PSI     135.0   175.0
  80 TYR   CHI1    155.0   215.0
  81 ILE   PHI    -155.0    75.0
  81 ILE   PSI     125.0   185.0
  81 ILE   CHI1     15.0   145.0
  82 ARG+  PHI    -135.0  -105.0
  82 ARG+  PSI     -85.0    45.0
  83 SER   PHI      45.0   295.0
  83 SER   PSI     125.0   195.0
  83 SER   CHI1   -145.0   115.0
  84 TYR   PHI      45.0   295.0
  84 TYR   PSI     125.0   185.0
  84 TYR   CHI1     15.0   115.0
  85 ARG+  PHI      45.0   285.0
  85 ARG+  PSI     125.0   185.0
  85 ARG+  CHI1   -215.0    15.0
  86 ARG+  PHI    -175.0    55.0
  86 ARG+  PSI      55.0   175.0
  86 ARG+  CHI1     25.0   345.0
  87 VAL   PHI    -155.0   -85.0
  87 VAL   PSI    -105.0   225.0
  87 VAL   CHI1   -105.0   115.0
  88 GLU-  PHI      35.0   295.0
  88 GLU-  PSI    -105.0   225.0
  88 GLU-  CHI1      5.0   235.0


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1HA   GLY   1          1HA       GLY   1  12.040  -0.016 -14.041
    2   2HA   GLY   1          2HA       GLY   1  13.770   0.402 -14.091
    3    QA   GLY   1           QA       GLY   1  12.905   0.193 -14.066
    4    H    ASP   2           H        ASP   2  13.523  -1.778 -12.759
    5    HA   ASP   2           HA       ASP   2  13.929  -2.844 -10.916
    6   1HB   ASP   2          1HB       ASP   2  14.393  -0.171  -9.580
    7   2HB   ASP   2          2HB       ASP   2  14.428  -1.709  -8.730
    8    QB   ASP   2           QB       ASP   2  14.410  -0.940  -9.155
    9    H    GLY   3           H        GLY   3  12.615  -4.068  -9.915
   10   1HA   GLY   3          1HA       GLY   3   9.960  -3.539  -9.189
   11   2HA   GLY   3          2HA       GLY   3  11.052  -4.747  -8.429
   12    QA   GLY   3           QA       GLY   3  10.506  -4.143  -8.809
   13    H    TYR   4           H        TYR   4   8.975  -3.213  -7.203
   14    HA   TYR   4           HA       TYR   4  10.134  -2.950  -4.750
   15   1HB   TYR   4          1HB       TYR   4   9.731  -0.440  -4.347
   16   2HB   TYR   4          2HB       TYR   4  11.185  -0.977  -5.124
   17    HD1  TYR   4          1HD       TYR   4   7.730   0.321  -5.977
   18    HD2  TYR   4          2HD       TYR   4  11.841  -0.012  -7.251
   19    HE1  TYR   4          1HE       TYR   4   7.272   1.790  -7.891
   20    HE2  TYR   4          2HE       TYR   4  11.375   1.485  -9.134
   21    HH   TYR   4           HH       TYR   4   9.671   2.317 -10.481
   22    QB   TYR   4           QB       TYR   4  10.458  -0.708  -4.735
   23    QG   TYR   4           QD       TYR   4   9.786   0.155  -6.614
   24    QZ   TYR   4           QE       TYR   4   9.324   1.637  -8.512
   25    QR   TYR   4           QR       TYR   4   9.555   0.896  -7.563
   26    H    LEU   5           H        LEU   5   8.611  -2.258  -3.165
   27    HA   LEU   5           HA       LEU   5   5.802  -1.867  -4.099
   28   1HB   LEU   5          1HB       LEU   5   6.253  -4.342  -3.489
   29   2HB   LEU   5          2HB       LEU   5   6.404  -3.782  -1.820
   30    HG   LEU   5           HG       LEU   5   4.084  -2.520  -2.547
   31   1HD1  LEU   5          1HD1      LEU   5   4.318  -3.612  -4.843
   32   2HD1  LEU   5          2HD1      LEU   5   3.941  -5.150  -4.067
   33   3HD1  LEU   5          3HD1      LEU   5   2.752  -3.832  -4.025
   34   1HD2  LEU   5          2HD2      LEU   5   4.190  -5.425  -1.654
   35   2HD2  LEU   5          3HD2      LEU   5   4.258  -4.000  -0.589
   36   3HD2  LEU   5          1HD2      LEU   5   2.796  -4.328  -1.540
   37    QB   LEU   5           QB       LEU   5   6.329  -4.062  -2.654
   38    QD1  LEU   5           QD1      LEU   5   3.670  -4.198  -4.312
   39    QD2  LEU   5           QD2      LEU   5   3.748  -4.584  -1.261
   40    QQD  LEU   5           QQD      LEU   5   3.709  -4.391  -2.786
   41    H    ILE   6           H        ILE   6   7.008   0.250  -3.578
   42    HA   ILE   6           HA       ILE   6   6.915   0.946  -0.675
   43    HB   ILE   6           HB       ILE   6   7.883   3.118  -1.548
   44   1HG1  ILE   6          1HG1      ILE   6   8.778   1.654  -4.014
   45   2HG1  ILE   6          2HG1      ILE   6   7.203   2.461  -4.040
   46   1HG2  ILE   6          3HG2      ILE   6   9.098   1.146  -0.489
   47   2HG2  ILE   6          1HG2      ILE   6   9.694   0.741  -2.099
   48   3HG2  ILE   6          2HG2      ILE   6  10.046   2.336  -1.392
   49   1HD1  ILE   6          3HD1      ILE   6   9.625   3.963  -3.062
   50   2HD1  ILE   6          1HD1      ILE   6   9.301   3.800  -4.799
   51   3HD1  ILE   6          2HD1      ILE   6   8.108   4.576  -3.737
   52    QG1  ILE   6           QG1      ILE   6   7.991   2.058  -4.027
   53    QG2  ILE   6           QG2      ILE   6   9.613   1.408  -1.327
   54    QD1  ILE   6           QD1      ILE   6   9.011   4.113  -3.866
   55    H    MET   7           H        MET   7   6.063   3.285  -0.286
   56    HA   MET   7           HA       MET   7   3.887   4.018  -2.062
   57   1HB   MET   7          1HB       MET   7   2.371   4.149  -0.304
   58   2HB   MET   7          2HB       MET   7   3.132   2.553  -0.159
   59   1HG   MET   7          1HG       MET   7   4.620   3.550   1.612
   60   2HG   MET   7          2HG       MET   7   3.544   4.951   1.615
   61   1HE   MET   7          3HE       MET   7   0.755   4.506   1.976
   62   2HE   MET   7          1HE       MET   7   0.742   3.042   0.974
   63   3HE   MET   7          2HE       MET   7   0.153   2.975   2.644
   64    QB   MET   7           QB       MET   7   2.751   3.351  -0.231
   65    QG   MET   7           QG       MET   7   4.082   4.250   1.613
   66    QE   MET   7           QE       MET   7   0.550   3.508   1.864
   67    H    CYS   8           H        CYS   8   3.136   6.249  -1.364
   68    HA   CYS   8           HA       CYS   8   5.476   7.959  -0.824
   69   1HB   CYS   8          1HB       CYS   8   3.814   7.886  -3.342
   70   2HB   CYS   8          2HB       CYS   8   5.142   8.973  -3.039
   71    QB   CYS   8           QB       CYS   8   4.478   8.430  -3.191
   72    H    LYS   9           H        LYS   9   5.030  10.132  -0.946
   73    HA   LYS   9           HA       LYS   9   2.547  10.851   0.390
   74   1HB   LYS   9          1HB       LYS   9   4.911  12.573  -0.377
   75   2HB   LYS   9          2HB       LYS   9   3.673  12.927   0.840
   76   1HG   LYS   9          1HG       LYS   9   4.554  11.351   2.396
   77   2HG   LYS   9          2HG       LYS   9   5.474  10.475   1.180
   78   1HD   LYS   9          1HD       LYS   9   7.115  11.675   2.254
   79   2HD   LYS   9          2HD       LYS   9   6.852  12.540   0.747
   80   1HE   LYS   9          1HE       LYS   9   6.872  14.325   2.246
   81   2HE   LYS   9          2HE       LYS   9   5.138  13.982   2.246
   82   1HZ   LYS   9          2HZ       LYS   9   5.786  12.435   4.205
   83   2HZ   LYS   9          3HZ       LYS   9   7.177  13.262   4.205
   84   3HZ   LYS   9          1HZ       LYS   9   5.740  14.048   4.500
   85    QB   LYS   9           QB       LYS   9   4.292  12.750   0.232
   86    QG   LYS   9           QG       LYS   9   5.014  10.913   1.788
   87    QD   LYS   9           QD       LYS   9   6.983  12.107   1.501
   88    QE   LYS   9           QE       LYS   9   6.005  14.153   2.246
   89    QZ   LYS   9           QZ       LYS   9   6.235  13.248   4.304
   90    H    ASN  10           H        ASN  10   4.054  11.097  -2.759
   91    HA   ASN  10           HA       ASN  10   1.737  12.624  -3.829
   92   1HB   ASN  10          1HB       ASN  10   3.226  13.829  -5.286
   93   2HB   ASN  10          2HB       ASN  10   3.810  14.045  -3.643
   94   1HD2  ASN  10          2HD2      ASN  10   6.739  13.203  -5.841
   95   2HD2  ASN  10          1HD2      ASN  10   5.727  14.600  -5.423
   96    QB   ASN  10           QB       ASN  10   3.518  13.937  -4.465
   97    QD2  ASN  10           QD2      ASN  10   6.233  13.902  -5.632
   98    H    CYS  11           H        CYS  11   2.469  12.316  -6.466
   99    HA   CYS  11           HA       CYS  11   2.081   9.387  -6.820
  100   1HB   CYS  11          1HB       CYS  11   0.580  11.062  -7.823
  101   2HB   CYS  11          2HB       CYS  11   1.935  11.759  -8.722
  102    QB   CYS  11           QB       CYS  11   1.258  11.411  -8.272
  103    H    ASP  12           H        ASP  12   4.763  11.241  -6.587
  104    HA   ASP  12           HA       ASP  12   6.230   9.945  -8.800
  105   1HB   ASP  12          1HB       ASP  12   5.483  12.155  -9.438
  106   2HB   ASP  12          2HB       ASP  12   6.217  12.860  -7.991
  107    QB   ASP  12           QB       ASP  12   5.850  12.507  -8.715
  108    HA   PRO  13           HA       PRO  13   8.984   9.411  -5.158
  109   1HB   PRO  13          1HB       PRO  13  10.817   7.746  -6.423
  110   2HB   PRO  13          2HB       PRO  13   9.325   7.159  -5.656
  111   1HG   PRO  13          1HG       PRO  13   9.814   7.743  -8.553
  112   2HG   PRO  13          2HG       PRO  13   8.949   6.357  -7.810
  113   1HD   PRO  13          1HD       PRO  13   7.681   8.460  -8.900
  114   2HD   PRO  13          2HD       PRO  13   7.003   7.670  -7.451
  115    QB   PRO  13           QB       PRO  13  10.071   7.453  -6.039
  116    QG   PRO  13           QG       PRO  13   9.382   7.050  -8.182
  117    QD   PRO  13           QD       PRO  13   7.342   8.065  -8.175
  118    H    ASN  14           H        ASN  14   9.592  10.693  -8.417
  119    HA   ASN  14           HA       ASN  14  12.318  11.441  -7.876
  120   1HB   ASN  14          1HB       ASN  14  11.004  11.441 -10.144
  121   2HB   ASN  14          2HB       ASN  14  10.546  13.076  -9.685
  122   1HD2  ASN  14          2HD2      ASN  14  14.297  12.301 -11.077
  123   2HD2  ASN  14          1HD2      ASN  14  12.887  11.259 -11.245
  124    QB   ASN  14           QB       ASN  14  10.775  12.258  -9.914
  125    QD2  ASN  14           QD2      ASN  14  13.592  11.780 -11.161
  126    H    THR  15           H        THR  15   9.162  13.037  -7.416
  127    HA   THR  15           HA       THR  15  10.563  15.207  -5.888
  128    HB   THR  15           HB       THR  15   8.610  16.586  -6.566
  129    HG1  THR  15          1HG       THR  15   7.982  14.483  -8.363
  130   1HG2  THR  15          2HG2      THR  15  10.742  16.538  -7.901
  131   2HG2  THR  15          3HG2      THR  15  10.016  15.309  -8.953
  132   3HG2  THR  15          1HG2      THR  15   9.306  16.928  -8.862
  133    QG2  THR  15           QG2      THR  15  10.021  16.259  -8.572
  134    H    GLY  16           H        GLY  16   9.121  12.510  -5.028
  135   1HA   GLY  16          1HA       GLY  16   8.080  13.752  -2.531
  136   2HA   GLY  16          2HA       GLY  16   7.208  12.443  -3.319
  137    QA   GLY  16           QA       GLY  16   7.644  13.097  -2.925
  138    H    SER  17           H        SER  17   8.897  12.877  -0.682
  139    HA   SER  17           HA       SER  17  10.821  10.729  -0.762
  140   1HB   SER  17          1HB       SER  17  10.211  11.023   1.845
  141   2HB   SER  17          2HB       SER  17  11.346  12.031   0.957
  142    HG   SER  17           HG       SER  17   9.068  12.741   2.163
  143    QB   SER  17           QB       SER  17  10.779  11.527   1.401
  144    H    CYS  18           H        CYS  18   9.825   8.938  -1.606
  145    HA   CYS  18           HA       CYS  18   7.447   7.747  -0.382
  146   1HB   CYS  18          1HB       CYS  18   9.599   6.621  -2.202
  147   2HB   CYS  18          2HB       CYS  18   8.074   5.830  -1.845
  148    QB   CYS  18           QB       CYS  18   8.837   6.225  -2.023
  149    H    ASP  19           H        ASP  19   7.551   5.758   1.020
  150    HA   ASP  19           HA       ASP  19  10.141   5.681   2.463
  151   1HB   ASP  19          1HB       ASP  19   8.935   4.389   4.137
  152   2HB   ASP  19          2HB       ASP  19   8.481   6.093   3.933
  153    QB   ASP  19           QB       ASP  19   8.708   5.241   4.035
  154    H    TRP  20           H        TRP  20  11.414   4.095   2.198
  155    HA   TRP  20           HA       TRP  20  10.842   1.671   0.559
  156   1HB   TRP  20          1HB       TRP  20  13.420   3.216   0.944
  157   2HB   TRP  20          2HB       TRP  20  13.178   1.744   0.027
  158    HD1  TRP  20           HD       TRP  20  12.254   5.497  -0.099
  159    HE1  TRP  20          1HE       TRP  20  12.095   6.215  -2.514
  160    HE3  TRP  20          3HE       TRP  20  12.517   0.906  -2.270
  161    HZ2  TRP  20          2HZ       TRP  20  12.065   4.952  -5.139
  162    HZ3  TRP  20          3HZ       TRP  20  12.604   0.700  -4.764
  163    HH2  TRP  20           HH       TRP  20  12.260   2.708  -6.191
  164    QB   TRP  20           QB       TRP  20  13.299   2.480   0.485
  165    H    LYS  21           H        LYS  21   9.885   1.318   2.909
  166    HA   LYS  21           HA       LYS  21  11.983   0.001   4.591
  167   1HB   LYS  21          1HB       LYS  21   9.258   1.169   5.082
  168   2HB   LYS  21          2HB       LYS  21   9.477  -0.442   5.737
  169   1HG   LYS  21          1HG       LYS  21  11.301   1.917   6.292
  170   2HG   LYS  21          2HG       LYS  21   9.953   1.385   7.309
  171   1HD   LYS  21          1HD       LYS  21  11.120  -0.932   7.350
  172   2HD   LYS  21          2HD       LYS  21  12.569  -0.101   6.789
  173   1HE   LYS  21          1HE       LYS  21  10.976   0.604   9.308
  174   2HE   LYS  21          2HE       LYS  21  12.412  -0.416   9.274
  175   1HZ   LYS  21          1HZ       LYS  21  12.443   2.450   8.479
  176   2HZ   LYS  21          2HZ       LYS  21  12.893   1.805   9.938
  177   3HZ   LYS  21          3HZ       LYS  21  13.734   1.446   8.611
  178    QB   LYS  21           QB       LYS  21   9.368   0.364   5.410
  179    QG   LYS  21           QG       LYS  21  10.627   1.651   6.800
  180    QD   LYS  21           QD       LYS  21  11.844  -0.516   7.069
  181    QE   LYS  21           QE       LYS  21  11.694   0.094   9.291
  182    QZ   LYS  21           QZ       LYS  21  13.024   1.900   9.009
  183    H    GLN  22           H        GLN  22  11.314  -2.396   5.041
  184    HA   GLN  22           HA       GLN  22  10.216  -3.567   2.581
  185   1HB   GLN  22          1HB       GLN  22  11.860  -4.818   3.991
  186   2HB   GLN  22          2HB       GLN  22  10.606  -4.953   5.239
  187   1HG   GLN  22          1HG       GLN  22   9.276  -6.383   3.915
  188   2HG   GLN  22          2HG       GLN  22   9.998  -5.802   2.399
  189   1HE2  GLN  22          2HE2      GLN  22  12.327  -8.424   4.536
  190   2HE2  GLN  22          1HE2      GLN  22  11.351  -7.277   5.447
  191    QB   GLN  22           QB       GLN  22  11.233  -4.886   4.615
  192    QG   GLN  22           QG       GLN  22   9.637  -6.092   3.157
  193    QE2  GLN  22           QE2      GLN  22  11.839  -7.850   4.992
  194    H    ASN  23           H        ASN  23   8.248  -4.294   2.363
  195    HA   ASN  23           HA       ASN  23   6.077  -3.575   4.310
  196   1HB   ASN  23          1HB       ASN  23   6.122  -3.269   1.286
  197   2HB   ASN  23          2HB       ASN  23   4.779  -2.880   2.368
  198   1HD2  ASN  23          2HD2      ASN  23   7.555  -0.075   1.700
  199   2HD2  ASN  23          1HD2      ASN  23   7.028  -1.326   0.576
  200    QB   ASN  23           QB       ASN  23   5.451  -3.075   1.827
  201    QD2  ASN  23           QD2      ASN  23   7.292  -0.700   1.138
  202    H    TRP  24           H        TRP  24   7.556  -6.043   2.406
  203    HA   TRP  24           HA       TRP  24   5.144  -7.434   1.665
  204   1HB   TRP  24          1HB       TRP  24   8.188  -7.822   1.500
  205   2HB   TRP  24          2HB       TRP  24   7.145  -9.212   1.337
  206    HD1  TRP  24           HD       TRP  24   8.238  -6.134  -0.511
  207    HE1  TRP  24          1HE       TRP  24   7.253  -6.046  -2.852
  208    HE3  TRP  24          3HE       TRP  24   5.275 -10.344  -0.386
  209    HZ2  TRP  24          2HZ       TRP  24   5.034  -7.258  -4.239
  210    HZ3  TRP  24          3HZ       TRP  24   3.492 -10.621  -2.065
  211    HH2  TRP  24           HH       TRP  24   3.344  -9.048  -3.987
  212    QB   TRP  24           QB       TRP  24   7.667  -8.517   1.419
  213    H    ASN  25           H        ASN  25   3.981  -8.311   3.258
  214    HA   ASN  25           HA       ASN  25   3.361  -9.759   4.909
  215   1HB   ASN  25          1HB       ASN  25   4.754 -11.351   3.638
  216   2HB   ASN  25          2HB       ASN  25   6.137 -10.957   4.664
  217   1HD2  ASN  25          2HD2      ASN  25   4.971 -13.974   6.217
  218   2HD2  ASN  25          1HD2      ASN  25   6.289 -13.139   5.412
  219    QB   ASN  25           QB       ASN  25   5.445 -11.154   4.151
  220    QD2  ASN  25           QD2      ASN  25   5.630 -13.557   5.814
  221    H    THR  26           H        THR  26   4.114  -7.224   5.705
  222    HA   THR  26           HA       THR  26   4.915  -7.777   8.469
  223    HB   THR  26           HB       THR  26   7.006  -7.141   7.698
  224    HG1  THR  26          1HG       THR  26   7.224  -4.896   8.375
  225   1HG2  THR  26          3HG2      THR  26   5.625  -5.150   5.904
  226   2HG2  THR  26          1HG2      THR  26   7.381  -5.183   6.159
  227   3HG2  THR  26          2HG2      THR  26   6.601  -6.565   5.444
  228    QG2  THR  26           QG2      THR  26   6.536  -5.633   5.836
  229    H    CYS  27           H        CYS  27   3.897  -6.533   9.902
  230    HA   CYS  27           HA       CYS  27   1.508  -5.104   9.154
  231   1HB   CYS  27          1HB       CYS  27   1.623  -6.645  11.079
  232   2HB   CYS  27          2HB       CYS  27   2.900  -5.665  11.788
  233    QB   CYS  27           QB       CYS  27   2.261  -6.155  11.433
  234    H    VAL  28           H        VAL  28   2.607  -3.255   7.954
  235    HA   VAL  28           HA       VAL  28   4.439  -1.564   9.578
  236    HB   VAL  28           HB       VAL  28   3.667  -1.136   6.689
  237   1HG1  VAL  28          3HG1      VAL  28   4.773   0.749   7.978
  238   2HG1  VAL  28          1HG1      VAL  28   6.130  -0.331   8.315
  239   3HG1  VAL  28          2HG1      VAL  28   5.759   0.133   6.643
  240   1HG2  VAL  28          3HG2      VAL  28   5.922  -2.822   7.853
  241   2HG2  VAL  28          1HG2      VAL  28   4.616  -3.350   6.761
  242   3HG2  VAL  28          2HG2      VAL  28   5.861  -2.238   6.178
  243    QG1  VAL  28           QG1      VAL  28   5.554   0.184   7.645
  244    QG2  VAL  28           QG2      VAL  28   5.467  -2.803   6.931
  245    QQG  VAL  28           QQG      VAL  28   5.510  -1.310   7.288
  246    H    GLY  29           H        GLY  29   3.638   0.263  10.612
  247   1HA   GLY  29          1HA       GLY  29   0.972   1.242  10.096
  248   2HA   GLY  29          2HA       GLY  29   2.057   1.793  11.337
  249    QA   GLY  29           QA       GLY  29   1.515   1.517  10.716
  250    H    ILE  30           H        ILE  30   0.532   3.221   9.085
  251    HA   ILE  30           HA       ILE  30   2.736   4.930   8.052
  252    HB   ILE  30           HB       ILE  30   0.226   4.231   6.471
  253   1HG1  ILE  30          1HG1      ILE  30   1.464   2.085   6.891
  254   2HG1  ILE  30          2HG1      ILE  30   1.430   2.571   5.210
  255   1HG2  ILE  30          2HG2      ILE  30   2.841   5.501   5.682
  256   2HG2  ILE  30          3HG2      ILE  30   1.640   4.840   4.548
  257   3HG2  ILE  30          1HG2      ILE  30   1.187   6.155   5.599
  258   1HD1  ILE  30          2HD1      ILE  30   3.755   3.451   6.946
  259   2HD1  ILE  30          3HD1      ILE  30   3.680   1.820   6.299
  260   3HD1  ILE  30          1HD1      ILE  30   3.675   3.238   5.205
  261    QG1  ILE  30           QG1      ILE  30   1.447   2.328   6.050
  262    QG2  ILE  30           QG2      ILE  30   1.889   5.499   5.276
  263    QD1  ILE  30           QD1      ILE  30   3.704   2.836   6.150
  264    H    GLY  31           H        GLY  31   1.920   7.088   7.379
  265   1HA   GLY  31          1HA       GLY  31  -0.574   7.984   7.261
  266   2HA   GLY  31          2HA       GLY  31  -0.211   8.259   8.975
  267    QA   GLY  31           QA       GLY  31  -0.392   8.121   8.118
  268    H    ALA  32           H        ALA  32  -0.476  10.551   8.029
  269    HA   ALA  32           HA       ALA  32   0.344  12.523   7.772
  270   1HB   ALA  32          2HB       ALA  32   1.837  11.894   9.620
  271   2HB   ALA  32          3HB       ALA  32   3.062  11.337   8.459
  272   3HB   ALA  32          1HB       ALA  32   2.619  13.056   8.531
  273    QB   ALA  32           QB       ALA  32   2.506  12.096   8.870
  274    H    ASN  33           H        ASN  33  -0.359  12.604   5.780
  275    HA   ASN  33           HA       ASN  33  -0.277  13.432   3.690
  276   1HB   ASN  33          1HB       ASN  33   2.761  13.626   3.907
  277   2HB   ASN  33          2HB       ASN  33   1.727  14.347   2.681
  278   1HD2  ASN  33          2HD2      ASN  33   2.408  17.134   4.932
  279   2HD2  ASN  33          1HD2      ASN  33   3.336  16.122   3.840
  280    QB   ASN  33           QB       ASN  33   2.244  13.987   3.294
  281    QD2  ASN  33           QD2      ASN  33   2.872  16.628   4.386
  282    H    VAL  34           H        VAL  34   0.723  10.499   4.587
  283    HA   VAL  34           HA       VAL  34   1.743   9.587   1.905
  284    HB   VAL  34           HB       VAL  34   1.265   8.072   4.477
  285   1HG1  VAL  34          3HG1      VAL  34   2.579   7.363   1.804
  286   2HG1  VAL  34          1HG1      VAL  34   2.743   6.390   3.271
  287   3HG1  VAL  34          2HG1      VAL  34   1.144   6.608   2.528
  288   1HG2  VAL  34          2HG2      VAL  34   3.840   9.105   3.209
  289   2HG2  VAL  34          3HG2      VAL  34   3.113   9.731   4.697
  290   3HG2  VAL  34          1HG2      VAL  34   3.728   8.077   4.655
  291    QG1  VAL  34           QG1      VAL  34   2.155   6.787   2.534
  292    QG2  VAL  34           QG2      VAL  34   3.560   8.971   4.187
  293    QQG  VAL  34           QQG      VAL  34   2.858   7.879   3.361
  294    H    HIS  35           H        HIS  35   0.277   9.409   0.357
  295    HA   HIS  35           HA       HIS  35  -2.041   7.695   0.900
  296   1HB   HIS  35          1HB       HIS  35  -3.686   9.155   0.072
  297   2HB   HIS  35          2HB       HIS  35  -2.912   9.960   1.438
  298    HD1  HIS  35          1HD       HIS  35  -4.313  10.778  -1.736
  299    HD2  HIS  35          2HD       HIS  35  -0.794  11.794   0.330
  300    HE1  HIS  35          1HE       HIS  35  -3.621  13.079  -2.570
  301    QB   HIS  35           QB       HIS  35  -3.299   9.557   0.755
  302    H    TRP  36           H        TRP  36   0.510   7.651  -0.844
  303    HA   TRP  36           HA       TRP  36  -1.096   6.720  -3.228
  304   1HB   TRP  36          1HB       TRP  36   1.538   8.129  -3.326
  305   2HB   TRP  36          2HB       TRP  36   0.631   7.519  -4.701
  306    HD1  TRP  36           HD       TRP  36   0.286  10.203  -1.942
  307    HE1  TRP  36          1HE       TRP  36  -1.011  12.167  -2.824
  308    HE3  TRP  36          3HE       TRP  36  -1.075   8.242  -6.440
  309    HZ2  TRP  36          2HZ       TRP  36  -2.525  12.846  -5.231
  310    HZ3  TRP  36          3HZ       TRP  36  -2.465   9.564  -8.025
  311    HH2  TRP  36           HH       TRP  36  -3.278  11.828  -7.375
  312    QB   TRP  36           QB       TRP  36   1.084   7.824  -4.013
  313    H    MET  37           H        MET  37  -0.850   4.586  -3.396
  314    HA   MET  37           HA       MET  37   1.731   3.320  -2.563
  315   1HB   MET  37          1HB       MET  37  -0.384   2.301  -1.961
  316   2HB   MET  37          2HB       MET  37  -0.785   2.028  -3.678
  317   1HG   MET  37          1HG       MET  37   1.332   0.576  -3.744
  318   2HG   MET  37          2HG       MET  37   1.491   0.890  -2.025
  319   1HE   MET  37          2HE       MET  37   1.608  -1.948  -2.915
  320   2HE   MET  37          3HE       MET  37   1.339  -1.723  -1.171
  321   3HE   MET  37          1HE       MET  37   0.331  -2.866  -2.081
  322    QB   MET  37           QB       MET  37  -0.584   2.164  -2.820
  323    QG   MET  37           QG       MET  37   1.411   0.733  -2.885
  324    QE   MET  37           QE       MET  37   1.093  -2.179  -2.056
  325    H    VAL  38           H        VAL  38   3.288   3.447  -4.048
  326    HA   VAL  38           HA       VAL  38   2.586   3.648  -6.956
  327    HB   VAL  38           HB       VAL  38   4.922   5.025  -5.624
  328   1HG1  VAL  38          3HG1      VAL  38   5.090   4.467  -8.070
  329   2HG1  VAL  38          1HG1      VAL  38   3.617   5.377  -8.359
  330   3HG1  VAL  38          2HG1      VAL  38   5.055   6.218  -7.765
  331   1HG2  VAL  38          3HG2      VAL  38   2.189   6.166  -6.378
  332   2HG2  VAL  38          1HG2      VAL  38   2.920   6.114  -4.763
  333   3HG2  VAL  38          2HG2      VAL  38   3.624   7.143  -6.011
  334    QG1  VAL  38           QG1      VAL  38   4.587   5.354  -8.065
  335    QG2  VAL  38           QG2      VAL  38   2.911   6.474  -5.717
  336    QQG  VAL  38           QQG      VAL  38   3.749   5.914  -6.891
  337    H    THR  39           H        THR  39   2.912   1.674  -7.614
  338    HA   THR  39           HA       THR  39   4.931   0.008  -6.190
  339    HB   THR  39           HB       THR  39   2.544  -0.409  -6.002
  340    HG1  THR  39          1HG       THR  39   2.648  -2.492  -6.106
  341   1HG2  THR  39          3HG2      THR  39   1.767   0.151  -8.317
  342   2HG2  THR  39          1HG2      THR  39   2.690  -1.220  -8.937
  343   3HG2  THR  39          2HG2      THR  39   1.310  -1.497  -7.873
  344    QG2  THR  39           QG2      THR  39   1.922  -0.855  -8.376
  345    H    GLY  40           H        GLY  40   6.424  -1.314  -7.301
  346   1HA   GLY  40          1HA       GLY  40   7.233  -0.129  -9.881
  347   2HA   GLY  40          2HA       GLY  40   8.187  -1.149  -8.792
  348    QA   GLY  40           QA       GLY  40   7.710  -0.639  -9.337
  349    H    GLY  41           H        GLY  41   8.648  -1.895 -11.120
  350   1HA   GLY  41          1HA       GLY  41   6.687  -3.786 -12.200
  351   2HA   GLY  41          2HA       GLY  41   8.202  -3.231 -12.948
  352    QA   GLY  41           QA       GLY  41   7.445  -3.509 -12.574
  353    H    SER  42           H        SER  42   7.795  -4.413  -9.703
  354    HA   SER  42           HA       SER  42   9.754  -6.124  -9.157
  355   1HB   SER  42          1HB       SER  42   6.763  -6.376  -8.731
  356   2HB   SER  42          2HB       SER  42   8.006  -7.049  -7.671
  357    HG   SER  42           HG       SER  42   6.971  -4.802  -7.249
  358    QB   SER  42           QB       SER  42   7.384  -6.713  -8.201
  359    H    THR  43           H        THR  43   6.694  -7.261 -10.470
  360    HA   THR  43           HA       THR  43   8.038  -9.462 -11.952
  361    HB   THR  43           HB       THR  43   5.852 -10.701 -11.093
  362    HG1  THR  43          1HG       THR  43   5.047  -8.815  -9.948
  363   1HG2  THR  43          1HG2      THR  43   8.208 -11.327 -10.560
  364   2HG2  THR  43          2HG2      THR  43   8.188 -10.179  -9.204
  365   3HG2  THR  43          3HG2      THR  43   7.115 -11.587  -9.195
  366    QG2  THR  43           QG2      THR  43   7.837 -11.031  -9.653
  367    H    ASP  44           H        ASP  44   7.573  -7.004 -12.847
  368    HA   ASP  44           HA       ASP  44   5.606  -5.745 -13.785
  369   1HB   ASP  44          1HB       ASP  44   7.768  -5.388 -14.768
  370   2HB   ASP  44          2HB       ASP  44   7.645  -6.908 -15.684
  371    QB   ASP  44           QB       ASP  44   7.707  -6.148 -15.226
  372    H    GLY  45           H        GLY  45   3.620  -6.394 -13.947
  373   1HA   GLY  45          1HA       GLY  45   1.952  -7.125 -15.760
  374   2HA   GLY  45          2HA       GLY  45   2.759  -8.696 -15.581
  375    QA   GLY  45           QA       GLY  45   2.355  -7.910 -15.671
  376    H    LYS  46           H        LYS  46   3.386  -8.809 -13.078
  377    HA   LYS  46           HA       LYS  46   0.847  -9.550 -11.842
  378   1HB   LYS  46          1HB       LYS  46   3.602  -9.827 -10.662
  379   2HB   LYS  46          2HB       LYS  46   2.116 -10.618 -10.121
  380   1HG   LYS  46          1HG       LYS  46   1.944 -11.669 -12.405
  381   2HG   LYS  46          2HG       LYS  46   3.518 -10.932 -12.798
  382   1HD   LYS  46          1HD       LYS  46   4.154 -12.269 -10.477
  383   2HD   LYS  46          2HD       LYS  46   2.877 -13.304 -11.125
  384   1HE   LYS  46          1HE       LYS  46   5.418 -12.425 -12.561
  385   2HE   LYS  46          2HE       LYS  46   5.053 -14.048 -11.972
  386   1HZ   LYS  46          2HZ       LYS  46   3.429 -12.680 -14.056
  387   2HZ   LYS  46          3HZ       LYS  46   4.718 -13.623 -14.376
  388   3HZ   LYS  46          1HZ       LYS  46   3.373 -14.263 -13.594
  389    QB   LYS  46           QB       LYS  46   2.859 -10.223 -10.391
  390    QG   LYS  46           QG       LYS  46   2.731 -11.300 -12.601
  391    QD   LYS  46           QD       LYS  46   3.515 -12.786 -10.801
  392    QE   LYS  46           QE       LYS  46   5.235 -13.237 -12.267
  393    QZ   LYS  46           QZ       LYS  46   3.840 -13.522 -14.008
  394    H    GLN  47           H        GLN  47  -0.313  -7.974 -11.066
  395    HA   GLN  47           HA       GLN  47   0.303  -5.479 -10.075
  396   1HB   GLN  47          1HB       GLN  47  -1.940  -5.654  -8.993
  397   2HB   GLN  47          2HB       GLN  47  -1.950  -6.422 -10.582
  398   1HG   GLN  47          1HG       GLN  47  -1.406  -8.640  -9.199
  399   2HG   GLN  47          2HG       GLN  47  -1.934  -7.694  -7.818
  400   1HE2  GLN  47          2HE2      GLN  47  -4.532  -8.837 -10.852
  401   2HE2  GLN  47          1HE2      GLN  47  -2.788  -8.773 -11.056
  402    QB   GLN  47           QB       GLN  47  -1.945  -6.038  -9.787
  403    QG   GLN  47           QG       GLN  47  -1.670  -8.167  -8.508
  404    QE2  GLN  47           QE2      GLN  47  -3.660  -8.805 -10.954
  405    H    GLY  48           H        GLY  48   0.229  -4.614  -7.905
  406   1HA   GLY  48          1HA       GLY  48   1.305  -6.439  -5.771
  407   2HA   GLY  48          2HA       GLY  48   1.654  -4.716  -5.862
  408    QA   GLY  48           QA       GLY  48   1.479  -5.578  -5.817
  409    H    CYS  49           H        CYS  49  -0.110  -6.662  -4.079
  410    HA   CYS  49           HA       CYS  49  -2.312  -4.710  -3.778
  411   1HB   CYS  49          1HB       CYS  49  -2.500  -7.737  -3.469
  412   2HB   CYS  49          2HB       CYS  49  -3.807  -6.594  -3.278
  413    QB   CYS  49           QB       CYS  49  -3.154  -7.165  -3.374
  414    H    ALA  50           H        ALA  50  -3.185  -4.617  -1.694
  415    HA   ALA  50           HA       ALA  50  -1.636  -5.965   0.449
  416   1HB   ALA  50          1HB       ALA  50  -1.952  -2.932   0.250
  417   2HB   ALA  50          2HB       ALA  50  -1.316  -3.813   1.651
  418   3HB   ALA  50          3HB       ALA  50  -0.419  -3.827   0.116
  419    QB   ALA  50           QB       ALA  50  -1.229  -3.524   0.672
  420    H    THR  51           H        THR  51  -2.639  -6.092   2.438
  421    HA   THR  51           HA       THR  51  -5.492  -5.324   2.518
  422    HB   THR  51           HB       THR  51  -3.833  -6.680   4.679
  423    HG1  THR  51          1HG       THR  51  -5.289  -7.911   2.598
  424   1HG2  THR  51          3HG2      THR  51  -6.841  -6.634   4.104
  425   2HG2  THR  51          1HG2      THR  51  -6.061  -7.524   5.428
  426   3HG2  THR  51          2HG2      THR  51  -6.011  -5.750   5.407
  427    QG2  THR  51           QG2      THR  51  -6.304  -6.636   4.980
  428    H    ILE  52           H        ILE  52  -5.922  -3.368   3.487
  429    HA   ILE  52           HA       ILE  52  -3.662  -1.874   4.742
  430    HB   ILE  52           HB       ILE  52  -5.898  -0.763   3.029
  431   1HG1  ILE  52          1HG1      ILE  52  -3.042  -1.416   2.183
  432   2HG1  ILE  52          2HG1      ILE  52  -4.508  -2.213   1.589
  433   1HG2  ILE  52          3HG2      ILE  52  -4.696   0.709   4.725
  434   2HG2  ILE  52          1HG2      ILE  52  -3.237   0.484   3.735
  435   3HG2  ILE  52          2HG2      ILE  52  -4.680   1.267   3.047
  436   1HD1  ILE  52          2HD1      ILE  52  -5.307  -0.074   0.637
  437   2HD1  ILE  52          3HD1      ILE  52  -3.780   0.697   1.113
  438   3HD1  ILE  52          1HD1      ILE  52  -3.758  -0.626  -0.048
  439    QG1  ILE  52           QG1      ILE  52  -3.775  -1.815   1.886
  440    QG2  ILE  52           QG2      ILE  52  -4.204   0.820   3.836
  441    QD1  ILE  52           QD1      ILE  52  -4.282  -0.001   0.567
  442    H    TRP  53           H        TRP  53  -4.219  -1.004   6.753
  443    HA   TRP  53           HA       TRP  53  -6.936  -1.600   7.799
  444   1HB   TRP  53          1HB       TRP  53  -4.189  -1.810   8.969
  445   2HB   TRP  53          2HB       TRP  53  -5.546  -1.518  10.043
  446    HD1  TRP  53           HD       TRP  53  -7.354  -3.430  10.349
  447    HE1  TRP  53          1HE       TRP  53  -7.281  -5.936  10.015
  448    HE3  TRP  53          3HE       TRP  53  -3.229  -3.656   7.386
  449    HZ2  TRP  53          2HZ       TRP  53  -5.606  -7.862   8.574
  450    HZ3  TRP  53          3HZ       TRP  53  -2.468  -5.807   6.460
  451    HH2  TRP  53           HH       TRP  53  -3.649  -7.917   7.040
  452    QB   TRP  53           QB       TRP  53  -4.867  -1.664   9.506
  453    H    GLU  54           H        GLU  54  -7.834  -0.332   9.297
  454    HA   GLU  54           HA       GLU  54  -7.503   2.500   9.196
  455   1HB   GLU  54          1HB       GLU  54  -9.687   1.422   9.479
  456   2HB   GLU  54          2HB       GLU  54  -9.020   0.374  10.736
  457   1HG   GLU  54          1HG       GLU  54 -10.495   1.679  11.827
  458   2HG   GLU  54          2HG       GLU  54  -8.928   2.293  12.316
  459    QB   GLU  54           QB       GLU  54  -9.353   0.898  10.108
  460    QG   GLU  54           QG       GLU  54  -9.712   1.986  12.071
  461    H    GLY  55           H        GLY  55  -6.675  -0.017  11.610
  462   1HA   GLY  55          1HA       GLY  55  -5.922   1.918  13.585
  463   2HA   GLY  55          2HA       GLY  55  -5.630   0.186  13.636
  464    QA   GLY  55           QA       GLY  55  -5.776   1.052  13.611
  465    H    SER  56           H        SER  56  -3.798   2.121  14.522
  466    HA   SER  56           HA       SER  56  -1.480   2.072  12.706
  467   1HB   SER  56          1HB       SER  56  -1.582   2.792  15.670
  468   2HB   SER  56          2HB       SER  56  -0.297   3.121  14.503
  469    HG   SER  56           HG       SER  56  -2.822   4.311  14.773
  470    QB   SER  56           QB       SER  56  -0.939   2.957  15.086
  471    H    GLY  57           H        GLY  57  -0.372   0.131  12.667
  472   1HA   GLY  57          1HA       GLY  57   0.652  -1.794  13.371
  473   2HA   GLY  57          2HA       GLY  57  -0.053  -1.575  14.973
  474    QA   GLY  57           QA       GLY  57   0.299  -1.685  14.172
  475    H    CYS  58           H        CYS  58  -1.741  -1.514  11.878
  476    HA   CYS  58           HA       CYS  58  -3.350  -2.776  10.925
  477   1HB   CYS  58          1HB       CYS  58  -2.690  -4.924  10.201
  478   2HB   CYS  58          2HB       CYS  58  -1.285  -3.862  10.122
  479    QB   CYS  58           QB       CYS  58  -1.987  -4.393  10.161
  480    H    VAL  59           H        VAL  59  -4.511  -2.176  13.028
  481    HA   VAL  59           HA       VAL  59  -6.150  -4.547  13.613
  482    HB   VAL  59           HB       VAL  59  -6.746  -3.327  15.725
  483   1HG1  VAL  59          1HG1      VAL  59  -5.314  -5.341  15.738
  484   2HG1  VAL  59          2HG1      VAL  59  -3.878  -4.301  15.593
  485   3HG1  VAL  59          3HG1      VAL  59  -4.886  -4.231  17.052
  486   1HG2  VAL  59          2HG2      VAL  59  -4.184  -1.748  15.286
  487   2HG2  VAL  59          3HG2      VAL  59  -5.851  -1.121  15.359
  488   3HG2  VAL  59          1HG2      VAL  59  -5.113  -1.829  16.791
  489    QG1  VAL  59           QG1      VAL  59  -4.693  -4.625  16.128
  490    QG2  VAL  59           QG2      VAL  59  -5.050  -1.566  15.812
  491    QQG  VAL  59           QQG      VAL  59  -4.871  -3.095  15.970
  492    H    GLY  60           H        GLY  60  -8.463  -3.631  14.106
  493   1HA   GLY  60          1HA       GLY  60 -10.073  -1.927  13.868
  494   2HA   GLY  60          2HA       GLY  60  -8.946  -0.952  12.935
  495    QA   GLY  60           QA       GLY  60  -9.510  -1.439  13.402
  496    H    ARG  61           H        ARG  61 -10.548  -0.701  11.282
  497    HA   ARG  61           HA       ARG  61 -11.668  -3.054   9.845
  498   1HB   ARG  61          1HB       ARG  61 -12.953  -0.889  10.338
  499   2HB   ARG  61          2HB       ARG  61 -11.834  -0.062   9.242
  500   1HG   ARG  61          1HG       ARG  61 -12.614  -1.459   7.373
  501   2HG   ARG  61          2HG       ARG  61 -13.620  -2.422   8.489
  502   1HD   ARG  61          1HD       ARG  61 -14.973  -0.459   9.022
  503   2HD   ARG  61          2HD       ARG  61 -13.894   0.565   8.045
  504    HE   ARG  61           HE       ARG  61 -14.905  -1.550   6.397
  505   1HH1  ARG  61          2HH2      ARG  61 -15.815   1.487   7.909
  506   2HH1  ARG  61          1HH2      ARG  61 -17.020   1.929   6.746
  507   1HH2  ARG  61          2HH1      ARG  61 -16.673  -1.149   4.916
  508   2HH2  ARG  61          1HH1      ARG  61 -17.528   0.356   4.985
  509    QB   ARG  61           QB       ARG  61 -12.393  -0.476   9.790
  510    QG   ARG  61           QG       ARG  61 -13.117  -1.941   7.931
  511    QD   ARG  61           QD       ARG  61 -14.433   0.053   8.533
  512    QH1  ARG  61           QH2      ARG  61 -16.417   1.708   7.328
  513    QH2  ARG  61           QH1      ARG  61 -17.100  -0.396   4.951
  514    H    SER  62           H        SER  62 -11.304  -3.317   7.541
  515    HA   SER  62           HA       SER  62  -8.959  -1.949   6.700
  516   1HB   SER  62          1HB       SER  62  -7.833  -4.198   5.964
  517   2HB   SER  62          2HB       SER  62  -7.779  -3.751   7.637
  518    HG   SER  62           HG       SER  62  -9.156  -5.297   8.177
  519    QB   SER  62           QB       SER  62  -7.806  -3.974   6.801
  520    H    THR  63           H        THR  63  -8.397  -2.368   4.429
  521    HA   THR  63           HA       THR  63 -10.657  -3.352   2.784
  522    HB   THR  63           HB       THR  63 -10.472  -0.941   2.384
  523    HG1  THR  63          1HG       THR  63  -9.750  -1.182   0.093
  524   1HG2  THR  63          3HG2      THR  63  -7.569  -1.481   1.660
  525   2HG2  THR  63          1HG2      THR  63  -8.441   0.039   1.393
  526   3HG2  THR  63          2HG2      THR  63  -8.157  -0.522   3.044
  527    QG2  THR  63           QG2      THR  63  -8.056  -0.654   2.032
  528    H    THR  64           H        THR  64  -9.821  -4.500   0.870
  529    HA   THR  64           HA       THR  64  -6.951  -5.258   1.000
  530    HB   THR  64           HB       THR  64  -9.144  -6.967  -0.220
  531    HG1  THR  64          1HG       THR  64  -8.436  -8.296   1.691
  532   1HG2  THR  64          1HG2      THR  64  -6.843  -7.199  -1.173
  533   2HG2  THR  64          2HG2      THR  64  -6.213  -7.521   0.456
  534   3HG2  THR  64          3HG2      THR  64  -7.352  -8.652  -0.306
  535    QG2  THR  64           QG2      THR  64  -6.803  -7.791  -0.341
  536    H    MET  65           H        MET  65  -6.040  -3.889  -0.382
  537    HA   MET  65           HA       MET  65  -7.626  -2.978  -2.766
  538   1HB   MET  65          1HB       MET  65  -7.053  -1.429  -0.714
  539   2HB   MET  65          2HB       MET  65  -5.425  -1.452  -1.393
  540   1HG   MET  65          1HG       MET  65  -6.206   0.400  -2.394
  541   2HG   MET  65          2HG       MET  65  -6.755  -0.736  -3.623
  542   1HE   MET  65          1HE       MET  65  -9.334  -1.496  -3.801
  543   2HE   MET  65          2HE       MET  65  -9.473  -1.940  -2.077
  544   3HE   MET  65          3HE       MET  65 -10.634  -0.814  -2.797
  545    QB   MET  65           QB       MET  65  -6.239  -1.440  -1.053
  546    QG   MET  65           QG       MET  65  -6.480  -0.168  -3.009
  547    QE   MET  65           QE       MET  65  -9.814  -1.417  -2.892
  548    H    CYS  66           H        CYS  66  -6.857  -3.606  -4.677
  549    HA   CYS  66           HA       CYS  66  -4.008  -4.397  -4.965
  550   1HB   CYS  66          1HB       CYS  66  -6.538  -4.944  -6.555
  551   2HB   CYS  66          2HB       CYS  66  -4.951  -5.264  -7.220
  552    QB   CYS  66           QB       CYS  66  -5.744  -5.104  -6.887
  553    H    CYS  67           H        CYS  67  -2.709  -3.605  -6.744
  554    HA   CYS  67           HA       CYS  67  -3.990  -1.826  -8.690
  555   1HB   CYS  67          1HB       CYS  67  -2.893  -0.544  -6.568
  556   2HB   CYS  67          2HB       CYS  67  -1.425  -0.833  -7.506
  557    QB   CYS  67           QB       CYS  67  -2.159  -0.689  -7.037
  558    HA   PRO  68           HA       PRO  68  -1.084  -4.112 -11.146
  559   1HB   PRO  68          1HB       PRO  68  -0.837  -2.549 -13.424
  560   2HB   PRO  68          2HB       PRO  68  -2.158  -3.686 -13.028
  561   1HG   PRO  68          1HG       PRO  68  -2.101  -0.707 -12.706
  562   2HG   PRO  68          2HG       PRO  68  -3.429  -1.722 -13.300
  563   1HD   PRO  68          1HD       PRO  68  -3.335  -0.755 -10.778
  564   2HD   PRO  68          2HD       PRO  68  -4.045  -2.338 -11.094
  565    QB   PRO  68           QB       PRO  68  -1.497  -3.118 -13.226
  566    QG   PRO  68           QG       PRO  68  -2.765  -1.215 -13.003
  567    QD   PRO  68           QD       PRO  68  -3.690  -1.547 -10.936
  568    H    ALA  69           H        ALA  69   0.957  -3.774 -12.478
  569    HA   ALA  69           HA       ALA  69   2.904  -2.720 -10.548
  570   1HB   ALA  69          3HB       ALA  69   3.059  -5.019 -11.379
  571   2HB   ALA  69          1HB       ALA  69   3.241  -4.417 -13.041
  572   3HB   ALA  69          2HB       ALA  69   4.486  -4.074 -11.824
  573    QB   ALA  69           QB       ALA  69   3.595  -4.503 -12.081
  574    H    ASN  70           H        ASN  70   4.251  -0.964 -10.905
  575    HA   ASN  70           HA       ASN  70   4.869   1.062 -11.698
  576   1HB   ASN  70          1HB       ASN  70   4.846  -0.265 -14.415
  577   2HB   ASN  70          2HB       ASN  70   5.028   1.465 -14.197
  578   1HD2  ASN  70          2HD2      ASN  70   8.123  -0.895 -12.866
  579   2HD2  ASN  70          1HD2      ASN  70   6.546  -1.618 -13.278
  580    QB   ASN  70           QB       ASN  70   4.937   0.600 -14.306
  581    QD2  ASN  70           QD2      ASN  70   7.335  -1.257 -13.072
  582    H    THR  71           H        THR  71   2.740   1.188 -10.592
  583    HA   THR  71           HA       THR  71   1.069   2.951 -12.247
  584    HB   THR  71           HB       THR  71  -0.182   0.780 -10.537
  585    HG1  THR  71          1HG       THR  71   0.548   0.795 -13.268
  586   1HG2  THR  71          1HG2      THR  71  -1.568   2.836 -11.028
  587   2HG2  THR  71          2HG2      THR  71  -1.380   2.490 -12.760
  588   3HG2  THR  71          3HG2      THR  71  -2.233   1.349 -11.707
  589    QG2  THR  71           QG2      THR  71  -1.727   2.225 -11.832
  590    H    CYS  72           H        CYS  72   0.829   4.766 -11.137
  591    HA   CYS  72           HA       CYS  72   1.396   4.962  -8.240
  592   1HB   CYS  72          1HB       CYS  72   2.323   6.842  -9.385
  593   2HB   CYS  72          2HB       CYS  72   1.014   6.809 -10.562
  594    QB   CYS  72           QB       CYS  72   1.669   6.825  -9.973
  595    H    CYS  73           H        CYS  73  -0.228   4.676  -6.830
  596    HA   CYS  73           HA       CYS  73  -3.040   4.849  -7.805
  597   1HB   CYS  73          1HB       CYS  73  -1.887   2.825  -5.862
  598   2HB   CYS  73          2HB       CYS  73  -3.401   2.820  -6.737
  599    QB   CYS  73           QB       CYS  73  -2.644   2.822  -6.300
  600    H    ASN  74           H        ASN  74  -3.936   6.584  -6.807
  601    HA   ASN  74           HA       ASN  74  -3.079   7.620  -4.270
  602   1HB   ASN  74          1HB       ASN  74  -4.214   9.019  -5.961
  603   2HB   ASN  74          2HB       ASN  74  -5.687   8.079  -5.777
  604   1HD2  ASN  74          2HD2      ASN  74  -6.495   9.464  -2.541
  605   2HD2  ASN  74          1HD2      ASN  74  -6.747   8.091  -3.609
  606    QB   ASN  74           QB       ASN  74  -4.950   8.549  -5.869
  607    QD2  ASN  74           QD2      ASN  74  -6.621   8.777  -3.075
  608    H    ILE  75           H        ILE  75  -3.406   6.551  -2.356
  609    HA   ILE  75           HA       ILE  75  -5.662   4.769  -1.870
  610    HB   ILE  75           HB       ILE  75  -3.228   5.701  -0.367
  611   1HG1  ILE  75          1HG1      ILE  75  -2.990   3.279  -0.016
  612   2HG1  ILE  75          2HG1      ILE  75  -4.550   2.980  -0.819
  613   1HG2  ILE  75          2HG2      ILE  75  -5.647   4.406   0.925
  614   2HG2  ILE  75          3HG2      ILE  75  -4.008   4.442   1.619
  615   3HG2  ILE  75          1HG2      ILE  75  -4.875   5.956   1.375
  616   1HD1  ILE  75          2HD1      ILE  75  -2.135   4.280  -2.056
  617   2HD1  ILE  75          3HD1      ILE  75  -2.549   2.552  -2.234
  618   3HD1  ILE  75          1HD1      ILE  75  -3.596   3.778  -2.945
  619    QG1  ILE  75           QG1      ILE  75  -3.770   3.130  -0.417
  620    QG2  ILE  75           QG2      ILE  75  -4.843   4.935   1.306
  621    QD1  ILE  75           QD1      ILE  75  -2.760   3.537  -2.412
  622    H    ASN  76           H        ASN  76  -7.580   5.718  -1.841
  623    HA   ASN  76           HA       ASN  76  -8.038   7.506   0.427
  624   1HB   ASN  76          1HB       ASN  76  -8.700   8.270  -2.381
  625   2HB   ASN  76          2HB       ASN  76 -10.046   8.348  -1.256
  626   1HD2  ASN  76          2HD2      ASN  76  -8.940  11.216   0.484
  627   2HD2  ASN  76          1HD2      ASN  76 -10.256  10.145   0.042
  628    QB   ASN  76           QB       ASN  76  -9.373   8.309  -1.818
  629    QD2  ASN  76           QD2      ASN  76  -9.598  10.681   0.263
  630    H    THR  77           H        THR  77  -9.755   6.617   1.642
  631    HA   THR  77           HA       THR  77 -11.218   4.312   0.352
  632    HB   THR  77           HB       THR  77 -10.782   2.925   2.204
  633    HG1  THR  77          1HG       THR  77  -9.540   5.184   3.380
  634   1HG2  THR  77          1HG2      THR  77  -9.048   2.946   0.466
  635   2HG2  THR  77          2HG2      THR  77  -8.141   4.172   1.368
  636   3HG2  THR  77          3HG2      THR  77  -8.395   2.569   2.073
  637    QG2  THR  77           QG2      THR  77  -8.528   3.229   1.302
  638    H    GLY  78           H        GLY  78 -12.823   3.522   2.387
  639   1HA   GLY  78          1HA       GLY  78 -14.591   5.862   2.851
  640   2HA   GLY  78          2HA       GLY  78 -14.940   4.156   3.134
  641    QA   GLY  78           QA       GLY  78 -14.765   5.009   2.993
  642    H    PHE  79           H        PHE  79 -11.790   4.962   4.356
  643    HA   PHE  79           HA       PHE  79 -12.597   6.036   6.925
  644   1HB   PHE  79          1HB       PHE  79 -11.081   4.019   7.823
  645   2HB   PHE  79          2HB       PHE  79 -12.830   3.891   7.715
  646    HD1  PHE  79          1HD       PHE  79 -13.884   2.453   6.034
  647    HD2  PHE  79          2HD       PHE  79  -9.603   2.690   6.410
  648    HE1  PHE  79          1HE       PHE  79 -13.654   0.213   4.963
  649    HE2  PHE  79          2HE       PHE  79  -9.370   0.510   5.274
  650   1HZ   PHE  79           HZ       PHE  79 -11.419  -0.733   4.540
  651    QB   PHE  79           QB       PHE  79 -11.956   3.955   7.769
  652    QG   PHE  79           QD       PHE  79 -11.743   2.572   6.222
  653    QZ   PHE  79           QE       PHE  79 -11.512   0.362   5.119
  654    QZ   PHE  79           QR       PHE  79 -11.586   1.027   5.444
  655    H    TYR  80           H        TYR  80 -10.623   6.164   8.324
  656    HA   TYR  80           HA       TYR  80  -8.636   7.383   6.635
  657   1HB   TYR  80          1HB       TYR  80  -9.096   8.328   8.901
  658   2HB   TYR  80          2HB       TYR  80  -8.594   6.792   9.605
  659    HD1  TYR  80          2HD       TYR  80  -6.783   8.599   6.807
  660    HD2  TYR  80          1HD       TYR  80  -6.836   7.543  10.997
  661    HE1  TYR  80          2HE       TYR  80  -4.456   9.344   7.024
  662    HE2  TYR  80          1HE       TYR  80  -4.596   8.517  11.237
  663    HH   TYR  80           HH       TYR  80  -2.788   9.912   8.564
  664    QB   TYR  80           QB       TYR  80  -8.845   7.560   9.253
  665    QG   TYR  80           QD       TYR  80  -6.809   8.071   8.902
  666    QZ   TYR  80           QE       TYR  80  -4.526   8.930   9.130
  667    QR   TYR  80           QR       TYR  80  -5.668   8.501   9.016
  668    H    ILE  81           H        ILE  81  -6.441   6.374   6.388
  669    HA   ILE  81           HA       ILE  81  -6.360   3.493   6.973
  670    HB   ILE  81           HB       ILE  81  -4.522   3.679   5.145
  671   1HG1  ILE  81          1HG1      ILE  81  -5.023   6.278   5.091
  672   2HG1  ILE  81          2HG1      ILE  81  -4.707   5.402   3.645
  673   1HG2  ILE  81          1HG2      ILE  81  -7.526   3.528   4.647
  674   2HG2  ILE  81          2HG2      ILE  81  -6.268   3.046   3.482
  675   3HG2  ILE  81          3HG2      ILE  81  -6.432   2.205   5.032
  676   1HD1  ILE  81          3HD1      ILE  81  -7.581   5.826   4.559
  677   2HD1  ILE  81          1HD1      ILE  81  -6.673   6.948   3.545
  678   3HD1  ILE  81          2HD1      ILE  81  -6.980   5.279   2.999
  679    QG1  ILE  81           QG1      ILE  81  -4.865   5.840   4.368
  680    QG2  ILE  81           QG2      ILE  81  -6.742   2.927   4.387
  681    QD1  ILE  81           QD1      ILE  81  -7.078   6.018   3.701
  682    H    ARG  82           H        ARG  82  -4.488   2.782   8.028
  683    HA   ARG  82           HA       ARG  82  -2.189   4.628   8.504
  684   1HB   ARG  82          1HB       ARG  82  -3.948   3.224  10.562
  685   2HB   ARG  82          2HB       ARG  82  -2.227   3.419  10.889
  686   1HG   ARG  82          1HG       ARG  82  -2.291   5.676  11.022
  687   2HG   ARG  82          2HG       ARG  82  -3.775   5.857  10.070
  688   1HD   ARG  82          1HD       ARG  82  -5.180   5.316  11.872
  689   2HD   ARG  82          2HD       ARG  82  -3.886   4.504  12.763
  690    HE   ARG  82           HE       ARG  82  -3.347   7.326  12.295
  691   1HH1  ARG  82          2HH2      ARG  82  -4.939   5.111  14.663
  692   2HH1  ARG  82          1HH2      ARG  82  -4.257   6.000  15.982
  693   1HH2  ARG  82          2HH1      ARG  82  -3.363   8.815  14.008
  694   2HH2  ARG  82          1HH1      ARG  82  -3.550   8.216  15.636
  695    QB   ARG  82           QB       ARG  82  -3.088   3.321  10.726
  696    QG   ARG  82           QG       ARG  82  -3.033   5.767  10.546
  697    QD   ARG  82           QD       ARG  82  -4.533   4.910  12.318
  698    QH1  ARG  82           QH2      ARG  82  -4.598   5.556  15.322
  699    QH2  ARG  82           QH1      ARG  82  -3.456   8.515  14.822
  700    H    SER  83           H        SER  83  -3.307   1.222   9.132
  701    HA   SER  83           HA       SER  83  -0.385   0.696   8.517
  702   1HB   SER  83          1HB       SER  83  -2.232  -1.287   9.697
  703   2HB   SER  83          2HB       SER  83  -0.477  -1.376   9.581
  704    HG   SER  83           HG       SER  83  -1.911   0.623  10.996
  705    QB   SER  83           QB       SER  83  -1.355  -1.332   9.639
  706    H    TYR  84           H        TYR  84   0.120  -1.382   7.431
  707    HA   TYR  84           HA       TYR  84  -1.985  -2.573   5.911
  708   1HB   TYR  84          1HB       TYR  84  -1.227  -2.252   3.715
  709   2HB   TYR  84          2HB       TYR  84  -1.244  -0.640   4.401
  710    HD1  TYR  84          2HD       TYR  84   1.107   0.110   5.515
  711    HD2  TYR  84          1HD       TYR  84   0.620  -2.867   2.437
  712    HE1  TYR  84          2HE       TYR  84   3.246   0.801   4.481
  713    HE2  TYR  84          1HE       TYR  84   2.700  -2.089   1.377
  714    HH   TYR  84           HH       TYR  84   4.541   0.687   2.580
  715    QB   TYR  84           QB       TYR  84  -1.235  -1.446   4.058
  716    QG   TYR  84           QD       TYR  84   0.864  -1.378   3.976
  717    QZ   TYR  84           QE       TYR  84   2.973  -0.644   2.929
  718    QR   TYR  84           QR       TYR  84   1.919  -1.011   3.452
  719    H    ARG  85           H        ARG  85  -1.180  -4.443   4.705
  720    HA   ARG  85           HA       ARG  85   1.565  -5.231   5.084
  721   1HB   ARG  85          1HB       ARG  85   0.587  -6.148   7.142
  722   2HB   ARG  85          2HB       ARG  85  -0.665  -7.006   6.249
  723   1HG   ARG  85          1HG       ARG  85   2.204  -7.438   5.511
  724   2HG   ARG  85          2HG       ARG  85   1.612  -8.219   6.978
  725   1HD   ARG  85          1HD       ARG  85  -0.243  -8.534   4.688
  726   2HD   ARG  85          2HD       ARG  85   1.376  -9.147   4.335
  727    HE   ARG  85           HE       ARG  85   0.482 -10.132   6.892
  728   1HH1  ARG  85          2HH2      ARG  85  -0.233 -10.394   3.434
  729   2HH1  ARG  85          1HH2      ARG  85  -0.944 -11.981   3.586
  730   1HH2  ARG  85          2HH1      ARG  85  -0.310 -12.123   7.103
  731   2HH2  ARG  85          1HH1      ARG  85  -0.995 -13.061   5.794
  732    QB   ARG  85           QB       ARG  85  -0.039  -6.577   6.695
  733    QG   ARG  85           QG       ARG  85   1.908  -7.828   6.244
  734    QD   ARG  85           QD       ARG  85   0.567  -8.840   4.512
  735    QH1  ARG  85           QH2      ARG  85  -0.588 -11.187   3.510
  736    QH2  ARG  85           QH1      ARG  85  -0.652 -12.592   6.448
  737    H    ARG  86           H        ARG  86   2.213  -6.348   3.199
  738    HA   ARG  86           HA       ARG  86   0.401  -5.998   1.086
  739   1HB   ARG  86          1HB       ARG  86   2.216  -5.966  -0.048
  740   2HB   ARG  86          2HB       ARG  86   3.142  -6.338   1.384
  741   1HG   ARG  86          1HG       ARG  86   2.171  -8.185  -0.803
  742   2HG   ARG  86          2HG       ARG  86   3.784  -7.696  -0.396
  743   1HD   ARG  86          1HD       ARG  86   4.068  -9.411   1.096
  744   2HD   ARG  86          2HD       ARG  86   2.575  -9.113   1.909
  745    HE   ARG  86           HE       ARG  86   1.628 -10.178  -0.373
  746   1HH1  ARG  86          2HH2      ARG  86   4.498 -11.473   1.288
  747   2HH1  ARG  86          1HH2      ARG  86   4.018 -13.091   0.902
  748   1HH2  ARG  86          2HH1      ARG  86   1.174 -12.340  -0.902
  749   2HH2  ARG  86          1HH1      ARG  86   2.312 -13.557  -0.352
  750    QB   ARG  86           QB       ARG  86   2.679  -6.152   0.668
  751    QG   ARG  86           QG       ARG  86   2.977  -7.941  -0.600
  752    QD   ARG  86           QD       ARG  86   3.322  -9.262   1.503
  753    QH1  ARG  86           QH2      ARG  86   4.258 -12.282   1.095
  754    QH2  ARG  86           QH1      ARG  86   1.743 -12.948  -0.627
  755    H    VAL  87           H        VAL  87  -0.181  -7.716  -0.589
  756    HA   VAL  87           HA       VAL  87  -0.236 -10.446   0.425
  757    HB   VAL  87           HB       VAL  87  -2.620 -10.811  -0.085
  758   1HG1  VAL  87          2HG1      VAL  87  -2.040 -10.235   2.220
  759   2HG1  VAL  87          3HG1      VAL  87  -2.382  -8.518   1.887
  760   3HG1  VAL  87          1HG1      VAL  87  -3.664  -9.734   1.779
  761   1HG2  VAL  87          3HG2      VAL  87  -2.794  -7.805  -0.567
  762   2HG2  VAL  87          1HG2      VAL  87  -3.057  -9.094  -1.759
  763   3HG2  VAL  87          2HG2      VAL  87  -4.179  -8.890  -0.417
  764    QG1  VAL  87           QG1      VAL  87  -2.695  -9.496   1.962
  765    QG2  VAL  87           QG2      VAL  87  -3.343  -8.597  -0.914
  766    QQG  VAL  87           QQG      VAL  87  -3.019  -9.046   0.524
  767    H    GLU  88           H        GLU  88  -0.578  -8.320  -2.346
  768    HA   GLU  88           HA       GLU  88   0.332  -8.676  -4.446
  769   1HB   GLU  88          1HB       GLU  88   1.731 -10.632  -3.407
  770   2HB   GLU  88          2HB       GLU  88   0.441 -11.647  -4.083
  771   1HG   GLU  88          1HG       GLU  88   0.862 -10.628  -6.307
  772   2HG   GLU  88          2HG       GLU  88   2.269  -9.794  -5.670
  773    QB   GLU  88           QB       GLU  88   1.086 -11.140  -3.745
  774    QG   GLU  88           QG       GLU  88   1.565 -10.211  -5.988
   
  No H/Q in entry =         774
  Start of MODEL    2
    1   1HA   GLY   1          1HA       GLY   1  13.508  -8.055  -7.968
    2   2HA   GLY   1          2HA       GLY   1  12.200  -7.109  -7.231
    3    QA   GLY   1           QA       GLY   1  12.854  -7.582  -7.599
    4    H    ASP   2           H        ASP   2  14.338  -4.819  -8.436
    5    HA   ASP   2           HA       ASP   2  14.448  -3.438 -10.104
    6   1HB   ASP   2          1HB       ASP   2  15.031  -4.952 -11.811
    7   2HB   ASP   2          2HB       ASP   2  13.400  -5.689 -11.850
    8    QB   ASP   2           QB       ASP   2  14.215  -5.321 -11.831
    9    H    GLY   3           H        GLY   3  11.272  -5.119 -10.428
   10   1HA   GLY   3          1HA       GLY   3   9.882  -2.555 -10.175
   11   2HA   GLY   3          2HA       GLY   3   9.121  -4.140 -10.050
   12    QA   GLY   3           QA       GLY   3   9.501  -3.348 -10.113
   13    H    TYR   4           H        TYR   4   8.891  -1.880  -8.295
   14    HA   TYR   4           HA       TYR   4   9.506  -3.238  -5.700
   15   1HB   TYR   4          1HB       TYR   4   9.644  -0.900  -4.726
   16   2HB   TYR   4          2HB       TYR   4  10.988  -1.397  -5.706
   17    HD1  TYR   4          1HD       TYR   4  11.281  -0.436  -8.055
   18    HD2  TYR   4          2HD       TYR   4   8.203   0.950  -5.373
   19    HE1  TYR   4          1HE       TYR   4  11.075   1.640  -9.368
   20    HE2  TYR   4          2HE       TYR   4   7.992   3.028  -6.698
   21    HH   TYR   4           HH       TYR   4  10.025   3.709  -9.566
   22    QB   TYR   4           QB       TYR   4  10.316  -1.148  -5.216
   23    QG   TYR   4           QD       TYR   4   9.742   0.257  -6.714
   24    QZ   TYR   4           QE       TYR   4   9.534   2.334  -8.033
   25    QR   TYR   4           QR       TYR   4   9.638   1.296  -7.374
   26    H    LEU   5           H        LEU   5   8.047  -2.217  -4.042
   27    HA   LEU   5           HA       LEU   5   5.730  -0.836  -4.986
   28   1HB   LEU   5          1HB       LEU   5   4.908  -3.176  -5.168
   29   2HB   LEU   5          2HB       LEU   5   5.203  -3.414  -3.442
   30    HG   LEU   5           HG       LEU   5   3.602  -0.963  -4.102
   31   1HD1  LEU   5          2HD1      LEU   5   2.824  -2.805  -5.777
   32   2HD1  LEU   5          3HD1      LEU   5   2.177  -3.576  -4.362
   33   3HD1  LEU   5          1HD1      LEU   5   1.593  -1.984  -4.767
   34   1HD2  LEU   5          3HD2      LEU   5   3.241  -3.287  -2.152
   35   2HD2  LEU   5          1HD2      LEU   5   3.709  -1.623  -1.756
   36   3HD2  LEU   5          2HD2      LEU   5   2.074  -1.986  -2.338
   37    QB   LEU   5           QB       LEU   5   5.056  -3.295  -4.305
   38    QD1  LEU   5           QD1      LEU   5   2.198  -2.788  -4.969
   39    QD2  LEU   5           QD2      LEU   5   3.008  -2.299  -2.082
   40    QQD  LEU   5           QQD      LEU   5   2.603  -2.543  -3.525
   41    H    ILE   6           H        ILE   6   5.408   0.736  -3.563
   42    HA   ILE   6           HA       ILE   6   6.188   0.535  -0.716
   43    HB   ILE   6           HB       ILE   6   7.382   2.706  -0.940
   44   1HG1  ILE   6          1HG1      ILE   6   6.872   2.360  -3.931
   45   2HG1  ILE   6          2HG1      ILE   6   6.411   3.696  -2.871
   46   1HG2  ILE   6          2HG2      ILE   6   8.627   0.529  -1.002
   47   2HG2  ILE   6          3HG2      ILE   6   8.698   0.675  -2.774
   48   3HG2  ILE   6          1HG2      ILE   6   9.462   1.899  -1.747
   49   1HD1  ILE   6          3HD1      ILE   6   8.908   4.132  -2.558
   50   2HD1  ILE   6          1HD1      ILE   6   9.180   2.951  -3.853
   51   3HD1  ILE   6          2HD1      ILE   6   8.266   4.425  -4.185
   52    QG1  ILE   6           QG1      ILE   6   6.642   3.028  -3.401
   53    QG2  ILE   6           QG2      ILE   6   8.929   1.034  -1.841
   54    QD1  ILE   6           QD1      ILE   6   8.785   3.836  -3.532
   55    H    MET   7           H        MET   7   5.171   2.641   0.403
   56    HA   MET   7           HA       MET   7   3.431   4.007  -1.499
   57   1HB   MET   7          1HB       MET   7   1.743   4.177  -0.130
   58   2HB   MET   7          2HB       MET   7   2.185   2.521   0.244
   59   1HG   MET   7          1HG       MET   7   3.251   3.327   2.319
   60   2HG   MET   7          2HG       MET   7   2.846   4.988   1.913
   61   1HE   MET   7          3HE       MET   7   0.271   5.784   1.478
   62   2HE   MET   7          1HE       MET   7  -0.321   4.305   0.679
   63   3HE   MET   7          2HE       MET   7  -1.117   4.894   2.145
   64    QB   MET   7           QB       MET   7   1.964   3.349   0.057
   65    QG   MET   7           QG       MET   7   3.049   4.158   2.116
   66    QE   MET   7           QE       MET   7  -0.389   4.994   1.434
   67    H    CYS   8           H        CYS   8   2.862   6.154  -0.673
   68    HA   CYS   8           HA       CYS   8   5.289   7.664  -0.010
   69   1HB   CYS   8          1HB       CYS   8   3.826   7.528  -2.674
   70   2HB   CYS   8          2HB       CYS   8   5.098   8.692  -2.316
   71    QB   CYS   8           QB       CYS   8   4.462   8.110  -2.495
   72    H    LYS   9           H        LYS   9   4.902   9.888  -0.122
   73    HA   LYS   9           HA       LYS   9   2.090  10.628   0.426
   74   1HB   LYS   9          1HB       LYS   9   3.007  12.855   0.868
   75   2HB   LYS   9          2HB       LYS   9   3.750  11.557   1.863
   76   1HG   LYS   9          1HG       LYS   9   5.734  11.607   0.735
   77   2HG   LYS   9          2HG       LYS   9   5.019  12.436  -0.677
   78   1HD   LYS   9          1HD       LYS   9   4.592  14.340   1.193
   79   2HD   LYS   9          2HD       LYS   9   5.990  13.582   1.952
   80   1HE   LYS   9          1HE       LYS   9   7.373  14.079  -0.029
   81   2HE   LYS   9          2HE       LYS   9   5.938  14.559  -0.958
   82   1HZ   LYS   9          1HZ       LYS   9   5.643  16.377   0.626
   83   2HZ   LYS   9          2HZ       LYS   9   7.128  16.013   1.303
   84   3HZ   LYS   9          3HZ       LYS   9   7.031  16.495  -0.239
   85    QB   LYS   9           QB       LYS   9   3.379  12.206   1.365
   86    QG   LYS   9           QG       LYS   9   5.376  12.022   0.029
   87    QD   LYS   9           QD       LYS   9   5.291  13.961   1.572
   88    QE   LYS   9           QE       LYS   9   6.656  14.319  -0.494
   89    QZ   LYS   9           QZ       LYS   9   6.601  16.295   0.563
   90    H    ASN  10           H        ASN  10   4.010  10.717  -2.225
   91    HA   ASN  10           HA       ASN  10   1.667  11.821  -3.690
   92   1HB   ASN  10          1HB       ASN  10   2.813  13.350  -5.038
   93   2HB   ASN  10          2HB       ASN  10   3.274  13.699  -3.385
   94   1HD2  ASN  10          2HD2      ASN  10   6.471  14.071  -4.790
   95   2HD2  ASN  10          1HD2      ASN  10   4.944  14.924  -4.549
   96    QB   ASN  10           QB       ASN  10   3.043  13.524  -4.211
   97    QD2  ASN  10           QD2      ASN  10   5.708  14.498  -4.670
   98    H    CYS  11           H        CYS  11   2.441  11.796  -6.212
   99    HA   CYS  11           HA       CYS  11   2.275   8.914  -6.650
  100   1HB   CYS  11          1HB       CYS  11   0.662  10.666  -7.474
  101   2HB   CYS  11          2HB       CYS  11   1.966  11.356  -8.452
  102    QB   CYS  11           QB       CYS  11   1.314  11.011  -7.963
  103    H    ASP  12           H        ASP  12   4.834  10.945  -6.421
  104    HA   ASP  12           HA       ASP  12   6.407   9.548  -8.562
  105   1HB   ASP  12          1HB       ASP  12   5.686  11.796  -9.257
  106   2HB   ASP  12          2HB       ASP  12   6.529  12.492  -7.851
  107    QB   ASP  12           QB       ASP  12   6.107  12.144  -8.554
  108    HA   PRO  13           HA       PRO  13   8.571   8.969  -4.546
  109   1HB   PRO  13          1HB       PRO  13  10.114   7.178  -6.408
  110   2HB   PRO  13          2HB       PRO  13   9.673   6.889  -4.711
  111   1HG   PRO  13          1HG       PRO  13   8.225   5.746  -6.727
  112   2HG   PRO  13          2HG       PRO  13   7.398   6.427  -5.302
  113   1HD   PRO  13          1HD       PRO  13   7.682   7.640  -8.028
  114   2HD   PRO  13          2HD       PRO  13   6.295   7.701  -6.906
  115    QB   PRO  13           QB       PRO  13   9.894   7.034  -5.559
  116    QG   PRO  13           QG       PRO  13   7.812   6.086  -6.014
  117    QD   PRO  13           QD       PRO  13   6.988   7.671  -7.467
  118    H    ASN  14           H        ASN  14   9.761  10.135  -7.700
  119    HA   ASN  14           HA       ASN  14  12.415  10.735  -6.779
  120   1HB   ASN  14          1HB       ASN  14  11.778  10.760  -9.178
  121   2HB   ASN  14          2HB       ASN  14  10.744  12.170  -8.863
  122   1HD2  ASN  14          2HD2      ASN  14  13.643  13.962 -10.013
  123   2HD2  ASN  14          1HD2      ASN  14  12.062  13.327 -10.458
  124    QB   ASN  14           QB       ASN  14  11.261  11.465  -9.020
  125    QD2  ASN  14           QD2      ASN  14  12.852  13.645 -10.236
  126    H    THR  15           H        THR  15   9.306  12.448  -6.615
  127    HA   THR  15           HA       THR  15  10.556  14.434  -4.741
  128    HB   THR  15           HB       THR  15   9.996  15.624  -6.692
  129    HG1  THR  15          1HG       THR  15   8.274  16.954  -5.940
  130   1HG2  THR  15          3HG2      THR  15   7.264  14.295  -6.650
  131   2HG2  THR  15          1HG2      THR  15   7.722  15.667  -7.676
  132   3HG2  THR  15          2HG2      THR  15   8.541  14.123  -7.875
  133    QG2  THR  15           QG2      THR  15   7.842  14.695  -7.400
  134    H    GLY  16           H        GLY  16   9.052  11.655  -4.635
  135   1HA   GLY  16          1HA       GLY  16   7.183  12.345  -2.442
  136   2HA   GLY  16          2HA       GLY  16   7.273  10.825  -3.302
  137    QA   GLY  16           QA       GLY  16   7.228  11.585  -2.872
  138    H    SER  17           H        SER  17   7.923  12.177  -0.497
  139    HA   SER  17           HA       SER  17  10.130  10.481   0.420
  140   1HB   SER  17          1HB       SER  17   7.819  11.533   2.090
  141   2HB   SER  17          2HB       SER  17   9.464  11.120   2.601
  142    HG   SER  17           HG       SER  17   9.993  12.877   0.913
  143    QB   SER  17           QB       SER  17   8.642  11.326   2.346
  144    H    CYS  18           H        CYS  18   9.855   8.225   0.490
  145    HA   CYS  18           HA       CYS  18   7.103   7.153   0.596
  146   1HB   CYS  18          1HB       CYS  18   9.528   6.498  -1.102
  147   2HB   CYS  18          2HB       CYS  18   8.106   5.483  -1.025
  148    QB   CYS  18           QB       CYS  18   8.817   5.991  -1.064
  149    H    ASP  19           H        ASP  19   7.081   4.899   1.346
  150    HA   ASP  19           HA       ASP  19   9.396   4.235   3.118
  151   1HB   ASP  19          1HB       ASP  19   7.846   2.382   3.873
  152   2HB   ASP  19          2HB       ASP  19   7.529   4.077   4.267
  153    QB   ASP  19           QB       ASP  19   7.687   3.229   4.070
  154    H    TRP  20           H        TRP  20  10.817   3.823   1.547
  155    HA   TRP  20           HA       TRP  20  10.625   1.271   0.020
  156   1HB   TRP  20          1HB       TRP  20  12.986   3.100   0.546
  157   2HB   TRP  20          2HB       TRP  20  12.938   1.725  -0.549
  158    HD1  TRP  20           HD       TRP  20  11.565   5.292  -0.204
  159    HE1  TRP  20          1HE       TRP  20  11.296   6.286  -2.541
  160    HE3  TRP  20          3HE       TRP  20  12.204   1.034  -2.933
  161    HZ2  TRP  20          2HZ       TRP  20  11.410   5.348  -5.288
  162    HZ3  TRP  20          3HZ       TRP  20  12.031   1.099  -5.402
  163    HH2  TRP  20           HH       TRP  20  11.757   3.259  -6.594
  164    QB   TRP  20           QB       TRP  20  12.962   2.413  -0.001
  165    H    LYS  21           H        LYS  21   9.867   0.955   2.584
  166    HA   LYS  21           HA       LYS  21  12.077  -0.645   3.792
  167   1HB   LYS  21          1HB       LYS  21   9.995   1.044   5.091
  168   2HB   LYS  21          2HB       LYS  21   9.946  -0.635   5.592
  169   1HG   LYS  21          1HG       LYS  21  11.452   0.455   7.098
  170   2HG   LYS  21          2HG       LYS  21  12.372  -0.622   6.071
  171   1HD   LYS  21          1HD       LYS  21  13.645   1.372   6.153
  172   2HD   LYS  21          2HD       LYS  21  12.938   1.346   4.558
  173   1HE   LYS  21          1HE       LYS  21  12.793   3.591   5.500
  174   2HE   LYS  21          2HE       LYS  21  11.174   2.959   5.242
  175   1HZ   LYS  21          3HZ       LYS  21  12.564   2.980   7.873
  176   2HZ   LYS  21          1HZ       LYS  21  11.447   4.043   7.415
  177   3HZ   LYS  21          2HZ       LYS  21  11.028   2.498   7.643
  178    QB   LYS  21           QB       LYS  21   9.970   0.205   5.341
  179    QG   LYS  21           QG       LYS  21  11.912  -0.083   6.584
  180    QD   LYS  21           QD       LYS  21  13.291   1.359   5.356
  181    QE   LYS  21           QE       LYS  21  11.983   3.275   5.371
  182    QZ   LYS  21           QZ       LYS  21  11.680   3.174   7.644
  183    H    GLN  22           H        GLN  22  11.176  -2.801   4.446
  184    HA   GLN  22           HA       GLN  22   9.590  -3.941   2.427
  185   1HB   GLN  22          1HB       GLN  22  11.144  -5.092   4.066
  186   2HB   GLN  22          2HB       GLN  22   9.843  -4.944   5.266
  187   1HG   GLN  22          1HG       GLN  22   8.437  -6.423   4.113
  188   2HG   GLN  22          2HG       GLN  22   9.394  -6.301   2.616
  189   1HE2  GLN  22          2HE2      GLN  22  10.112  -9.486   4.655
  190   2HE2  GLN  22          1HE2      GLN  22   8.601  -8.585   4.724
  191    QB   GLN  22           QB       GLN  22  10.493  -5.018   4.666
  192    QG   GLN  22           QG       GLN  22   8.915  -6.362   3.365
  193    QE2  GLN  22           QE2      GLN  22   9.356  -9.035   4.689
  194    H    ASN  23           H        ASN  23   7.537  -4.421   2.309
  195    HA   ASN  23           HA       ASN  23   5.519  -3.825   4.436
  196   1HB   ASN  23          1HB       ASN  23   3.841  -3.424   2.603
  197   2HB   ASN  23          2HB       ASN  23   4.988  -2.143   2.950
  198   1HD2  ASN  23          2HD2      ASN  23   6.210  -1.926  -0.333
  199   2HD2  ASN  23          1HD2      ASN  23   6.065  -1.253   1.281
  200    QB   ASN  23           QB       ASN  23   4.415  -2.783   2.777
  201    QD2  ASN  23           QD2      ASN  23   6.137  -1.589   0.474
  202    H    TRP  24           H        TRP  24   7.076  -6.137   2.484
  203    HA   TRP  24           HA       TRP  24   5.050  -8.132   2.264
  204   1HB   TRP  24          1HB       TRP  24   7.999  -7.954   2.050
  205   2HB   TRP  24          2HB       TRP  24   7.449  -9.467   2.697
  206    HD1  TRP  24           HD       TRP  24   8.496  -8.268  -0.392
  207    HE1  TRP  24          1HE       TRP  24   7.492  -9.494  -2.377
  208    HE3  TRP  24          3HE       TRP  24   4.505 -10.464   1.959
  209    HZ2  TRP  24          2HZ       TRP  24   5.262 -11.261  -2.898
  210    HZ3  TRP  24          3HZ       TRP  24   2.936 -11.888   0.666
  211    HH2  TRP  24           HH       TRP  24   3.332 -12.313  -1.747
  212    QB   TRP  24           QB       TRP  24   7.724  -8.711   2.373
  213    H    ASN  25           H        ASN  25   3.799  -8.149   4.019
  214    HA   ASN  25           HA       ASN  25   3.117  -8.449   6.151
  215   1HB   ASN  25          1HB       ASN  25   4.709 -10.919   5.535
  216   2HB   ASN  25          2HB       ASN  25   4.015 -10.726   7.134
  217   1HD2  ASN  25          2HD2      ASN  25   1.554 -11.827   4.137
  218   2HD2  ASN  25          1HD2      ASN  25   3.292 -11.963   4.103
  219    QB   ASN  25           QB       ASN  25   4.362 -10.823   6.334
  220    QD2  ASN  25           QD2      ASN  25   2.423 -11.895   4.120
  221    H    THR  26           H        THR  26   4.530  -6.438   6.310
  222    HA   THR  26           HA       THR  26   5.930  -6.550   8.896
  223    HB   THR  26           HB       THR  26   7.420  -4.734   7.789
  224    HG1  THR  26          1HG       THR  26   6.858  -4.406   5.808
  225   1HG2  THR  26          1HG2      THR  26   7.714  -7.677   7.007
  226   2HG2  THR  26          2HG2      THR  26   8.981  -6.471   6.790
  227   3HG2  THR  26          3HG2      THR  26   8.412  -6.857   8.417
  228    QG2  THR  26           QG2      THR  26   8.369  -7.001   7.405
  229    H    CYS  27           H        CYS  27   4.892  -5.008  10.131
  230    HA   CYS  27           HA       CYS  27   2.384  -4.080   9.073
  231   1HB   CYS  27          1HB       CYS  27   2.841  -5.150  11.339
  232   2HB   CYS  27          2HB       CYS  27   3.639  -3.652  11.793
  233    QB   CYS  27           QB       CYS  27   3.240  -4.401  11.566
  234    H    VAL  28           H        VAL  28   3.089  -2.430   7.467
  235    HA   VAL  28           HA       VAL  28   4.892  -0.337   8.396
  236    HB   VAL  28           HB       VAL  28   3.400  -0.728   5.780
  237   1HG1  VAL  28          3HG1      VAL  28   5.323   1.435   6.708
  238   2HG1  VAL  28          1HG1      VAL  28   5.099   1.037   4.994
  239   3HG1  VAL  28          2HG1      VAL  28   3.734   1.625   5.955
  240   1HG2  VAL  28          1HG2      VAL  28   6.288  -1.173   6.661
  241   2HG2  VAL  28          2HG2      VAL  28   5.125  -2.391   6.135
  242   3HG2  VAL  28          3HG2      VAL  28   5.733  -1.204   4.975
  243    QG1  VAL  28           QG1      VAL  28   4.719   1.366   5.886
  244    QG2  VAL  28           QG2      VAL  28   5.715  -1.589   5.924
  245    QQG  VAL  28           QQG      VAL  28   5.217  -0.112   5.905
  246    H    GLY  29           H        GLY  29   4.256   1.403   9.502
  247   1HA   GLY  29          1HA       GLY  29   1.518   2.190   9.827
  248   2HA   GLY  29          2HA       GLY  29   2.952   3.034  10.429
  249    QA   GLY  29           QA       GLY  29   2.235   2.612  10.128
  250    H    ILE  30           H        ILE  30   0.637   4.253   9.217
  251    HA   ILE  30           HA       ILE  30   1.784   5.592   6.821
  252    HB   ILE  30           HB       ILE  30  -1.138   4.901   7.401
  253   1HG1  ILE  30          1HG1      ILE  30   0.792   3.693   5.380
  254   2HG1  ILE  30          2HG1      ILE  30   0.165   2.880   6.797
  255   1HG2  ILE  30          1HG2      ILE  30  -0.869   7.015   6.153
  256   2HG2  ILE  30          2HG2      ILE  30   0.170   6.182   4.978
  257   3HG2  ILE  30          3HG2      ILE  30  -1.550   5.789   5.116
  258   1HD1  ILE  30          3HD1      ILE  30  -2.152   3.054   5.948
  259   2HD1  ILE  30          1HD1      ILE  30  -1.528   3.729   4.424
  260   3HD1  ILE  30          2HD1      ILE  30  -1.075   2.103   4.911
  261    QG1  ILE  30           QG1      ILE  30   0.478   3.286   6.089
  262    QG2  ILE  30           QG2      ILE  30  -0.750   6.329   5.416
  263    QD1  ILE  30           QD1      ILE  30  -1.585   2.962   5.094
  264    H    GLY  31           H        GLY  31   1.684   7.838   6.974
  265   1HA   GLY  31          1HA       GLY  31  -0.400   9.265   8.072
  266   2HA   GLY  31          2HA       GLY  31   0.839   9.200   9.347
  267    QA   GLY  31           QA       GLY  31   0.219   9.232   8.709
  268    H    ALA  32           H        ALA  32   0.202  11.586   8.354
  269    HA   ALA  32           HA       ALA  32   1.016  13.464   7.534
  270   1HB   ALA  32          1HB       ALA  32   2.775  12.891   9.222
  271   2HB   ALA  32          2HB       ALA  32   3.738  12.131   7.934
  272   3HB   ALA  32          3HB       ALA  32   3.430  13.880   7.901
  273    QB   ALA  32           QB       ALA  32   3.314  12.967   8.352
  274    H    ASN  33           H        ASN  33  -0.016  13.181   5.684
  275    HA   ASN  33           HA       ASN  33  -0.318  13.590   3.509
  276   1HB   ASN  33          1HB       ASN  33   2.689  13.680   3.014
  277   2HB   ASN  33          2HB       ASN  33   1.401  14.377   2.044
  278   1HD2  ASN  33          2HD2      ASN  33   2.911  16.437   5.253
  279   2HD2  ASN  33          1HD2      ASN  33   3.237  14.698   5.051
  280    QB   ASN  33           QB       ASN  33   2.045  14.029   2.529
  281    QD2  ASN  33           QD2      ASN  33   3.074  15.567   5.152
  282    H    VAL  34           H        VAL  34   1.080  10.901   4.734
  283    HA   VAL  34           HA       VAL  34   1.954   9.663   2.162
  284    HB   VAL  34           HB       VAL  34   1.730   8.505   4.933
  285   1HG1  VAL  34          3HG1      VAL  34   2.919   7.331   2.386
  286   2HG1  VAL  34          1HG1      VAL  34   3.051   6.638   4.021
  287   3HG1  VAL  34          2HG1      VAL  34   1.481   6.730   3.224
  288   1HG2  VAL  34          2HG2      VAL  34   3.521  10.260   4.577
  289   2HG2  VAL  34          3HG2      VAL  34   4.223   8.648   4.779
  290   3HG2  VAL  34          1HG2      VAL  34   4.095   9.360   3.166
  291    QG1  VAL  34           QG1      VAL  34   2.484   6.899   3.210
  292    QG2  VAL  34           QG2      VAL  34   3.947   9.423   4.174
  293    QQG  VAL  34           QQG      VAL  34   3.215   8.161   3.692
  294    H    HIS  35           H        HIS  35   0.181   9.584   0.756
  295    HA   HIS  35           HA       HIS  35  -1.778   7.486   1.386
  296   1HB   HIS  35          1HB       HIS  35  -3.707   8.688   1.025
  297   2HB   HIS  35          2HB       HIS  35  -2.837   9.630   2.234
  298    HD1  HIS  35          1HD       HIS  35  -4.863   9.871  -0.697
  299    HD2  HIS  35          2HD       HIS  35  -1.483  11.909   0.743
  300    HE1  HIS  35          1HE       HIS  35  -4.834  12.180  -1.856
  301    QB   HIS  35           QB       HIS  35  -3.272   9.159   1.629
  302    H    TRP  36           H        TRP  36   0.472   7.695  -0.442
  303    HA   TRP  36           HA       TRP  36  -1.141   6.987  -2.906
  304   1HB   TRP  36          1HB       TRP  36   1.453   8.484  -2.712
  305   2HB   TRP  36          2HB       TRP  36   0.778   7.857  -4.204
  306    HD1  TRP  36           HD       TRP  36  -0.259  10.383  -1.443
  307    HE1  TRP  36          1HE       TRP  36  -2.005  11.940  -2.338
  308    HE3  TRP  36          3HE       TRP  36  -0.782   8.294  -6.041
  309    HZ2  TRP  36          2HZ       TRP  36  -3.392  12.381  -4.908
  310    HZ3  TRP  36          3HZ       TRP  36  -2.425   9.215  -7.668
  311    HH2  TRP  36           HH       TRP  36  -3.639  11.334  -7.156
  312    QB   TRP  36           QB       TRP  36   1.115   8.170  -3.458
  313    H    MET  37           H        MET  37  -0.872   4.923  -3.249
  314    HA   MET  37           HA       MET  37   1.597   3.496  -2.342
  315   1HB   MET  37          1HB       MET  37  -0.520   2.501  -1.728
  316   2HB   MET  37          2HB       MET  37  -0.938   2.295  -3.447
  317   1HG   MET  37          1HG       MET  37   0.809   0.677  -3.729
  318   2HG   MET  37          2HG       MET  37   1.639   1.193  -2.258
  319   1HE   MET  37          2HE       MET  37  -1.579  -0.594  -3.598
  320   2HE   MET  37          3HE       MET  37  -2.298  -1.156  -2.065
  321   3HE   MET  37          1HE       MET  37  -2.238   0.576  -2.429
  322    QB   MET  37           QB       MET  37  -0.729   2.398  -2.587
  323    QG   MET  37           QG       MET  37   1.224   0.935  -2.993
  324    QE   MET  37           QE       MET  37  -2.038  -0.391  -2.697
  325    H    VAL  38           H        VAL  38   3.158   2.898  -3.877
  326    HA   VAL  38           HA       VAL  38   2.517   3.528  -6.717
  327    HB   VAL  38           HB       VAL  38   5.096   4.400  -5.375
  328   1HG1  VAL  38          1HG1      VAL  38   3.672   5.090  -7.998
  329   2HG1  VAL  38          2HG1      VAL  38   5.153   5.866  -7.427
  330   3HG1  VAL  38          3HG1      VAL  38   5.169   4.141  -7.808
  331   1HG2  VAL  38          3HG2      VAL  38   2.568   6.049  -5.868
  332   2HG2  VAL  38          1HG2      VAL  38   3.322   5.713  -4.294
  333   3HG2  VAL  38          2HG2      VAL  38   4.157   6.725  -5.469
  334    QG1  VAL  38           QG1      VAL  38   4.664   5.032  -7.744
  335    QG2  VAL  38           QG2      VAL  38   3.349   6.162  -5.210
  336    QQG  VAL  38           QQG      VAL  38   4.007   5.597  -6.477
  337    H    THR  39           H        THR  39   3.224   2.019  -8.115
  338    HA   THR  39           HA       THR  39   4.678  -0.327  -6.991
  339    HB   THR  39           HB       THR  39   2.507  -0.734  -6.357
  340    HG1  THR  39          1HG       THR  39   2.015  -1.904  -8.804
  341   1HG2  THR  39          3HG2      THR  39   1.405   0.330  -8.938
  342   2HG2  THR  39          1HG2      THR  39   0.490  -0.620  -7.749
  343   3HG2  THR  39          2HG2      THR  39   1.169   0.953  -7.287
  344    QG2  THR  39           QG2      THR  39   1.021   0.221  -7.991
  345    H    GLY  40           H        GLY  40   6.069  -1.124  -8.475
  346   1HA   GLY  40          1HA       GLY  40   5.787  -2.206 -10.808
  347   2HA   GLY  40          2HA       GLY  40   5.614  -0.521 -11.355
  348    QA   GLY  40           QA       GLY  40   5.701  -1.364 -11.082
  349    H    GLY  41           H        GLY  41   7.312  -1.026 -12.713
  350   1HA   GLY  41          1HA       GLY  41   9.474   0.330 -12.745
  351   2HA   GLY  41          2HA       GLY  41  10.046  -0.847 -11.554
  352    QA   GLY  41           QA       GLY  41   9.760  -0.258 -12.149
  353    H    SER  42           H        SER  42   9.329  -3.216 -12.174
  354    HA   SER  42           HA       SER  42  10.539  -3.970 -14.671
  355   1HB   SER  42          1HB       SER  42   9.415  -6.218 -13.865
  356   2HB   SER  42          2HB       SER  42  10.736  -5.534 -12.902
  357    HG   SER  42           HG       SER  42   7.959  -5.211 -12.413
  358    QB   SER  42           QB       SER  42  10.076  -5.876 -13.383
  359    H    THR  43           H        THR  43   9.500  -4.963 -16.426
  360    HA   THR  43           HA       THR  43   6.854  -3.876 -17.105
  361    HB   THR  43           HB       THR  43   9.193  -5.000 -18.491
  362    HG1  THR  43          1HG       THR  43   8.570  -3.580 -19.867
  363   1HG2  THR  43          1HG2      THR  43   6.511  -6.125 -19.399
  364   2HG2  THR  43          2HG2      THR  43   8.019  -6.131 -20.324
  365   3HG2  THR  43          3HG2      THR  43   7.917  -7.071 -18.841
  366    QG2  THR  43           QG2      THR  43   7.482  -6.442 -19.521
  367    H    ASP  44           H        ASP  44   8.384  -6.977 -16.240
  368    HA   ASP  44           HA       ASP  44   5.683  -8.209 -15.810
  369   1HB   ASP  44          1HB       ASP  44   7.400  -9.410 -17.233
  370   2HB   ASP  44          2HB       ASP  44   8.389  -9.599 -15.781
  371    QB   ASP  44           QB       ASP  44   7.894  -9.504 -16.507
  372    H    GLY  45           H        GLY  45   5.098  -7.229 -13.881
  373   1HA   GLY  45          1HA       GLY  45   6.915  -7.599 -11.551
  374   2HA   GLY  45          2HA       GLY  45   5.800  -6.259 -11.745
  375    QA   GLY  45           QA       GLY  45   6.357  -6.929 -11.648
  376    H    LYS  46           H        LYS  46   3.740  -8.183 -12.818
  377    HA   LYS  46           HA       LYS  46   1.818  -8.996 -12.126
  378   1HB   LYS  46          1HB       LYS  46   3.108  -9.879  -9.544
  379   2HB   LYS  46          2HB       LYS  46   1.555 -10.380 -10.245
  380   1HG   LYS  46          1HG       LYS  46   2.843 -11.397 -12.181
  381   2HG   LYS  46          2HG       LYS  46   4.339 -11.007 -11.292
  382   1HD   LYS  46          1HD       LYS  46   3.435 -12.278  -9.299
  383   2HD   LYS  46          2HD       LYS  46   2.001 -12.690 -10.239
  384   1HE   LYS  46          1HE       LYS  46   3.516 -14.554 -10.086
  385   2HE   LYS  46          2HE       LYS  46   3.329 -14.070 -11.774
  386   1HZ   LYS  46          1HZ       LYS  46   5.609 -13.331 -10.039
  387   2HZ   LYS  46          2HZ       LYS  46   5.610 -14.580 -11.092
  388   3HZ   LYS  46          3HZ       LYS  46   5.526 -13.028 -11.639
  389    QB   LYS  46           QB       LYS  46   2.332 -10.129  -9.895
  390    QG   LYS  46           QG       LYS  46   3.591 -11.202 -11.736
  391    QD   LYS  46           QD       LYS  46   2.718 -12.484  -9.769
  392    QE   LYS  46           QE       LYS  46   3.423 -14.312 -10.930
  393    QZ   LYS  46           QZ       LYS  46   5.582 -13.647 -10.923
  394    H    GLN  47           H        GLN  47   0.032  -7.882 -11.251
  395    HA   GLN  47           HA       GLN  47   0.418  -5.443 -10.020
  396   1HB   GLN  47          1HB       GLN  47  -1.927  -5.544  -9.351
  397   2HB   GLN  47          2HB       GLN  47  -1.703  -6.087 -11.029
  398   1HG   GLN  47          1HG       GLN  47  -2.294  -8.271 -10.582
  399   2HG   GLN  47          2HG       GLN  47  -1.940  -8.157  -8.854
  400   1HE2  GLN  47          2HE2      GLN  47  -5.211  -5.844  -9.735
  401   2HE2  GLN  47          1HE2      GLN  47  -3.866  -5.877 -10.881
  402    QB   GLN  47           QB       GLN  47  -1.815  -5.816 -10.190
  403    QG   GLN  47           QG       GLN  47  -2.117  -8.214  -9.718
  404    QE2  GLN  47           QE2      GLN  47  -4.539  -5.861 -10.308
  405    H    GLY  48           H        GLY  48   0.312  -4.609  -7.906
  406   1HA   GLY  48          1HA       GLY  48   1.171  -6.616  -5.878
  407   2HA   GLY  48          2HA       GLY  48   1.364  -4.869  -5.806
  408    QA   GLY  48           QA       GLY  48   1.268  -5.742  -5.842
  409    H    CYS  49           H        CYS  49  -0.192  -7.080  -4.160
  410    HA   CYS  49           HA       CYS  49  -2.550  -5.376  -3.828
  411   1HB   CYS  49          1HB       CYS  49  -2.403  -8.358  -3.386
  412   2HB   CYS  49          2HB       CYS  49  -3.799  -7.393  -3.056
  413    QB   CYS  49           QB       CYS  49  -3.101  -7.875  -3.221
  414    H    ALA  50           H        ALA  50  -3.261  -5.111  -1.866
  415    HA   ALA  50           HA       ALA  50  -1.495  -5.892   0.362
  416   1HB   ALA  50          2HB       ALA  50  -1.998  -2.992  -0.518
  417   2HB   ALA  50          3HB       ALA  50  -1.246  -3.456   1.010
  418   3HB   ALA  50          1HB       ALA  50  -0.413  -3.803  -0.520
  419    QB   ALA  50           QB       ALA  50  -1.219  -3.417  -0.009
  420    H    THR  51           H        THR  51  -2.401  -5.794   2.305
  421    HA   THR  51           HA       THR  51  -5.290  -5.092   2.401
  422    HB   THR  51           HB       THR  51  -3.578  -6.553   4.456
  423    HG1  THR  51          1HG       THR  51  -5.194  -7.457   2.309
  424   1HG2  THR  51          3HG2      THR  51  -6.608  -6.304   4.115
  425   2HG2  THR  51          1HG2      THR  51  -5.774  -7.274   5.348
  426   3HG2  THR  51          2HG2      THR  51  -5.626  -5.506   5.371
  427    QG2  THR  51           QG2      THR  51  -6.003  -6.361   4.944
  428    H    ILE  52           H        ILE  52  -5.507  -3.027   2.872
  429    HA   ILE  52           HA       ILE  52  -3.470  -1.538   4.436
  430    HB   ILE  52           HB       ILE  52  -5.843  -0.659   2.736
  431   1HG1  ILE  52          1HG1      ILE  52  -2.860  -0.496   2.145
  432   2HG1  ILE  52          2HG1      ILE  52  -4.019  -1.570   1.349
  433   1HG2  ILE  52          1HG2      ILE  52  -5.341   0.883   4.622
  434   2HG2  ILE  52          2HG2      ILE  52  -3.684   1.067   4.006
  435   3HG2  ILE  52          3HG2      ILE  52  -5.083   1.612   3.048
  436   1HD1  ILE  52          1HD1      ILE  52  -5.260   0.463   0.535
  437   2HD1  ILE  52          2HD1      ILE  52  -3.933   1.462   1.174
  438   3HD1  ILE  52          3HD1      ILE  52  -3.607   0.289  -0.096
  439    QG1  ILE  52           QG1      ILE  52  -3.439  -1.033   1.747
  440    QG2  ILE  52           QG2      ILE  52  -4.703   1.187   3.892
  441    QD1  ILE  52           QD1      ILE  52  -4.267   0.738   0.538
  442    H    TRP  53           H        TRP  53  -4.250  -0.531   6.424
  443    HA   TRP  53           HA       TRP  53  -6.831  -1.549   7.438
  444   1HB   TRP  53          1HB       TRP  53  -4.135  -1.561   8.785
  445   2HB   TRP  53          2HB       TRP  53  -5.615  -1.605   9.719
  446    HD1  TRP  53           HD       TRP  53  -7.047  -3.832   9.774
  447    HE1  TRP  53          1HE       TRP  53  -6.520  -6.267   9.182
  448    HE3  TRP  53          3HE       TRP  53  -2.668  -3.090   7.276
  449    HZ2  TRP  53          2HZ       TRP  53  -4.397  -7.718   7.857
  450    HZ3  TRP  53          3HZ       TRP  53  -1.332  -5.014   6.501
  451    HH2  TRP  53           HH       TRP  53  -2.209  -7.335   6.730
  452    QB   TRP  53           QB       TRP  53  -4.875  -1.583   9.252
  453    H    GLU  54           H        GLU  54  -7.830  -0.410   9.043
  454    HA   GLU  54           HA       GLU  54  -7.502   2.491   9.158
  455   1HB   GLU  54          1HB       GLU  54  -9.697   1.589   8.930
  456   2HB   GLU  54          2HB       GLU  54  -9.432   0.339  10.108
  457   1HG   GLU  54          1HG       GLU  54  -9.376   3.193  11.080
  458   2HG   GLU  54          2HG       GLU  54 -10.926   2.455  10.672
  459    QB   GLU  54           QB       GLU  54  -9.565   0.964   9.519
  460    QG   GLU  54           QG       GLU  54 -10.151   2.824  10.876
  461    H    GLY  55           H        GLY  55  -7.119  -0.407  11.209
  462   1HA   GLY  55          1HA       GLY  55  -6.696   1.096  13.600
  463   2HA   GLY  55          2HA       GLY  55  -6.322  -0.583  13.409
  464    QA   GLY  55           QA       GLY  55  -6.509   0.257  13.505
  465    H    SER  56           H        SER  56  -4.895   1.857  14.532
  466    HA   SER  56           HA       SER  56  -2.379   2.186  13.239
  467   1HB   SER  56          1HB       SER  56  -2.883   2.368  16.211
  468   2HB   SER  56          2HB       SER  56  -1.732   3.262  15.218
  469    HG   SER  56           HG       SER  56  -4.577   3.460  15.289
  470    QB   SER  56           QB       SER  56  -2.307   2.815  15.715
  471    H    GLY  57           H        GLY  57  -0.961   0.660  13.003
  472   1HA   GLY  57          1HA       GLY  57   0.411  -1.159  13.426
  473   2HA   GLY  57          2HA       GLY  57  -0.415  -1.388  14.959
  474    QA   GLY  57           QA       GLY  57  -0.002  -1.273  14.192
  475    H    CYS  58           H        CYS  58  -1.754  -1.232  11.689
  476    HA   CYS  58           HA       CYS  58  -3.033  -2.642  10.454
  477   1HB   CYS  58          1HB       CYS  58  -1.908  -4.694   9.751
  478   2HB   CYS  58          2HB       CYS  58  -0.859  -3.278   9.667
  479    QB   CYS  58           QB       CYS  58  -1.383  -3.986   9.709
  480    H    VAL  59           H        VAL  59  -4.375  -2.473  12.600
  481    HA   VAL  59           HA       VAL  59  -5.676  -5.080  12.935
  482    HB   VAL  59           HB       VAL  59  -6.338  -4.202  15.192
  483   1HG1  VAL  59          1HG1      VAL  59  -4.574  -5.939  14.908
  484   2HG1  VAL  59          2HG1      VAL  59  -3.354  -4.650  14.961
  485   3HG1  VAL  59          3HG1      VAL  59  -4.364  -4.968  16.374
  486   1HG2  VAL  59          2HG2      VAL  59  -4.085  -2.203  14.790
  487   2HG2  VAL  59          3HG2      VAL  59  -5.805  -1.857  15.080
  488   3HG2  VAL  59          1HG2      VAL  59  -4.824  -2.595  16.344
  489    QG1  VAL  59           QG1      VAL  59  -4.097  -5.185  15.414
  490    QG2  VAL  59           QG2      VAL  59  -4.905  -2.218  15.405
  491    QQG  VAL  59           QQG      VAL  59  -4.501  -3.702  15.410
  492    H    GLY  60           H        GLY  60  -8.027  -4.421  13.721
  493   1HA   GLY  60          1HA       GLY  60  -9.894  -3.016  13.525
  494   2HA   GLY  60          2HA       GLY  60  -8.821  -1.750  12.913
  495    QA   GLY  60           QA       GLY  60  -9.357  -2.383  13.219
  496    H    ARG  61           H        ARG  61 -10.293  -1.174  11.237
  497    HA   ARG  61           HA       ARG  61 -11.390  -3.301   9.494
  498   1HB   ARG  61          1HB       ARG  61 -12.759  -1.290  10.022
  499   2HB   ARG  61          2HB       ARG  61 -11.576  -0.264   9.191
  500   1HG   ARG  61          1HG       ARG  61 -12.010  -1.346   7.075
  501   2HG   ARG  61          2HG       ARG  61 -12.953  -2.633   7.860
  502   1HD   ARG  61          1HD       ARG  61 -14.691  -1.011   8.447
  503   2HD   ARG  61          2HD       ARG  61 -13.784   0.277   7.660
  504    HE   ARG  61           HE       ARG  61 -13.885  -1.046   5.523
  505   1HH1  ARG  61          2HH2      ARG  61 -16.540  -1.677   7.875
  506   2HH1  ARG  61          1HH2      ARG  61 -17.336  -2.751   6.751
  507   1HH2  ARG  61          2HH1      ARG  61 -14.970  -2.286   4.164
  508   2HH2  ARG  61          1HH1      ARG  61 -16.489  -3.048   4.546
  509    QB   ARG  61           QB       ARG  61 -12.168  -0.777   9.607
  510    QG   ARG  61           QG       ARG  61 -12.481  -1.989   7.468
  511    QD   ARG  61           QD       ARG  61 -14.237  -0.367   8.054
  512    QH1  ARG  61           QH2      ARG  61 -16.938  -2.214   7.313
  513    QH2  ARG  61           QH1      ARG  61 -15.729  -2.667   4.355
  514    H    SER  62           H        SER  62 -11.035  -3.548   7.240
  515    HA   SER  62           HA       SER  62  -8.636  -2.259   6.374
  516   1HB   SER  62          1HB       SER  62  -7.873  -4.674   5.473
  517   2HB   SER  62          2HB       SER  62  -7.395  -4.056   7.031
  518    HG   SER  62           HG       SER  62  -9.042  -5.234   8.009
  519    QB   SER  62           QB       SER  62  -7.634  -4.365   6.252
  520    H    THR  63           H        THR  63  -8.079  -2.742   4.085
  521    HA   THR  63           HA       THR  63 -10.345  -3.634   2.415
  522    HB   THR  63           HB       THR  63 -10.550  -1.159   2.576
  523    HG1  THR  63          1HG       THR  63 -10.300  -0.858   0.193
  524   1HG2  THR  63          2HG2      THR  63  -8.072  -0.664   2.795
  525   2HG2  THR  63          3HG2      THR  63  -7.922  -0.974   1.055
  526   3HG2  THR  63          1HG2      THR  63  -8.966   0.334   1.649
  527    QG2  THR  63           QG2      THR  63  -8.320  -0.434   1.833
  528    H    THR  64           H        THR  64  -9.549  -4.808   0.629
  529    HA   THR  64           HA       THR  64  -6.654  -5.323   0.556
  530    HB   THR  64           HB       THR  64  -8.796  -6.695  -1.077
  531    HG1  THR  64          1HG       THR  64  -8.579  -8.303   0.592
  532   1HG2  THR  64          2HG2      THR  64  -6.355  -6.889  -1.710
  533   2HG2  THR  64          3HG2      THR  64  -6.043  -7.591  -0.106
  534   3HG2  THR  64          1HG2      THR  64  -7.102  -8.420  -1.263
  535    QG2  THR  64           QG2      THR  64  -6.500  -7.633  -1.026
  536    H    MET  65           H        MET  65  -5.801  -3.532  -0.437
  537    HA   MET  65           HA       MET  65  -7.041  -2.449  -2.923
  538   1HB   MET  65          1HB       MET  65  -6.298  -0.798  -1.333
  539   2HB   MET  65          2HB       MET  65  -4.687  -1.525  -1.255
  540   1HG   MET  65          1HG       MET  65  -4.773   0.517  -2.688
  541   2HG   MET  65          2HG       MET  65  -4.212  -0.912  -3.546
  542   1HE   MET  65          3HE       MET  65  -7.080   1.681  -3.108
  543   2HE   MET  65          1HE       MET  65  -8.306   1.069  -4.241
  544   3HE   MET  65          2HE       MET  65  -7.956   0.165  -2.751
  545    QB   MET  65           QB       MET  65  -5.492  -1.161  -1.294
  546    QG   MET  65           QG       MET  65  -4.493  -0.198  -3.117
  547    QE   MET  65           QE       MET  65  -7.781   0.971  -3.366
  548    H    CYS  66           H        CYS  66  -6.656  -3.774  -4.581
  549    HA   CYS  66           HA       CYS  66  -3.898  -4.782  -5.154
  550   1HB   CYS  66          1HB       CYS  66  -6.491  -5.316  -6.534
  551   2HB   CYS  66          2HB       CYS  66  -4.931  -5.825  -7.124
  552    QB   CYS  66           QB       CYS  66  -5.711  -5.571  -6.829
  553    H    CYS  67           H        CYS  67  -2.718  -3.791  -6.679
  554    HA   CYS  67           HA       CYS  67  -3.896  -1.782  -8.494
  555   1HB   CYS  67          1HB       CYS  67  -3.334  -0.796  -6.270
  556   2HB   CYS  67          2HB       CYS  67  -1.658  -1.275  -6.502
  557    QB   CYS  67           QB       CYS  67  -2.496  -1.036  -6.386
  558    HA   PRO  68           HA       PRO  68  -1.101  -4.081 -10.965
  559   1HB   PRO  68          1HB       PRO  68  -0.666  -2.361 -13.116
  560   2HB   PRO  68          2HB       PRO  68  -2.003  -3.515 -12.875
  561   1HG   PRO  68          1HG       PRO  68  -1.910  -0.562 -12.357
  562   2HG   PRO  68          2HG       PRO  68  -3.263  -1.496 -13.026
  563   1HD   PRO  68          1HD       PRO  68  -3.252  -0.716 -10.425
  564   2HD   PRO  68          2HD       PRO  68  -3.873  -2.326 -10.878
  565    QB   PRO  68           QB       PRO  68  -1.334  -2.938 -12.995
  566    QG   PRO  68           QG       PRO  68  -2.587  -1.029 -12.691
  567    QD   PRO  68           QD       PRO  68  -3.562  -1.521 -10.651
  568    H    ALA  69           H        ALA  69   0.978  -4.217 -12.097
  569    HA   ALA  69           HA       ALA  69   3.095  -2.749 -10.657
  570   1HB   ALA  69          1HB       ALA  69   3.482  -5.128 -11.138
  571   2HB   ALA  69          2HB       ALA  69   3.274  -4.813 -12.879
  572   3HB   ALA  69          3HB       ALA  69   4.629  -4.089 -12.002
  573    QB   ALA  69           QB       ALA  69   3.795  -4.676 -12.006
  574    H    ASN  70           H        ASN  70   3.599  -0.847 -11.383
  575    HA   ASN  70           HA       ASN  70   4.366   0.826 -12.714
  576   1HB   ASN  70          1HB       ASN  70   3.280  -0.477 -15.215
  577   2HB   ASN  70          2HB       ASN  70   4.360   0.896 -15.063
  578   1HD2  ASN  70          2HD2      ASN  70   5.835  -2.903 -14.909
  579   2HD2  ASN  70          1HD2      ASN  70   4.109  -2.585 -14.999
  580    QB   ASN  70           QB       ASN  70   3.820   0.210 -15.139
  581    QD2  ASN  70           QD2      ASN  70   4.972  -2.744 -14.954
  582    H    THR  71           H        THR  71   2.469   1.153 -11.130
  583    HA   THR  71           HA       THR  71   1.324   3.304 -12.499
  584    HB   THR  71           HB       THR  71  -0.376   1.351 -12.762
  585    HG1  THR  71          1HG       THR  71  -0.844   3.397 -13.383
  586   1HG2  THR  71          2HG2      THR  71  -0.573   0.640 -10.446
  587   2HG2  THR  71          3HG2      THR  71  -1.167   2.250  -9.968
  588   3HG2  THR  71          1HG2      THR  71  -2.120   1.269 -11.067
  589    QG2  THR  71           QG2      THR  71  -1.287   1.386 -10.494
  590    H    CYS  72           H        CYS  72  -0.232   4.379 -10.824
  591    HA   CYS  72           HA       CYS  72   1.055   4.666  -8.158
  592   1HB   CYS  72          1HB       CYS  72   1.949   6.418  -9.467
  593   2HB   CYS  72          2HB       CYS  72   0.476   6.592 -10.418
  594    QB   CYS  72           QB       CYS  72   1.213   6.505  -9.942
  595    H    CYS  73           H        CYS  73  -0.547   4.431  -6.666
  596    HA   CYS  73           HA       CYS  73  -3.393   4.550  -7.481
  597   1HB   CYS  73          1HB       CYS  73  -2.757   3.110  -5.008
  598   2HB   CYS  73          2HB       CYS  73  -3.708   2.586  -6.379
  599    QB   CYS  73           QB       CYS  73  -3.233   2.848  -5.694
  600    H    ASN  74           H        ASN  74  -4.310   6.369  -6.683
  601    HA   ASN  74           HA       ASN  74  -3.384   7.795  -4.314
  602   1HB   ASN  74          1HB       ASN  74  -4.725   9.011  -6.003
  603   2HB   ASN  74          2HB       ASN  74  -5.983   7.781  -5.935
  604   1HD2  ASN  74          2HD2      ASN  74  -5.714  10.079  -2.546
  605   2HD2  ASN  74          1HD2      ASN  74  -4.210   9.630  -3.342
  606    QB   ASN  74           QB       ASN  74  -5.354   8.396  -5.969
  607    QD2  ASN  74           QD2      ASN  74  -4.962   9.854  -2.944
  608    H    ILE  75           H        ILE  75  -3.560   6.832  -2.298
  609    HA   ILE  75           HA       ILE  75  -5.791   5.037  -1.666
  610    HB   ILE  75           HB       ILE  75  -3.282   6.048  -0.344
  611   1HG1  ILE  75          1HG1      ILE  75  -3.026   3.727   0.209
  612   2HG1  ILE  75          2HG1      ILE  75  -4.651   3.349  -0.434
  613   1HG2  ILE  75          2HG2      ILE  75  -5.610   4.952   1.217
  614   2HG2  ILE  75          3HG2      ILE  75  -3.936   5.179   1.792
  615   3HG2  ILE  75          1HG2      ILE  75  -4.901   6.592   1.358
  616   1HD1  ILE  75          3HD1      ILE  75  -2.362   4.484  -2.043
  617   2HD1  ILE  75          1HD1      ILE  75  -2.754   2.751  -1.928
  618   3HD1  ILE  75          2HD1      ILE  75  -3.898   3.855  -2.695
  619    QG1  ILE  75           QG1      ILE  75  -3.839   3.538  -0.113
  620    QG2  ILE  75           QG2      ILE  75  -4.816   5.574   1.456
  621    QD1  ILE  75           QD1      ILE  75  -3.005   3.697  -2.222
  622    H    ASN  76           H        ASN  76  -7.719   5.838  -1.305
  623    HA   ASN  76           HA       ASN  76  -8.075   8.139   0.461
  624   1HB   ASN  76          1HB       ASN  76  -8.101   9.295  -1.711
  625   2HB   ASN  76          2HB       ASN  76  -9.269   8.120  -2.349
  626   1HD2  ASN  76          2HD2      ASN  76 -11.615  10.665  -1.405
  627   2HD2  ASN  76          1HD2      ASN  76 -10.716   9.977  -2.754
  628    QB   ASN  76           QB       ASN  76  -8.685   8.707  -2.030
  629    QD2  ASN  76           QD2      ASN  76 -11.165  10.321  -2.079
  630    H    THR  77           H        THR  77  -8.395   5.993   1.538
  631    HA   THR  77           HA       THR  77 -10.411   4.228   0.540
  632    HB   THR  77           HB       THR  77  -9.723   3.091   2.816
  633    HG1  THR  77          1HG       THR  77  -8.772   4.980   3.714
  634   1HG2  THR  77          3HG2      THR  77  -7.647   3.692   0.643
  635   2HG2  THR  77          1HG2      THR  77  -7.582   2.354   1.805
  636   3HG2  THR  77          2HG2      THR  77  -8.862   2.409   0.572
  637    QG2  THR  77           QG2      THR  77  -8.030   2.819   1.007
  638    H    GLY  78           H        GLY  78 -12.249   3.479   1.803
  639   1HA   GLY  78          1HA       GLY  78 -14.038   5.408   2.672
  640   2HA   GLY  78          2HA       GLY  78 -14.088   3.711   3.175
  641    QA   GLY  78           QA       GLY  78 -14.063   4.559   2.924
  642    H    PHE  79           H        PHE  79 -11.410   3.971   4.579
  643    HA   PHE  79           HA       PHE  79 -12.170   5.618   6.958
  644   1HB   PHE  79          1HB       PHE  79 -10.630   3.972   8.153
  645   2HB   PHE  79          2HB       PHE  79 -12.192   3.348   7.699
  646    HD1  PHE  79          1HD       PHE  79  -8.546   3.429   6.791
  647    HD2  PHE  79          2HD       PHE  79 -12.331   1.528   5.992
  648    HE1  PHE  79          1HE       PHE  79  -7.367   1.550   5.748
  649    HE2  PHE  79          2HE       PHE  79 -11.134  -0.383   4.951
  650   1HZ   PHE  79           HZ       PHE  79  -8.632  -0.409   4.918
  651    QB   PHE  79           QB       PHE  79 -11.411   3.660   7.926
  652    QG   PHE  79           QD       PHE  79 -10.439   2.479   6.391
  653    QZ   PHE  79           QE       PHE  79  -9.251   0.584   5.349
  654    QZ   PHE  79           QR       PHE  79  -9.602   1.143   5.680
  655    H    TYR  80           H        TYR  80 -10.442   6.439   8.135
  656    HA   TYR  80           HA       TYR  80  -8.483   7.498   6.322
  657   1HB   TYR  80          1HB       TYR  80  -9.283   8.951   8.093
  658   2HB   TYR  80          2HB       TYR  80  -8.698   7.834   9.327
  659    HD1  TYR  80          1HD       TYR  80  -7.344   9.623   6.267
  660    HD2  TYR  80          2HD       TYR  80  -6.589   8.231  10.270
  661    HE1  TYR  80          1HE       TYR  80  -4.933  10.107   5.985
  662    HE2  TYR  80          2HE       TYR  80  -4.188   8.806  10.015
  663    HH   TYR  80           HH       TYR  80  -2.793   9.817   6.918
  664    QB   TYR  80           QB       TYR  80  -8.991   8.393   8.710
  665    QG   TYR  80           QD       TYR  80  -6.966   8.927   8.269
  666    QZ   TYR  80           QE       TYR  80  -4.560   9.456   8.000
  667    QR   TYR  80           QR       TYR  80  -5.763   9.192   8.134
  668    H    ILE  81           H        ILE  81  -6.239   6.971   6.348
  669    HA   ILE  81           HA       ILE  81  -5.937   4.115   6.825
  670    HB   ILE  81           HB       ILE  81  -3.678   4.912   5.514
  671   1HG1  ILE  81          1HG1      ILE  81  -4.571   7.289   5.320
  672   2HG1  ILE  81          2HG1      ILE  81  -4.034   6.494   3.859
  673   1HG2  ILE  81          1HG2      ILE  81  -6.332   4.008   4.420
  674   2HG2  ILE  81          2HG2      ILE  81  -4.790   3.974   3.521
  675   3HG2  ILE  81          3HG2      ILE  81  -4.976   3.048   5.021
  676   1HD1  ILE  81          3HD1      ILE  81  -7.009   6.708   4.574
  677   2HD1  ILE  81          1HD1      ILE  81  -6.116   7.763   3.478
  678   3HD1  ILE  81          2HD1      ILE  81  -6.296   6.044   3.124
  679    QG1  ILE  81           QG1      ILE  81  -4.303   6.891   4.590
  680    QG2  ILE  81           QG2      ILE  81  -5.366   3.677   4.321
  681    QD1  ILE  81           QD1      ILE  81  -6.473   6.839   3.725
  682    H    ARG  82           H        ARG  82  -4.534   3.177   8.145
  683    HA   ARG  82           HA       ARG  82  -2.645   4.894   9.754
  684   1HB   ARG  82          1HB       ARG  82  -4.611   2.748  10.487
  685   2HB   ARG  82          2HB       ARG  82  -3.099   2.822  11.354
  686   1HG   ARG  82          1HG       ARG  82  -4.733   4.033  12.580
  687   2HG   ARG  82          2HG       ARG  82  -3.398   5.070  12.062
  688   1HD   ARG  82          1HD       ARG  82  -4.735   6.122  10.364
  689   2HD   ARG  82          2HD       ARG  82  -6.063   4.974  10.551
  690    HE   ARG  82           HE       ARG  82  -5.537   7.401  12.070
  691   1HH1  ARG  82          2HH2      ARG  82  -6.928   4.165  12.397
  692   2HH1  ARG  82          1HH2      ARG  82  -7.853   4.575  13.807
  693   1HH2  ARG  82          2HH1      ARG  82  -6.922   8.029  13.604
  694   2HH2  ARG  82          1HH1      ARG  82  -8.034   6.906  14.415
  695    QB   ARG  82           QB       ARG  82  -3.855   2.785  10.920
  696    QG   ARG  82           QG       ARG  82  -4.065   4.552  12.321
  697    QD   ARG  82           QD       ARG  82  -5.399   5.548  10.458
  698    QH1  ARG  82           QH2      ARG  82  -7.390   4.370  13.102
  699    QH2  ARG  82           QH1      ARG  82  -7.478   7.468  14.009
  700    H    SER  83           H        SER  83  -3.289   1.642   8.381
  701    HA   SER  83           HA       SER  83  -0.332   1.312   8.261
  702   1HB   SER  83          1HB       SER  83  -1.897  -1.044   9.147
  703   2HB   SER  83          2HB       SER  83  -0.204  -0.648   9.429
  704    HG   SER  83           HG       SER  83  -2.518   0.417  10.735
  705    QB   SER  83           QB       SER  83  -1.051  -0.846   9.288
  706    H    TYR  84           H        TYR  84   0.405  -0.588   6.884
  707    HA   TYR  84           HA       TYR  84  -1.653  -2.073   5.549
  708   1HB   TYR  84          1HB       TYR  84  -1.261  -1.641   3.338
  709   2HB   TYR  84          2HB       TYR  84  -1.355  -0.026   4.007
  710    HD1  TYR  84          1HD       TYR  84   1.160   0.905   4.765
  711    HD2  TYR  84          2HD       TYR  84   0.346  -2.059   1.739
  712    HE1  TYR  84          1HE       TYR  84   3.268   1.483   3.603
  713    HE2  TYR  84          2HE       TYR  84   2.436  -1.448   0.579
  714    HH   TYR  84           HH       TYR  84   4.631   1.110   1.755
  715    QB   TYR  84           QB       TYR  84  -1.308  -0.834   3.673
  716    QG   TYR  84           QD       TYR  84   0.753  -0.577   3.252
  717    QZ   TYR  84           QE       TYR  84   2.852   0.018   2.091
  718    QR   TYR  84           QR       TYR  84   1.802  -0.280   2.672
  719    H    ARG  85           H        ARG  85  -0.861  -3.985   4.422
  720    HA   ARG  85           HA       ARG  85   2.046  -4.480   4.384
  721   1HB   ARG  85          1HB       ARG  85  -0.246  -6.219   5.464
  722   2HB   ARG  85          2HB       ARG  85   1.025  -6.907   4.740
  723   1HG   ARG  85          1HG       ARG  85   2.646  -6.288   6.282
  724   2HG   ARG  85          2HG       ARG  85   1.800  -4.817   6.716
  725   1HD   ARG  85          1HD       ARG  85   1.774  -6.255   8.602
  726   2HD   ARG  85          2HD       ARG  85   0.171  -5.932   7.945
  727    HE   ARG  85           HE       ARG  85   1.224  -8.462   6.956
  728   1HH1  ARG  85          2HH2      ARG  85  -0.370  -6.903   9.674
  729   2HH1  ARG  85          1HH2      ARG  85  -1.078  -8.348  10.288
  730   1HH2  ARG  85          2HH1      ARG  85   0.880 -10.430   8.092
  731   2HH2  ARG  85          1HH1      ARG  85   0.150 -10.397   9.668
  732    QB   ARG  85           QB       ARG  85   0.390  -6.563   5.102
  733    QG   ARG  85           QG       ARG  85   2.223  -5.553   6.499
  734    QD   ARG  85           QD       ARG  85   0.973  -6.094   8.274
  735    QH1  ARG  85           QH2      ARG  85  -0.724  -7.625   9.981
  736    QH2  ARG  85           QH1      ARG  85   0.515 -10.413   8.880
  737    H    ARG  86           H        ARG  86   2.623  -5.686   2.510
  738    HA   ARG  86           HA       ARG  86   0.570  -5.870   0.404
  739   1HB   ARG  86          1HB       ARG  86   2.185  -6.711  -1.059
  740   2HB   ARG  86          2HB       ARG  86   2.689  -5.156  -0.351
  741   1HG   ARG  86          1HG       ARG  86   4.282  -6.278   1.031
  742   2HG   ARG  86          2HG       ARG  86   3.669  -7.880   0.603
  743   1HD   ARG  86          1HD       ARG  86   5.871  -6.855  -0.556
  744   2HD   ARG  86          2HD       ARG  86   4.736  -7.982  -1.330
  745    HE   ARG  86           HE       ARG  86   4.263  -5.087  -1.673
  746   1HH1  ARG  86          2HH2      ARG  86   5.745  -7.911  -3.290
  747   2HH1  ARG  86          1HH2      ARG  86   4.518  -7.890  -4.537
  748   1HH2  ARG  86          2HH1      ARG  86   2.786  -5.198  -3.513
  749   2HH2  ARG  86          1HH1      ARG  86   3.295  -6.088  -4.903
  750    QB   ARG  86           QB       ARG  86   2.437  -5.933  -0.705
  751    QG   ARG  86           QG       ARG  86   3.975  -7.079   0.817
  752    QD   ARG  86           QD       ARG  86   5.304  -7.419  -0.943
  753    QH1  ARG  86           QH2      ARG  86   5.131  -7.901  -3.913
  754    QH2  ARG  86           QH1      ARG  86   3.041  -5.643  -4.208
  755    H    VAL  87           H        VAL  87  -0.019  -7.849  -0.495
  756    HA   VAL  87           HA       VAL  87   0.699 -10.361   0.914
  757    HB   VAL  87           HB       VAL  87  -1.443 -11.295   0.259
  758   1HG1  VAL  87          1HG1      VAL  87  -1.163 -10.253   2.504
  759   2HG1  VAL  87          2HG1      VAL  87  -1.817  -8.727   1.869
  760   3HG1  VAL  87          3HG1      VAL  87  -2.838 -10.180   1.918
  761   1HG2  VAL  87          3HG2      VAL  87  -1.979  -9.866  -1.691
  762   2HG2  VAL  87          1HG2      VAL  87  -3.305  -9.937  -0.525
  763   3HG2  VAL  87          2HG2      VAL  87  -2.280  -8.493  -0.589
  764    QG1  VAL  87           QG1      VAL  87  -1.939  -9.720   2.097
  765    QG2  VAL  87           QG2      VAL  87  -2.521  -9.432  -0.935
  766    QQG  VAL  87           QQG      VAL  87  -2.230  -9.576   0.581
  767    H    GLU  88           H        GLU  88   0.665  -8.482  -2.078
  768    HA   GLU  88           HA       GLU  88   2.663 -10.134  -3.074
  769   1HB   GLU  88          1HB       GLU  88   0.023 -10.910  -4.031
  770   2HB   GLU  88          2HB       GLU  88   0.840 -10.010  -5.309
  771   1HG   GLU  88          1HG       GLU  88   2.860 -11.396  -5.043
  772   2HG   GLU  88          2HG       GLU  88   2.036 -12.443  -3.897
  773    QB   GLU  88           QB       GLU  88   0.431 -10.460  -4.670
  774    QG   GLU  88           QG       GLU  88   2.448 -11.920  -4.470
   
  No H/Q in entry =         774
  Start of MODEL    3
    1   1HA   GLY   1          1HA       GLY   1  12.645  -8.258 -11.852
    2   2HA   GLY   1          2HA       GLY   1  14.052  -8.984 -11.088
    3    QA   GLY   1           QA       GLY   1  13.348  -8.621 -11.470
    4    H    ASP   2           H        ASP   2  14.512  -5.569 -10.993
    5    HA   ASP   2           HA       ASP   2  14.369  -5.740  -8.125
    6   1HB   ASP   2          1HB       ASP   2  14.790  -3.248  -9.789
    7   2HB   ASP   2          2HB       ASP   2  15.287  -3.534  -8.136
    8    QB   ASP   2           QB       ASP   2  15.038  -3.391  -8.962
    9    H    GLY   3           H        GLY   3  11.847  -6.250  -8.437
   10   1HA   GLY   3          1HA       GLY   3  10.223  -3.874  -8.913
   11   2HA   GLY   3          2HA       GLY   3   9.596  -5.403  -8.400
   12    QA   GLY   3           QA       GLY   3   9.910  -4.638  -8.656
   13    H    TYR   4           H        TYR   4   9.330  -2.640  -7.586
   14    HA   TYR   4           HA       TYR   4   9.729  -2.910  -4.616
   15   1HB   TYR   4          1HB       TYR   4   9.525  -0.395  -4.546
   16   2HB   TYR   4          2HB       TYR   4  11.018  -1.031  -5.146
   17    HD1  TYR   4          2HD       TYR   4  11.553  -0.783  -7.650
   18    HD2  TYR   4          1HD       TYR   4   7.882   0.724  -5.963
   19    HE1  TYR   4          2HE       TYR   4  11.016   0.352  -9.794
   20    HE2  TYR   4          1HE       TYR   4   7.367   1.853  -8.092
   21    HH   TYR   4           HH       TYR   4   8.005   2.259 -10.174
   22    QB   TYR   4           QB       TYR   4  10.272  -0.713  -4.846
   23    QG   TYR   4           QD       TYR   4   9.717  -0.029  -6.807
   24    QZ   TYR   4           QE       TYR   4   9.192   1.102  -8.943
   25    QR   TYR   4           QR       TYR   4   9.455   0.536  -7.875
   26    H    LEU   5           H        LEU   5   8.129  -2.020  -3.460
   27    HA   LEU   5           HA       LEU   5   5.786  -0.878  -4.743
   28   1HB   LEU   5          1HB       LEU   5   5.133  -3.256  -4.483
   29   2HB   LEU   5          2HB       LEU   5   5.328  -3.112  -2.730
   30    HG   LEU   5           HG       LEU   5   3.592  -1.127  -4.257
   31   1HD1  LEU   5          3HD1      LEU   5   2.950  -3.458  -4.942
   32   2HD1  LEU   5          1HD1      LEU   5   2.493  -3.745  -3.248
   33   3HD1  LEU   5          2HD1      LEU   5   1.673  -2.507  -4.200
   34   1HD2  LEU   5          1HD2      LEU   5   3.730  -2.121  -1.393
   35   2HD2  LEU   5          2HD2      LEU   5   3.782  -0.461  -1.997
   36   3HD2  LEU   5          3HD2      LEU   5   2.267  -1.365  -2.027
   37    QB   LEU   5           QB       LEU   5   5.230  -3.184  -3.606
   38    QD1  LEU   5           QD1      LEU   5   2.372  -3.237  -4.130
   39    QD2  LEU   5           QD2      LEU   5   3.260  -1.316  -1.806
   40    QQD  LEU   5           QQD      LEU   5   2.816  -2.276  -2.968
   41    H    ILE   6           H        ILE   6   6.133   1.049  -3.910
   42    HA   ILE   6           HA       ILE   6   6.490   1.368  -0.979
   43    HB   ILE   6           HB       ILE   6   7.786   3.445  -1.626
   44   1HG1  ILE   6          1HG1      ILE   6   8.690   2.083  -4.135
   45   2HG1  ILE   6          2HG1      ILE   6   7.178   3.011  -4.215
   46   1HG2  ILE   6          3HG2      ILE   6   9.053   0.721  -2.122
   47   2HG2  ILE   6          1HG2      ILE   6   9.928   2.225  -1.784
   48   3HG2  ILE   6          2HG2      ILE   6   8.829   1.539  -0.562
   49   1HD1  ILE   6          1HD1      ILE   6   9.632   4.229  -2.959
   50   2HD1  ILE   6          2HD1      ILE   6   9.389   4.274  -4.712
   51   3HD1  ILE   6          3HD1      ILE   6   8.199   5.024  -3.627
   52    QG1  ILE   6           QG1      ILE   6   7.934   2.547  -4.175
   53    QG2  ILE   6           QG2      ILE   6   9.270   1.495  -1.489
   54    QD1  ILE   6           QD1      ILE   6   9.073   4.509  -3.766
   55    H    MET   7           H        MET   7   5.904   3.642  -0.419
   56    HA   MET   7           HA       MET   7   3.663   4.619  -2.052
   57   1HB   MET   7          1HB       MET   7   2.474   4.781   0.342
   58   2HB   MET   7          2HB       MET   7   2.446   3.355  -0.688
   59   1HG   MET   7          1HG       MET   7   4.238   2.293   0.639
   60   2HG   MET   7          2HG       MET   7   4.258   3.699   1.705
   61   1HE   MET   7          1HE       MET   7   2.265   0.753   0.190
   62   2HE   MET   7          2HE       MET   7   0.818   0.636   1.219
   63   3HE   MET   7          3HE       MET   7   0.964   1.972   0.082
   64    QB   MET   7           QB       MET   7   2.460   4.068  -0.173
   65    QG   MET   7           QG       MET   7   4.248   2.996   1.172
   66    QE   MET   7           QE       MET   7   1.349   1.120   0.497
   67    H    CYS   8           H        CYS   8   3.068   6.671  -1.867
   68    HA   CYS   8           HA       CYS   8   5.342   8.417  -1.078
   69   1HB   CYS   8          1HB       CYS   8   3.723   8.389  -3.618
   70   2HB   CYS   8          2HB       CYS   8   5.051   9.491  -3.283
   71    QB   CYS   8           QB       CYS   8   4.387   8.940  -3.451
   72    H    LYS   9           H        LYS   9   4.810  10.695  -1.370
   73    HA   LYS   9           HA       LYS   9   2.542  11.325   0.347
   74   1HB   LYS   9          1HB       LYS   9   4.340  13.415  -0.928
   75   2HB   LYS   9          2HB       LYS   9   3.595  13.394   0.678
   76   1HG   LYS   9          1HG       LYS   9   5.203  11.428   1.205
   77   2HG   LYS   9          2HG       LYS   9   6.043  11.839  -0.291
   78   1HD   LYS   9          1HD       LYS   9   5.719  13.619   2.154
   79   2HD   LYS   9          2HD       LYS   9   7.155  12.745   1.651
   80   1HE   LYS   9          1HE       LYS   9   6.841  14.197  -0.615
   81   2HE   LYS   9          2HE       LYS   9   5.928  15.239   0.478
   82   1HZ   LYS   9          1HZ       LYS   9   8.029  15.138   1.917
   83   2HZ   LYS   9          2HZ       LYS   9   8.796  14.570   0.591
   84   3HZ   LYS   9          3HZ       LYS   9   8.073  16.027   0.517
   85    QB   LYS   9           QB       LYS   9   3.968  13.404  -0.125
   86    QG   LYS   9           QG       LYS   9   5.623  11.634   0.457
   87    QD   LYS   9           QD       LYS   9   6.437  13.182   1.902
   88    QE   LYS   9           QE       LYS   9   6.384  14.718  -0.068
   89    QZ   LYS   9           QZ       LYS   9   8.300  15.245   1.008
   90    H    ASN  10           H        ASN  10   3.551  11.598  -3.021
   91    HA   ASN  10           HA       ASN  10   0.949  12.706  -3.930
   92   1HB   ASN  10          1HB       ASN  10   2.210  14.071  -5.533
   93   2HB   ASN  10          2HB       ASN  10   2.772  14.464  -3.923
   94   1HD2  ASN  10          2HD2      ASN  10   5.640  13.444  -6.387
   95   2HD2  ASN  10          1HD2      ASN  10   4.242  14.457  -6.740
   96    QB   ASN  10           QB       ASN  10   2.491  14.267  -4.728
   97    QD2  ASN  10           QD2      ASN  10   4.941  13.950  -6.564
   98    H    CYS  11           H        CYS  11   1.612  12.491  -6.670
   99    HA   CYS  11           HA       CYS  11   1.479   9.517  -6.850
  100   1HB   CYS  11          1HB       CYS  11  -0.352  10.950  -7.700
  101   2HB   CYS  11          2HB       CYS  11   0.803  11.756  -8.765
  102    QB   CYS  11           QB       CYS  11   0.226  11.353  -8.232
  103    H    ASP  12           H        ASP  12   3.887  11.725  -7.116
  104    HA   ASP  12           HA       ASP  12   5.348  10.194  -9.212
  105   1HB   ASP  12          1HB       ASP  12   4.885  12.437  -9.939
  106   2HB   ASP  12          2HB       ASP  12   5.532  13.109  -8.437
  107    QB   ASP  12           QB       ASP  12   5.208  12.773  -9.188
  108    HA   PRO  13           HA       PRO  13   8.030   9.587  -5.537
  109   1HB   PRO  13          1HB       PRO  13   9.883   7.898  -6.762
  110   2HB   PRO  13          2HB       PRO  13   8.376   7.346  -6.000
  111   1HG   PRO  13          1HG       PRO  13   8.890   7.858  -8.907
  112   2HG   PRO  13          2HG       PRO  13   7.953   6.531  -8.170
  113   1HD   PRO  13          1HD       PRO  13   6.765   8.653  -9.293
  114   2HD   PRO  13          2HD       PRO  13   6.084   7.944  -7.800
  115    QB   PRO  13           QB       PRO  13   9.129   7.622  -6.381
  116    QG   PRO  13           QG       PRO  13   8.421   7.195  -8.539
  117    QD   PRO  13           QD       PRO  13   6.424   8.298  -8.546
  118    H    ASN  14           H        ASN  14   8.809  10.816  -8.809
  119    HA   ASN  14           HA       ASN  14  11.518  11.384  -8.161
  120   1HB   ASN  14          1HB       ASN  14  10.378  11.428 -10.489
  121   2HB   ASN  14          2HB       ASN  14  10.003  13.112 -10.103
  122   1HD2  ASN  14          2HD2      ASN  14  13.839  13.515  -9.706
  123   2HD2  ASN  14          1HD2      ASN  14  12.542  13.612  -8.540
  124    QB   ASN  14           QB       ASN  14  10.191  12.270 -10.296
  125    QD2  ASN  14           QD2      ASN  14  13.191  13.564  -9.123
  126    H    THR  15           H        THR  15   8.556  13.358  -7.961
  127    HA   THR  15           HA       THR  15   9.951  15.261  -6.137
  128    HB   THR  15           HB       THR  15   7.949  16.697  -6.556
  129    HG1  THR  15          1HG       THR  15   7.311  14.679  -8.472
  130   1HG2  THR  15          1HG2      THR  15   9.954  16.916  -7.992
  131   2HG2  THR  15          2HG2      THR  15   9.281  15.697  -9.102
  132   3HG2  THR  15          3HG2      THR  15   8.473  17.251  -8.900
  133    QG2  THR  15           QG2      THR  15   9.236  16.621  -8.665
  134    H    GLY  16           H        GLY  16   8.552  12.452  -5.633
  135   1HA   GLY  16          1HA       GLY  16   7.205  13.274  -3.116
  136   2HA   GLY  16          2HA       GLY  16   6.901  11.777  -3.948
  137    QA   GLY  16           QA       GLY  16   7.053  12.525  -3.532
  138    H    SER  17           H        SER  17   8.493  13.067  -1.506
  139    HA   SER  17           HA       SER  17  10.635  11.121  -1.244
  140   1HB   SER  17          1HB       SER  17   9.548  12.384   1.230
  141   2HB   SER  17          2HB       SER  17  11.199  12.184   0.626
  142    HG   SER  17           HG       SER  17  10.895  13.853  -0.795
  143    QB   SER  17           QB       SER  17  10.373  12.284   0.928
  144    H    CYS  18           H        CYS  18   9.792   9.057  -1.507
  145    HA   CYS  18           HA       CYS  18   7.232   8.346  -0.289
  146   1HB   CYS  18          1HB       CYS  18   9.197   6.735  -1.950
  147   2HB   CYS  18          2HB       CYS  18   7.535   6.283  -1.645
  148    QB   CYS  18           QB       CYS  18   8.366   6.509  -1.797
  149    H    ASP  19           H        ASP  19   7.191   5.949   0.663
  150    HA   ASP  19           HA       ASP  19   9.318   5.706   2.670
  151   1HB   ASP  19          1HB       ASP  19   8.135   4.060   3.633
  152   2HB   ASP  19          2HB       ASP  19   6.764   4.812   2.809
  153    QB   ASP  19           QB       ASP  19   7.449   4.436   3.221
  154    H    TRP  20           H        TRP  20  10.518   3.682   2.564
  155    HA   TRP  20           HA       TRP  20  10.845   2.166   0.182
  156   1HB   TRP  20          1HB       TRP  20  13.148   3.961   1.020
  157   2HB   TRP  20          2HB       TRP  20  13.292   2.568  -0.041
  158    HD1  TRP  20           HD       TRP  20  12.099   6.192   0.010
  159    HE1  TRP  20          1HE       TRP  20  11.787   7.050  -2.372
  160    HE3  TRP  20          3HE       TRP  20  12.708   1.771  -2.487
  161    HZ2  TRP  20          2HZ       TRP  20  11.844   5.944  -5.064
  162    HZ3  TRP  20          3HZ       TRP  20  12.544   1.697  -4.960
  163    HH2  TRP  20           HH       TRP  20  12.150   3.780  -6.256
  164    QB   TRP  20           QB       TRP  20  13.220   3.264   0.490
  165    H    LYS  21           H        LYS  21   9.758   1.423   2.366
  166    HA   LYS  21           HA       LYS  21  11.802   0.323   4.266
  167   1HB   LYS  21          1HB       LYS  21   9.192   1.770   4.595
  168   2HB   LYS  21          2HB       LYS  21   9.365   0.325   5.565
  169   1HG   LYS  21          1HG       LYS  21  10.089   2.207   6.836
  170   2HG   LYS  21          2HG       LYS  21  11.490   1.154   6.535
  171   1HD   LYS  21          1HD       LYS  21  12.256   2.667   4.727
  172   2HD   LYS  21          2HD       LYS  21  10.730   3.542   4.792
  173   1HE   LYS  21          1HE       LYS  21  12.418   4.882   5.803
  174   2HE   LYS  21          2HE       LYS  21  11.295   4.407   7.074
  175   1HZ   LYS  21          1HZ       LYS  21  13.834   2.984   6.546
  176   2HZ   LYS  21          2HZ       LYS  21  13.772   4.298   7.499
  177   3HZ   LYS  21          3HZ       LYS  21  12.928   2.975   7.941
  178    QB   LYS  21           QB       LYS  21   9.278   1.047   5.080
  179    QG   LYS  21           QG       LYS  21  10.789   1.680   6.685
  180    QD   LYS  21           QD       LYS  21  11.493   3.105   4.759
  181    QE   LYS  21           QE       LYS  21  11.857   4.645   6.438
  182    QZ   LYS  21           QZ       LYS  21  13.511   3.419   7.329
  183    H    GLN  22           H        GLN  22  10.667  -1.582   5.474
  184    HA   GLN  22           HA       GLN  22  10.400  -3.700   3.570
  185   1HB   GLN  22          1HB       GLN  22  11.294  -3.735   5.972
  186   2HB   GLN  22          2HB       GLN  22   9.603  -3.686   6.513
  187   1HG   GLN  22          1HG       GLN  22   9.211  -5.826   5.301
  188   2HG   GLN  22          2HG       GLN  22  10.885  -5.770   4.696
  189   1HE2  GLN  22          2HE2      GLN  22  10.607  -6.373   8.764
  190   2HE2  GLN  22          1HE2      GLN  22   9.761  -5.026   8.054
  191    QB   GLN  22           QB       GLN  22  10.448  -3.710   6.242
  192    QG   GLN  22           QG       GLN  22  10.048  -5.798   4.998
  193    QE2  GLN  22           QE2      GLN  22  10.184  -5.700   8.409
  194    H    ASN  23           H        ASN  23   8.466  -5.034   3.208
  195    HA   ASN  23           HA       ASN  23   5.880  -3.917   4.085
  196   1HB   ASN  23          1HB       ASN  23   4.913  -3.633   1.896
  197   2HB   ASN  23          2HB       ASN  23   6.262  -2.552   2.191
  198   1HD2  ASN  23          2HD2      ASN  23   8.333  -3.826  -0.402
  199   2HD2  ASN  23          1HD2      ASN  23   8.377  -3.043   1.157
  200    QB   ASN  23           QB       ASN  23   5.587  -3.093   2.043
  201    QD2  ASN  23           QD2      ASN  23   8.355  -3.434   0.378
  202    H    TRP  24           H        TRP  24   7.653  -6.704   3.013
  203    HA   TRP  24           HA       TRP  24   5.160  -8.279   2.669
  204   1HB   TRP  24          1HB       TRP  24   7.952  -8.257   1.500
  205   2HB   TRP  24          2HB       TRP  24   7.286  -9.824   1.808
  206    HD1  TRP  24           HD       TRP  24   7.426  -7.409  -0.793
  207    HE1  TRP  24          1HE       TRP  24   5.729  -8.023  -2.668
  208    HE3  TRP  24          3HE       TRP  24   4.503 -10.644   1.831
  209    HZ2  TRP  24          2HZ       TRP  24   3.237  -9.544  -2.842
  210    HZ3  TRP  24          3HZ       TRP  24   2.392 -11.523   0.880
  211    HH2  TRP  24           HH       TRP  24   1.768 -10.985  -1.443
  212    QB   TRP  24           QB       TRP  24   7.619  -9.041   1.654
  213    H    ASN  25           H        ASN  25   6.124  -7.362   5.210
  214    HA   ASN  25           HA       ASN  25   7.029  -9.941   6.442
  215   1HB   ASN  25          1HB       ASN  25   8.925  -8.354   5.857
  216   2HB   ASN  25          2HB       ASN  25   8.227  -7.221   7.028
  217   1HD2  ASN  25          2HD2      ASN  25   9.616  -9.021   9.795
  218   2HD2  ASN  25          1HD2      ASN  25   8.938  -7.512   9.200
  219    QB   ASN  25           QB       ASN  25   8.576  -7.788   6.442
  220    QD2  ASN  25           QD2      ASN  25   9.277  -8.266   9.497
  221    H    THR  26           H        THR  26   4.445  -8.745   6.403
  222    HA   THR  26           HA       THR  26   2.880  -9.137   8.077
  223    HB   THR  26           HB       THR  26   4.966  -9.754   9.677
  224    HG1  THR  26          1HG       THR  26   3.277 -10.751  10.173
  225   1HG2  THR  26          2HG2      THR  26   5.136  -7.203  10.442
  226   2HG2  THR  26          3HG2      THR  26   3.671  -7.581  11.339
  227   3HG2  THR  26          1HG2      THR  26   5.143  -8.512  11.624
  228    QG2  THR  26           QG2      THR  26   4.650  -7.765  11.135
  229    H    CYS  27           H        CYS  27   1.959  -7.549   9.861
  230    HA   CYS  27           HA       CYS  27   1.128  -5.132   8.736
  231   1HB   CYS  27          1HB       CYS  27  -0.046  -6.149  10.444
  232   2HB   CYS  27          2HB       CYS  27   1.347  -6.214  11.535
  233    QB   CYS  27           QB       CYS  27   0.650  -6.182  10.990
  234    H    VAL  28           H        VAL  28   2.461  -3.571   8.056
  235    HA   VAL  28           HA       VAL  28   4.634  -2.473   9.775
  236    HB   VAL  28           HB       VAL  28   4.009  -2.341   6.803
  237   1HG1  VAL  28          2HG1      VAL  28   6.135  -0.771   8.314
  238   2HG1  VAL  28          3HG1      VAL  28   6.012  -0.910   6.554
  239   3HG1  VAL  28          1HG1      VAL  28   4.741  -0.077   7.450
  240   1HG2  VAL  28          3HG2      VAL  28   5.251  -4.342   7.602
  241   2HG2  VAL  28          1HG2      VAL  28   6.265  -3.317   6.593
  242   3HG2  VAL  28          2HG2      VAL  28   6.456  -3.293   8.357
  243    QG1  VAL  28           QG1      VAL  28   5.629  -0.586   7.439
  244    QG2  VAL  28           QG2      VAL  28   5.990  -3.651   7.517
  245    QQG  VAL  28           QQG      VAL  28   5.810  -2.118   7.478
  246    H    GLY  29           H        GLY  29   4.499  -0.243  10.348
  247   1HA   GLY  29          1HA       GLY  29   1.807   0.725  10.644
  248   2HA   GLY  29          2HA       GLY  29   3.279   1.447  11.304
  249    QA   GLY  29           QA       GLY  29   2.543   1.086  10.974
  250    H    ILE  30           H        ILE  30   0.934   2.493   9.645
  251    HA   ILE  30           HA       ILE  30   2.348   3.835   7.407
  252    HB   ILE  30           HB       ILE  30  -0.181   2.141   7.390
  253   1HG1  ILE  30          1HG1      ILE  30   1.795   0.897   6.835
  254   2HG1  ILE  30          2HG1      ILE  30   0.828   1.132   5.379
  255   1HG2  ILE  30          1HG2      ILE  30   0.467   4.161   5.238
  256   2HG2  ILE  30          2HG2      ILE  30  -0.715   2.841   5.129
  257   3HG2  ILE  30          3HG2      ILE  30  -0.961   4.112   6.298
  258   1HD1  ILE  30          2HD1      ILE  30   2.394   3.112   4.825
  259   2HD1  ILE  30          3HD1      ILE  30   3.446   2.496   6.117
  260   3HD1  ILE  30          1HD1      ILE  30   3.086   1.488   4.727
  261    QG1  ILE  30           QG1      ILE  30   1.312   1.015   6.107
  262    QG2  ILE  30           QG2      ILE  30  -0.403   3.705   5.555
  263    QD1  ILE  30           QD1      ILE  30   2.975   2.366   5.223
  264    H    GLY  31           H        GLY  31   1.113   5.694   6.597
  265   1HA   GLY  31          1HA       GLY  31  -0.964   6.973   6.952
  266   2HA   GLY  31          2HA       GLY  31  -0.531   7.033   8.679
  267    QA   GLY  31           QA       GLY  31  -0.748   7.003   7.815
  268    H    ALA  32           H        ALA  32  -0.579   9.302   8.148
  269    HA   ALA  32           HA       ALA  32   0.431  11.281   7.853
  270   1HB   ALA  32          2HB       ALA  32   1.241  10.330  10.008
  271   2HB   ALA  32          3HB       ALA  32   2.653   9.644   9.169
  272   3HB   ALA  32          1HB       ALA  32   2.445  11.406   9.275
  273    QB   ALA  32           QB       ALA  32   2.113  10.460   9.484
  274    H    ASN  33           H        ASN  33   0.492  11.809   5.886
  275    HA   ASN  33           HA       ASN  33   1.320  12.607   3.971
  276   1HB   ASN  33          1HB       ASN  33   4.099  12.387   5.183
  277   2HB   ASN  33          2HB       ASN  33   3.631  13.345   3.784
  278   1HD2  ASN  33          2HD2      ASN  33   1.692  15.664   5.993
  279   2HD2  ASN  33          1HD2      ASN  33   1.222  14.622   4.667
  280    QB   ASN  33           QB       ASN  33   3.865  12.866   4.484
  281    QD2  ASN  33           QD2      ASN  33   1.457  15.143   5.330
  282    H    VAL  34           H        VAL  34   1.209   9.602   4.542
  283    HA   VAL  34           HA       VAL  34   2.444   8.998   1.858
  284    HB   VAL  34           HB       VAL  34   2.463   7.353   4.410
  285   1HG1  VAL  34          1HG1      VAL  34   3.433   6.641   1.608
  286   2HG1  VAL  34          2HG1      VAL  34   3.804   5.686   3.058
  287   3HG1  VAL  34          3HG1      VAL  34   2.134   5.821   2.498
  288   1HG2  VAL  34          3HG2      VAL  34   4.735   8.516   2.729
  289   2HG2  VAL  34          1HG2      VAL  34   4.275   9.039   4.362
  290   3HG2  VAL  34          2HG2      VAL  34   4.956   7.430   4.111
  291    QG1  VAL  34           QG1      VAL  34   3.124   6.049   2.388
  292    QG2  VAL  34           QG2      VAL  34   4.655   8.328   3.734
  293    QQG  VAL  34           QQG      VAL  34   3.890   7.189   3.061
  294    H    HIS  35           H        HIS  35   0.656   8.975   0.603
  295    HA   HIS  35           HA       HIS  35  -1.558   7.088   1.148
  296   1HB   HIS  35          1HB       HIS  35  -3.219   8.964   0.709
  297   2HB   HIS  35          2HB       HIS  35  -2.529   8.980   2.282
  298    HD1  HIS  35          1HD       HIS  35  -2.742  11.273  -0.704
  299    HD2  HIS  35          2HD       HIS  35  -0.581  10.839   2.877
  300    HE1  HIS  35          1HE       HIS  35  -1.559  13.469  -0.292
  301    QB   HIS  35           QB       HIS  35  -2.874   8.972   1.495
  302    H    TRP  36           H        TRP  36   0.658   7.470  -0.803
  303    HA   TRP  36           HA       TRP  36  -1.159   6.816  -3.055
  304   1HB   TRP  36          1HB       TRP  36   1.426   8.419  -3.134
  305   2HB   TRP  36          2HB       TRP  36   0.650   7.706  -4.548
  306    HD1  TRP  36           HD       TRP  36  -0.109  10.312  -1.794
  307    HE1  TRP  36          1HE       TRP  36  -2.067  11.783  -2.522
  308    HE3  TRP  36          3HE       TRP  36  -1.175   8.052  -6.201
  309    HZ2  TRP  36          2HZ       TRP  36  -3.686  12.149  -4.907
  310    HZ3  TRP  36          3HZ       TRP  36  -2.975   8.956  -7.700
  311    HH2  TRP  36           HH       TRP  36  -4.245  10.970  -7.033
  312    QB   TRP  36           QB       TRP  36   1.038   8.062  -3.841
  313    H    MET  37           H        MET  37  -0.516   4.846  -3.917
  314    HA   MET  37           HA       MET  37   1.988   3.552  -2.887
  315   1HB   MET  37          1HB       MET  37  -0.003   2.342  -2.310
  316   2HB   MET  37          2HB       MET  37  -0.585   2.390  -3.992
  317   1HG   MET  37          1HG       MET  37   1.377   1.014  -4.652
  318   2HG   MET  37          2HG       MET  37   1.843   0.902  -2.949
  319   1HE   MET  37          3HE       MET  37   0.342  -0.458  -1.115
  320   2HE   MET  37          1HE       MET  37  -1.104   0.498  -1.511
  321   3HE   MET  37          2HE       MET  37  -1.180  -1.272  -1.534
  322    QB   MET  37           QB       MET  37  -0.294   2.366  -3.151
  323    QG   MET  37           QG       MET  37   1.610   0.958  -3.800
  324    QE   MET  37           QE       MET  37  -0.648  -0.411  -1.387
  325    H    VAL  38           H        VAL  38   3.592   3.487  -4.439
  326    HA   VAL  38           HA       VAL  38   2.740   3.813  -7.252
  327    HB   VAL  38           HB       VAL  38   5.159   5.294  -6.227
  328   1HG1  VAL  38          3HG1      VAL  38   3.423   5.347  -8.753
  329   2HG1  VAL  38          1HG1      VAL  38   4.690   6.503  -8.434
  330   3HG1  VAL  38          2HG1      VAL  38   5.101   4.789  -8.635
  331   1HG2  VAL  38          3HG2      VAL  38   2.323   6.361  -6.637
  332   2HG2  VAL  38          1HG2      VAL  38   3.200   6.301  -5.095
  333   3HG2  VAL  38          2HG2      VAL  38   3.770   7.354  -6.394
  334    QG1  VAL  38           QG1      VAL  38   4.405   5.546  -8.607
  335    QG2  VAL  38           QG2      VAL  38   3.098   6.672  -6.042
  336    QQG  VAL  38           QQG      VAL  38   3.751   6.109  -7.325
  337    H    THR  39           H        THR  39   3.017   1.844  -7.885
  338    HA   THR  39           HA       THR  39   5.213   0.178  -6.715
  339    HB   THR  39           HB       THR  39   2.813  -0.450  -6.325
  340    HG1  THR  39          1HG       THR  39   4.106  -2.343  -7.963
  341   1HG2  THR  39          1HG2      THR  39   1.893   0.232  -8.562
  342   2HG2  THR  39          2HG2      THR  39   2.748  -1.129  -9.296
  343   3HG2  THR  39          3HG2      THR  39   1.493  -1.433  -8.092
  344    QG2  THR  39           QG2      THR  39   2.045  -0.777  -8.650
  345    H    GLY  40           H        GLY  40   6.412  -1.288  -8.197
  346   1HA   GLY  40          1HA       GLY  40   6.011  -1.602 -10.903
  347   2HA   GLY  40          2HA       GLY  40   6.926  -0.086 -10.787
  348    QA   GLY  40           QA       GLY  40   6.469  -0.844 -10.845
  349    H    GLY  41           H        GLY  41   8.481  -1.346 -12.020
  350   1HA   GLY  41          1HA       GLY  41  10.752  -1.617 -11.861
  351   2HA   GLY  41          2HA       GLY  41  10.617  -1.980 -10.147
  352    QA   GLY  41           QA       GLY  41  10.684  -1.798 -11.004
  353    H    SER  42           H        SER  42   8.469  -4.201 -11.110
  354    HA   SER  42           HA       SER  42  10.284  -6.298 -10.804
  355   1HB   SER  42          1HB       SER  42   7.612  -6.692 -12.192
  356   2HB   SER  42          2HB       SER  42   8.430  -7.667 -10.972
  357    HG   SER  42           HG       SER  42   8.001  -5.795  -9.513
  358    QB   SER  42           QB       SER  42   8.021  -7.179 -11.582
  359    H    THR  43           H        THR  43   8.401  -5.558 -13.719
  360    HA   THR  43           HA       THR  43  10.442  -6.305 -15.663
  361    HB   THR  43           HB       THR  43   8.866  -8.222 -16.398
  362    HG1  THR  43          1HG       THR  43   7.446  -8.965 -14.901
  363   1HG2  THR  43          2HG2      THR  43  11.116  -8.578 -15.221
  364   2HG2  THR  43          3HG2      THR  43  10.199  -8.822 -13.722
  365   3HG2  THR  43          1HG2      THR  43   9.951  -9.902 -15.083
  366    QG2  THR  43           QG2      THR  43  10.422  -9.100 -14.675
  367    H    ASP  44           H        ASP  44   6.991  -6.914 -15.938
  368    HA   ASP  44           HA       ASP  44   5.999  -4.280 -15.950
  369   1HB   ASP  44          1HB       ASP  44   6.852  -4.266 -18.210
  370   2HB   ASP  44          2HB       ASP  44   6.077  -5.794 -18.596
  371    QB   ASP  44           QB       ASP  44   6.465  -5.030 -18.403
  372    H    GLY  45           H        GLY  45   3.716  -4.499 -15.595
  373   1HA   GLY  45          1HA       GLY  45   1.643  -5.508 -15.573
  374   2HA   GLY  45          2HA       GLY  45   2.323  -6.822 -16.546
  375    QA   GLY  45           QA       GLY  45   1.983  -6.165 -16.060
  376    H    LYS  46           H        LYS  46   3.806  -6.029 -13.526
  377    HA   LYS  46           HA       LYS  46   2.448  -8.330 -12.158
  378   1HB   LYS  46          1HB       LYS  46   5.125  -7.123 -11.454
  379   2HB   LYS  46          2HB       LYS  46   4.257  -8.449 -10.666
  380   1HG   LYS  46          1HG       LYS  46   4.260  -9.491 -13.153
  381   2HG   LYS  46          2HG       LYS  46   5.572  -8.347 -13.405
  382   1HD   LYS  46          1HD       LYS  46   6.558 -10.420 -12.794
  383   2HD   LYS  46          2HD       LYS  46   6.728  -9.351 -11.376
  384   1HE   LYS  46          1HE       LYS  46   4.920 -10.471 -10.207
  385   2HE   LYS  46          2HE       LYS  46   4.431 -11.335 -11.679
  386   1HZ   LYS  46          1HZ       LYS  46   7.112 -11.809 -10.618
  387   2HZ   LYS  46          2HZ       LYS  46   5.838 -12.464  -9.842
  388   3HZ   LYS  46          3HZ       LYS  46   6.120 -12.793 -11.452
  389    QB   LYS  46           QB       LYS  46   4.691  -7.786 -11.060
  390    QG   LYS  46           QG       LYS  46   4.916  -8.919 -13.279
  391    QD   LYS  46           QD       LYS  46   6.643  -9.886 -12.085
  392    QE   LYS  46           QE       LYS  46   4.675 -10.903 -10.943
  393    QZ   LYS  46           QZ       LYS  46   6.357 -12.355 -10.637
  394    H    GLN  47           H        GLN  47   0.746  -7.365 -11.319
  395    HA   GLN  47           HA       GLN  47   0.623  -4.883  -9.941
  396   1HB   GLN  47          1HB       GLN  47  -1.472  -5.717  -9.056
  397   2HB   GLN  47          2HB       GLN  47  -1.332  -6.258 -10.742
  398   1HG   GLN  47          1HG       GLN  47  -0.480  -8.489  -9.824
  399   2HG   GLN  47          2HG       GLN  47  -1.015  -7.932  -8.229
  400   1HE2  GLN  47          2HE2      GLN  47  -4.464  -7.576  -9.941
  401   2HE2  GLN  47          1HE2      GLN  47  -3.358  -6.437  -9.195
  402    QB   GLN  47           QB       GLN  47  -1.402  -5.988  -9.899
  403    QG   GLN  47           QG       GLN  47  -0.748  -8.210  -9.027
  404    QE2  GLN  47           QE2      GLN  47  -3.911  -7.007  -9.568
  405    H    GLY  48           H        GLY  48   0.187  -4.711  -7.564
  406   1HA   GLY  48          1HA       GLY  48   1.149  -6.919  -5.891
  407   2HA   GLY  48          2HA       GLY  48   1.932  -5.363  -5.616
  408    QA   GLY  48           QA       GLY  48   1.541  -6.141  -5.754
  409    H    CYS  49           H        CYS  49  -0.298  -7.105  -4.171
  410    HA   CYS  49           HA       CYS  49  -2.007  -4.705  -3.585
  411   1HB   CYS  49          1HB       CYS  49  -2.772  -7.603  -3.238
  412   2HB   CYS  49          2HB       CYS  49  -3.809  -6.205  -3.148
  413    QB   CYS  49           QB       CYS  49  -3.291  -6.904  -3.193
  414    H    ALA  50           H        ALA  50  -2.987  -4.781  -1.425
  415    HA   ALA  50           HA       ALA  50  -1.441  -6.103   0.686
  416   1HB   ALA  50          3HB       ALA  50  -0.231  -3.910   0.116
  417   2HB   ALA  50          1HB       ALA  50  -1.728  -3.067   0.541
  418   3HB   ALA  50          2HB       ALA  50  -0.863  -4.005   1.777
  419    QB   ALA  50           QB       ALA  50  -0.941  -3.661   0.811
  420    H    THR  51           H        THR  51  -2.539  -6.225   2.607
  421    HA   THR  51           HA       THR  51  -5.345  -5.256   2.684
  422    HB   THR  51           HB       THR  51  -3.725  -6.645   4.861
  423    HG1  THR  51          1HG       THR  51  -5.380  -7.802   2.872
  424   1HG2  THR  51          3HG2      THR  51  -6.735  -6.398   4.378
  425   2HG2  THR  51          1HG2      THR  51  -5.963  -7.302   5.694
  426   3HG2  THR  51          2HG2      THR  51  -5.806  -5.538   5.625
  427    QG2  THR  51           QG2      THR  51  -6.168  -6.412   5.232
  428    H    ILE  52           H        ILE  52  -5.591  -3.173   3.460
  429    HA   ILE  52           HA       ILE  52  -3.439  -1.976   5.116
  430    HB   ILE  52           HB       ILE  52  -5.524  -0.502   3.458
  431   1HG1  ILE  52          1HG1      ILE  52  -2.608  -1.029   2.730
  432   2HG1  ILE  52          2HG1      ILE  52  -4.014  -1.737   1.925
  433   1HG2  ILE  52          2HG2      ILE  52  -4.555   0.752   5.399
  434   2HG2  ILE  52          3HG2      ILE  52  -2.928   0.473   4.732
  435   3HG2  ILE  52          1HG2      ILE  52  -4.106   1.457   3.864
  436   1HD1  ILE  52          2HD1      ILE  52  -4.768   0.548   1.272
  437   2HD1  ILE  52          3HD1      ILE  52  -3.264   1.213   1.926
  438   3HD1  ILE  52          1HD1      ILE  52  -3.184   0.080   0.598
  439    QG1  ILE  52           QG1      ILE  52  -3.311  -1.383   2.328
  440    QG2  ILE  52           QG2      ILE  52  -3.863   0.894   4.665
  441    QD1  ILE  52           QD1      ILE  52  -3.739   0.614   1.265
  442    H    TRP  53           H        TRP  53  -4.294  -0.766   6.987
  443    HA   TRP  53           HA       TRP  53  -7.093  -1.367   7.796
  444   1HB   TRP  53          1HB       TRP  53  -4.483  -1.626   9.355
  445   2HB   TRP  53          2HB       TRP  53  -6.038  -1.507  10.154
  446    HD1  TRP  53           HD       TRP  53  -7.573  -3.545  10.276
  447    HE1  TRP  53          1HE       TRP  53  -7.316  -6.022   9.767
  448    HE3  TRP  53          3HE       TRP  53  -3.146  -3.340   7.743
  449    HZ2  TRP  53          2HZ       TRP  53  -5.296  -7.759   8.555
  450    HZ3  TRP  53          3HZ       TRP  53  -2.028  -5.427   7.004
  451    HH2  TRP  53           HH       TRP  53  -3.087  -7.629   7.404
  452    QB   TRP  53           QB       TRP  53  -5.261  -1.566   9.755
  453    H    GLU  54           H        GLU  54  -7.972   0.186   9.301
  454    HA   GLU  54           HA       GLU  54  -6.858   2.873   9.135
  455   1HB   GLU  54          1HB       GLU  54  -9.312   2.242   8.949
  456   2HB   GLU  54          2HB       GLU  54  -9.218   1.665  10.617
  457   1HG   GLU  54          1HG       GLU  54  -8.381   4.157  11.123
  458   2HG   GLU  54          2HG       GLU  54  -9.184   4.507   9.600
  459    QB   GLU  54           QB       GLU  54  -9.265   1.954   9.783
  460    QG   GLU  54           QG       GLU  54  -8.782   4.332  10.362
  461    H    GLY  55           H        GLY  55  -7.144   0.250  11.569
  462   1HA   GLY  55          1HA       GLY  55  -6.663   1.857  13.869
  463   2HA   GLY  55          2HA       GLY  55  -6.441   0.109  13.737
  464    QA   GLY  55           QA       GLY  55  -6.552   0.983  13.803
  465    H    SER  56           H        SER  56  -4.750   2.151  15.078
  466    HA   SER  56           HA       SER  56  -2.300   2.370  13.526
  467   1HB   SER  56          1HB       SER  56  -2.614   2.825  16.525
  468   2HB   SER  56          2HB       SER  56  -1.515   3.632  15.400
  469    HG   SER  56           HG       SER  56  -4.252   4.036  15.917
  470    QB   SER  56           QB       SER  56  -2.064   3.228  15.962
  471    H    GLY  57           H        GLY  57  -2.750  -0.197  13.389
  472   1HA   GLY  57          1HA       GLY  57  -0.779  -1.791  14.160
  473   2HA   GLY  57          2HA       GLY  57  -1.746  -1.681  15.649
  474    QA   GLY  57           QA       GLY  57  -1.262  -1.736  14.904
  475    H    CYS  58           H        CYS  58  -2.537  -1.817  12.189
  476    HA   CYS  58           HA       CYS  58  -3.848  -3.193  10.972
  477   1HB   CYS  58          1HB       CYS  58  -3.137  -5.743  11.625
  478   2HB   CYS  58          2HB       CYS  58  -2.231  -4.639  10.633
  479    QB   CYS  58           QB       CYS  58  -2.684  -5.191  11.129
  480    H    VAL  59           H        VAL  59  -5.399  -2.241  13.136
  481    HA   VAL  59           HA       VAL  59  -7.489  -4.320  13.262
  482    HB   VAL  59           HB       VAL  59  -8.105  -3.274  15.411
  483   1HG1  VAL  59          2HG1      VAL  59  -6.995  -5.433  15.276
  484   2HG1  VAL  59          3HG1      VAL  59  -5.418  -4.645  15.301
  485   3HG1  VAL  59          1HG1      VAL  59  -6.475  -4.545  16.726
  486   1HG2  VAL  59          3HG2      VAL  59  -5.382  -1.939  15.295
  487   2HG2  VAL  59          1HG2      VAL  59  -6.983  -1.166  15.425
  488   3HG2  VAL  59          2HG2      VAL  59  -6.367  -2.157  16.746
  489    QG1  VAL  59           QG1      VAL  59  -6.296  -4.874  15.768
  490    QG2  VAL  59           QG2      VAL  59  -6.244  -1.754  15.822
  491    QQG  VAL  59           QQG      VAL  59  -6.270  -3.314  15.795
  492    H    GLY  60           H        GLY  60  -9.636  -3.078  13.859
  493   1HA   GLY  60          1HA       GLY  60 -11.145  -1.404  13.358
  494   2HA   GLY  60          2HA       GLY  60  -9.835  -0.419  12.699
  495    QA   GLY  60           QA       GLY  60 -10.490  -0.912  13.028
  496    H    ARG  61           H        ARG  61 -10.987   0.143  10.841
  497    HA   ARG  61           HA       ARG  61 -12.262  -1.876   9.102
  498   1HB   ARG  61          1HB       ARG  61 -13.023   0.583   9.528
  499   2HB   ARG  61          2HB       ARG  61 -11.673   1.059   8.485
  500   1HG   ARG  61          1HG       ARG  61 -12.674  -0.167   6.598
  501   2HG   ARG  61          2HG       ARG  61 -13.898  -0.871   7.672
  502   1HD   ARG  61          1HD       ARG  61 -14.740   1.390   8.212
  503   2HD   ARG  61          2HD       ARG  61 -13.628   2.107   7.041
  504    HE   ARG  61           HE       ARG  61 -14.848   0.518   5.339
  505   1HH1  ARG  61          2HH2      ARG  61 -16.185   2.789   7.653
  506   2HH1  ARG  61          1HH2      ARG  61 -17.844   2.535   7.236
  507   1HH2  ARG  61          2HH1      ARG  61 -17.104   0.106   4.717
  508   2HH2  ARG  61          1HH1      ARG  61 -18.286   1.272   5.278
  509    QB   ARG  61           QB       ARG  61 -12.348   0.821   9.007
  510    QG   ARG  61           QG       ARG  61 -13.286  -0.519   7.135
  511    QD   ARG  61           QD       ARG  61 -14.184   1.748   7.627
  512    QH1  ARG  61           QH2      ARG  61 -17.015   2.662   7.444
  513    QH2  ARG  61           QH1      ARG  61 -17.695   0.689   4.998
  514    H    SER  62           H        SER  62 -11.511  -2.645   7.179
  515    HA   SER  62           HA       SER  62  -8.844  -1.795   6.507
  516   1HB   SER  62          1HB       SER  62  -8.325  -4.405   6.200
  517   2HB   SER  62          2HB       SER  62  -8.083  -3.533   7.697
  518    HG   SER  62           HG       SER  62  -9.987  -5.443   7.070
  519    QB   SER  62           QB       SER  62  -8.204  -3.969   6.948
  520    H    THR  63           H        THR  63  -8.071  -2.807   4.441
  521    HA   THR  63           HA       THR  63 -10.211  -3.692   2.672
  522    HB   THR  63           HB       THR  63 -10.435  -1.241   2.577
  523    HG1  THR  63          1HG       THR  63 -10.635  -2.796   0.646
  524   1HG2  THR  63          1HG2      THR  63  -7.899  -0.744   2.814
  525   2HG2  THR  63          2HG2      THR  63  -7.763  -1.187   1.110
  526   3HG2  THR  63          3HG2      THR  63  -8.775   0.183   1.584
  527    QG2  THR  63           QG2      THR  63  -8.146  -0.582   1.836
  528    H    THR  64           H        THR  64  -9.405  -4.970   0.990
  529    HA   THR  64           HA       THR  64  -6.485  -5.327   0.687
  530    HB   THR  64           HB       THR  64  -8.828  -6.417  -0.904
  531    HG1  THR  64          1HG       THR  64  -8.598  -7.401   1.108
  532   1HG2  THR  64          3HG2      THR  64  -5.847  -7.032  -1.143
  533   2HG2  THR  64          1HG2      THR  64  -7.165  -7.907  -1.957
  534   3HG2  THR  64          2HG2      THR  64  -6.847  -6.221  -2.362
  535    QG2  THR  64           QG2      THR  64  -6.620  -7.053  -1.821
  536    H    MET  65           H        MET  65  -5.613  -3.388   0.018
  537    HA   MET  65           HA       MET  65  -6.814  -1.884  -2.269
  538   1HB   MET  65          1HB       MET  65  -5.814  -0.556  -0.454
  539   2HB   MET  65          2HB       MET  65  -4.334  -1.517  -0.576
  540   1HG   MET  65          1HG       MET  65  -3.623   0.258  -1.734
  541   2HG   MET  65          2HG       MET  65  -4.337  -0.562  -3.104
  542   1HE   MET  65          2HE       MET  65  -6.579   0.297  -4.270
  543   2HE   MET  65          3HE       MET  65  -7.517   0.158  -2.748
  544   3HE   MET  65          1HE       MET  65  -7.546   1.665  -3.674
  545    QB   MET  65           QB       MET  65  -5.074  -1.037  -0.515
  546    QG   MET  65           QG       MET  65  -3.980  -0.152  -2.419
  547    QE   MET  65           QE       MET  65  -7.214   0.707  -3.564
  548    H    CYS  66           H        CYS  66  -6.330  -2.672  -4.280
  549    HA   CYS  66           HA       CYS  66  -3.785  -4.210  -4.641
  550   1HB   CYS  66          1HB       CYS  66  -6.396  -4.249  -6.146
  551   2HB   CYS  66          2HB       CYS  66  -4.889  -4.666  -6.940
  552    QB   CYS  66           QB       CYS  66  -5.643  -4.457  -6.543
  553    H    CYS  67           H        CYS  67  -2.397  -3.491  -6.280
  554    HA   CYS  67           HA       CYS  67  -3.215  -1.092  -7.804
  555   1HB   CYS  67          1HB       CYS  67  -1.871  -0.494  -5.794
  556   2HB   CYS  67          2HB       CYS  67  -0.542  -1.476  -6.415
  557    QB   CYS  67           QB       CYS  67  -1.207  -0.985  -6.104
  558    HA   PRO  68           HA       PRO  68  -1.399  -4.052 -10.787
  559   1HB   PRO  68          1HB       PRO  68  -1.904  -2.607 -13.091
  560   2HB   PRO  68          2HB       PRO  68  -3.066  -3.651 -12.262
  561   1HG   PRO  68          1HG       PRO  68  -2.770  -0.648 -12.157
  562   2HG   PRO  68          2HG       PRO  68  -4.282  -1.589 -12.210
  563   1HD   PRO  68          1HD       PRO  68  -3.191  -0.472  -9.932
  564   2HD   PRO  68          2HD       PRO  68  -4.218  -1.937  -9.883
  565    QB   PRO  68           QB       PRO  68  -2.485  -3.129 -12.676
  566    QG   PRO  68           QG       PRO  68  -3.526  -1.118 -12.183
  567    QD   PRO  68           QD       PRO  68  -3.704  -1.204  -9.908
  568    H    ALA  69           H        ALA  69   0.077  -3.668 -12.714
  569    HA   ALA  69           HA       ALA  69   2.395  -3.023 -11.280
  570   1HB   ALA  69          3HB       ALA  69   2.044  -4.703 -13.150
  571   2HB   ALA  69          1HB       ALA  69   2.334  -3.386 -14.294
  572   3HB   ALA  69          2HB       ALA  69   3.617  -3.855 -13.152
  573    QB   ALA  69           QB       ALA  69   2.665  -3.981 -13.532
  574    H    ASN  70           H        ASN  70   4.016  -1.546 -11.515
  575    HA   ASN  70           HA       ASN  70   5.148   0.414 -12.124
  576   1HB   ASN  70          1HB       ASN  70   4.102  -0.600 -14.784
  577   2HB   ASN  70          2HB       ASN  70   5.313   0.672 -14.592
  578   1HD2  ASN  70          2HD2      ASN  70   7.984  -1.443 -13.969
  579   2HD2  ASN  70          1HD2      ASN  70   7.390   0.184 -13.648
  580    QB   ASN  70           QB       ASN  70   4.707   0.036 -14.688
  581    QD2  ASN  70           QD2      ASN  70   7.687  -0.630 -13.809
  582    H    THR  71           H        THR  71   2.994   1.323 -10.877
  583    HA   THR  71           HA       THR  71   2.202   3.647 -12.424
  584    HB   THR  71           HB       THR  71   0.665   1.731 -13.120
  585    HG1  THR  71          1HG       THR  71  -1.160   3.120 -13.040
  586   1HG2  THR  71          1HG2      THR  71   0.372   0.856 -10.757
  587   2HG2  THR  71          2HG2      THR  71  -0.708   2.229 -10.452
  588   3HG2  THR  71          3HG2      THR  71  -1.127   1.042 -11.687
  589    QG2  THR  71           QG2      THR  71  -0.488   1.375 -10.966
  590    H    CYS  72           H        CYS  72   0.327   4.646 -11.116
  591    HA   CYS  72           HA       CYS  72   1.167   4.990  -8.287
  592   1HB   CYS  72          1HB       CYS  72   1.756   7.001  -9.359
  593   2HB   CYS  72          2HB       CYS  72   0.502   6.828 -10.584
  594    QB   CYS  72           QB       CYS  72   1.129   6.915  -9.972
  595    H    CYS  73           H        CYS  73  -0.478   5.014  -6.785
  596    HA   CYS  73           HA       CYS  73  -3.290   4.504  -7.651
  597   1HB   CYS  73          1HB       CYS  73  -1.354   2.783  -6.078
  598   2HB   CYS  73          2HB       CYS  73  -3.079   2.648  -5.796
  599    QB   CYS  73           QB       CYS  73  -2.216   2.716  -5.937
  600    H    ASN  74           H        ASN  74  -4.575   5.894  -6.542
  601    HA   ASN  74           HA       ASN  74  -3.496   7.468  -4.345
  602   1HB   ASN  74          1HB       ASN  74  -5.104   8.393  -5.991
  603   2HB   ASN  74          2HB       ASN  74  -6.339   7.273  -5.431
  604   1HD2  ASN  74          2HD2      ASN  74  -6.846   9.039  -2.274
  605   2HD2  ASN  74          1HD2      ASN  74  -6.851   7.407  -2.954
  606    QB   ASN  74           QB       ASN  74  -5.721   7.833  -5.711
  607    QD2  ASN  74           QD2      ASN  74  -6.849   8.223  -2.614
  608    H    ILE  75           H        ILE  75  -3.172   6.371  -2.384
  609    HA   ILE  75           HA       ILE  75  -5.090   4.391  -1.442
  610    HB   ILE  75           HB       ILE  75  -2.446   5.543  -0.605
  611   1HG1  ILE  75          1HG1      ILE  75  -1.939   3.252  -0.196
  612   2HG1  ILE  75          2HG1      ILE  75  -3.649   2.777  -0.435
  613   1HG2  ILE  75          1HG2      ILE  75  -4.379   4.323   1.358
  614   2HG2  ILE  75          2HG2      ILE  75  -2.629   4.502   1.614
  615   3HG2  ILE  75          3HG2      ILE  75  -3.633   5.954   1.429
  616   1HD1  ILE  75          2HD1      ILE  75  -1.843   4.077  -2.466
  617   2HD1  ILE  75          3HD1      ILE  75  -2.222   2.328  -2.407
  618   3HD1  ILE  75          1HD1      ILE  75  -3.478   3.500  -2.813
  619    QG1  ILE  75           QG1      ILE  75  -2.794   3.015  -0.316
  620    QG2  ILE  75           QG2      ILE  75  -3.547   4.926   1.467
  621    QD1  ILE  75           QD1      ILE  75  -2.514   3.302  -2.562
  622    H    ASN  76           H        ASN  76  -6.753   4.723  -0.219
  623    HA   ASN  76           HA       ASN  76  -7.656   6.193   1.709
  624   1HB   ASN  76          1HB       ASN  76  -7.025   8.409   0.833
  625   2HB   ASN  76          2HB       ASN  76  -7.859   8.044  -0.705
  626   1HD2  ASN  76          2HD2      ASN  76 -10.291  10.071   1.083
  627   2HD2  ASN  76          1HD2      ASN  76  -8.947  10.153  -0.094
  628    QB   ASN  76           QB       ASN  76  -7.442   8.226   0.064
  629    QD2  ASN  76           QD2      ASN  76  -9.619  10.112   0.494
  630    H    THR  77           H        THR  77  -9.382   4.897   1.883
  631    HA   THR  77           HA       THR  77 -10.865   4.091  -0.596
  632    HB   THR  77           HB       THR  77  -9.572   2.713   1.587
  633    HG1  THR  77          1HG       THR  77 -10.521   2.215  -0.992
  634   1HG2  THR  77          2HG2      THR  77 -11.767   2.519   2.639
  635   2HG2  THR  77          3HG2      THR  77 -12.412   1.786   1.147
  636   3HG2  THR  77          1HG2      THR  77 -11.145   0.971   2.057
  637    QG2  THR  77           QG2      THR  77 -11.775   1.759   1.948
  638    H    GLY  78           H        GLY  78 -11.034   6.415   1.582
  639   1HA   GLY  78          1HA       GLY  78 -13.188   7.444   2.259
  640   2HA   GLY  78          2HA       GLY  78 -13.648   5.840   2.870
  641    QA   GLY  78           QA       GLY  78 -13.418   6.642   2.564
  642    H    PHE  79           H        PHE  79 -11.448   4.762   3.995
  643    HA   PHE  79           HA       PHE  79 -11.338   6.460   6.394
  644   1HB   PHE  79          1HB       PHE  79 -10.453   4.483   7.505
  645   2HB   PHE  79          2HB       PHE  79 -11.983   4.219   6.718
  646    HD1  PHE  79          2HD       PHE  79  -8.353   3.515   6.568
  647    HD2  PHE  79          1HD       PHE  79 -12.267   2.420   5.140
  648    HE1  PHE  79          2HE       PHE  79  -7.470   1.339   5.837
  649    HE2  PHE  79          1HE       PHE  79 -11.379   0.219   4.435
  650   1HZ   PHE  79           HZ       PHE  79  -8.949  -0.277   4.714
  651    QB   PHE  79           QB       PHE  79 -11.218   4.351   7.112
  652    QG   PHE  79           QD       PHE  79 -10.310   2.968   5.854
  653    QZ   PHE  79           QE       PHE  79  -9.424   0.779   5.136
  654    QZ   PHE  79           QR       PHE  79  -9.683   1.443   5.339
  655    H    TYR  80           H        TYR  80  -9.640   6.737   7.703
  656    HA   TYR  80           HA       TYR  80  -7.340   7.695   6.231
  657   1HB   TYR  80          1HB       TYR  80  -8.074   8.933   8.174
  658   2HB   TYR  80          2HB       TYR  80  -7.834   7.533   9.227
  659    HD1  TYR  80          2HD       TYR  80  -6.176  10.199   7.260
  660    HD2  TYR  80          1HD       TYR  80  -5.540   6.842   9.889
  661    HE1  TYR  80          2HE       TYR  80  -3.862  10.953   7.665
  662    HE2  TYR  80          1HE       TYR  80  -3.196   7.581  10.252
  663    HH   TYR  80           HH       TYR  80  -2.022  10.702   8.985
  664    QB   TYR  80           QB       TYR  80  -7.954   8.233   8.701
  665    QG   TYR  80           QD       TYR  80  -5.858   8.521   8.574
  666    QZ   TYR  80           QE       TYR  80  -3.529   9.267   8.958
  667    QR   TYR  80           QR       TYR  80  -4.693   8.894   8.766
  668    H    ILE  81           H        ILE  81  -5.304   6.588   6.118
  669    HA   ILE  81           HA       ILE  81  -5.621   3.728   6.640
  670    HB   ILE  81           HB       ILE  81  -3.656   3.637   5.018
  671   1HG1  ILE  81          1HG1      ILE  81  -3.611   6.309   5.108
  672   2HG1  ILE  81          2HG1      ILE  81  -3.303   5.455   3.641
  673   1HG2  ILE  81          2HG2      ILE  81  -6.570   4.209   4.267
  674   2HG2  ILE  81          3HG2      ILE  81  -5.362   3.467   3.189
  675   3HG2  ILE  81          1HG2      ILE  81  -5.857   2.657   4.670
  676   1HD1  ILE  81          1HD1      ILE  81  -6.096   6.454   4.348
  677   2HD1  ILE  81          2HD1      ILE  81  -4.909   7.358   3.393
  678   3HD1  ILE  81          3HD1      ILE  81  -5.552   5.792   2.822
  679    QG1  ILE  81           QG1      ILE  81  -3.457   5.882   4.375
  680    QG2  ILE  81           QG2      ILE  81  -5.930   3.444   4.042
  681    QD1  ILE  81           QD1      ILE  81  -5.519   6.535   3.521
  682    H    ARG  82           H        ARG  82  -4.237   2.691   8.091
  683    HA   ARG  82           HA       ARG  82  -1.956   4.253   9.118
  684   1HB   ARG  82          1HB       ARG  82  -4.335   4.442  10.274
  685   2HB   ARG  82          2HB       ARG  82  -3.763   2.977  11.110
  686   1HG   ARG  82          1HG       ARG  82  -1.872   4.136  12.012
  687   2HG   ARG  82          2HG       ARG  82  -2.077   5.505  10.896
  688   1HD   ARG  82          1HD       ARG  82  -4.265   6.020  11.865
  689   2HD   ARG  82          2HD       ARG  82  -4.068   4.703  13.048
  690    HE   ARG  82           HE       ARG  82  -1.795   6.304  13.307
  691   1HH1  ARG  82          2HH2      ARG  82  -5.338   6.714  13.608
  692   2HH1  ARG  82          1HH2      ARG  82  -5.169   8.315  14.317
  693   1HH2  ARG  82          2HH1      ARG  82  -1.697   8.374  14.435
  694   2HH2  ARG  82          1HH1      ARG  82  -3.183   9.136  14.892
  695    QB   ARG  82           QB       ARG  82  -4.049   3.710  10.692
  696    QG   ARG  82           QG       ARG  82  -1.975   4.820  11.454
  697    QD   ARG  82           QD       ARG  82  -4.167   5.361  12.457
  698    QH1  ARG  82           QH2      ARG  82  -5.253   7.515  13.963
  699    QH2  ARG  82           QH1      ARG  82  -2.440   8.755  14.663
  700    H    SER  83           H        SER  83  -3.008   1.022   8.464
  701    HA   SER  83           HA       SER  83  -0.187   0.357   8.955
  702   1HB   SER  83          1HB       SER  83  -2.121  -1.722   9.818
  703   2HB   SER  83          2HB       SER  83  -0.431  -1.524  10.241
  704    HG   SER  83           HG       SER  83  -2.512   0.219  11.206
  705    QB   SER  83           QB       SER  83  -1.276  -1.623  10.030
  706    H    TYR  84           H        TYR  84   0.393  -1.690   7.719
  707    HA   TYR  84           HA       TYR  84  -1.661  -2.770   6.048
  708   1HB   TYR  84          1HB       TYR  84  -1.099  -2.140   3.968
  709   2HB   TYR  84          2HB       TYR  84  -0.819  -0.616   4.791
  710    HD1  TYR  84          2HD       TYR  84   2.011  -1.230   5.902
  711    HD2  TYR  84          1HD       TYR  84   0.196  -1.914   2.052
  712    HE1  TYR  84          2HE       TYR  84   4.188  -0.833   4.790
  713    HE2  TYR  84          1HE       TYR  84   2.404  -1.649   0.974
  714    HH   TYR  84           HH       TYR  84   5.243  -0.413   2.730
  715    QB   TYR  84           QB       TYR  84  -0.959  -1.378   4.380
  716    QG   TYR  84           QD       TYR  84   1.104  -1.572   3.977
  717    QZ   TYR  84           QE       TYR  84   3.296  -1.241   2.882
  718    QR   TYR  84           QR       TYR  84   2.200  -1.406   3.429
  719    H    ARG  85           H        ARG  85  -1.004  -4.572   4.710
  720    HA   ARG  85           HA       ARG  85   1.732  -5.594   5.044
  721   1HB   ARG  85          1HB       ARG  85   0.409  -6.441   7.010
  722   2HB   ARG  85          2HB       ARG  85  -0.676  -7.276   5.899
  723   1HG   ARG  85          1HG       ARG  85   2.324  -7.754   6.137
  724   2HG   ARG  85          2HG       ARG  85   1.033  -8.663   6.985
  725   1HD   ARG  85          1HD       ARG  85   0.172  -8.992   4.521
  726   2HD   ARG  85          2HD       ARG  85   1.862  -8.719   4.101
  727    HE   ARG  85           HE       ARG  85   0.563 -10.934   5.593
  728   1HH1  ARG  85          2HH2      ARG  85   3.486  -9.858   3.943
  729   2HH1  ARG  85          1HH2      ARG  85   4.351 -11.345   4.251
  730   1HH2  ARG  85          2HH1      ARG  85   1.682 -12.860   5.993
  731   2HH2  ARG  85          1HH1      ARG  85   3.197 -13.159   5.176
  732    QB   ARG  85           QB       ARG  85  -0.134  -6.859   6.454
  733    QG   ARG  85           QG       ARG  85   1.678  -8.209   6.561
  734    QD   ARG  85           QD       ARG  85   1.017  -8.855   4.311
  735    QH1  ARG  85           QH2      ARG  85   3.919 -10.602   4.097
  736    QH2  ARG  85           QH1      ARG  85   2.440 -13.010   5.585
  737    H    ARG  86           H        ARG  86   2.313  -6.382   3.057
  738    HA   ARG  86           HA       ARG  86   0.662  -6.288   0.821
  739   1HB   ARG  86          1HB       ARG  86   3.131  -7.926   1.432
  740   2HB   ARG  86          2HB       ARG  86   2.465  -7.789  -0.189
  741   1HG   ARG  86          1HG       ARG  86   3.391  -5.410   1.513
  742   2HG   ARG  86          2HG       ARG  86   4.358  -6.274   0.310
  743   1HD   ARG  86          1HD       ARG  86   1.808  -4.647  -0.130
  744   2HD   ARG  86          2HD       ARG  86   3.413  -4.218  -0.659
  745    HE   ARG  86           HE       ARG  86   1.533  -6.096  -1.895
  746   1HH1  ARG  86          2HH2      ARG  86   4.976  -5.196  -1.558
  747   2HH1  ARG  86          1HH2      ARG  86   5.447  -5.871  -3.076
  748   1HH2  ARG  86          2HH1      ARG  86   2.247  -7.293  -3.800
  749   2HH2  ARG  86          1HH1      ARG  86   3.914  -7.269  -4.244
  750    QB   ARG  86           QB       ARG  86   2.798  -7.857   0.621
  751    QG   ARG  86           QG       ARG  86   3.874  -5.842   0.911
  752    QD   ARG  86           QD       ARG  86   2.610  -4.432  -0.395
  753    QH1  ARG  86           QH2      ARG  86   5.211  -5.533  -2.317
  754    QH2  ARG  86           QH1      ARG  86   3.081  -7.281  -4.022
  755    H    VAL  87           H        VAL  87  -0.518  -7.783  -0.456
  756    HA   VAL  87           HA       VAL  87  -0.674 -10.565   0.536
  757    HB   VAL  87           HB       VAL  87  -3.055 -10.687   0.110
  758   1HG1  VAL  87          2HG1      VAL  87  -2.132 -10.346   2.394
  759   2HG1  VAL  87          3HG1      VAL  87  -2.408  -8.599   2.218
  760   3HG1  VAL  87          1HG1      VAL  87  -3.774  -9.745   2.166
  761   1HG2  VAL  87          3HG2      VAL  87  -2.983  -7.657  -0.119
  762   2HG2  VAL  87          1HG2      VAL  87  -3.401  -8.807  -1.401
  763   3HG2  VAL  87          2HG2      VAL  87  -4.438  -8.654   0.029
  764    QG1  VAL  87           QG1      VAL  87  -2.771  -9.563   2.260
  765    QG2  VAL  87           QG2      VAL  87  -3.607  -8.373  -0.497
  766    QQG  VAL  87           QQG      VAL  87  -3.189  -8.968   0.881
  767    H    GLU  88           H        GLU  88  -0.008  -8.546  -2.009
  768    HA   GLU  88           HA       GLU  88   1.078  -9.275  -3.892
  769   1HB   GLU  88          1HB       GLU  88   0.763 -11.778  -3.105
  770   2HB   GLU  88          2HB       GLU  88  -0.644 -11.692  -4.186
  771   1HG   GLU  88          1HG       GLU  88   1.101 -12.631  -5.467
  772   2HG   GLU  88          2HG       GLU  88   0.954 -10.940  -5.986
  773    QB   GLU  88           QB       GLU  88   0.060 -11.735  -3.646
  774    QG   GLU  88           QG       GLU  88   1.027 -11.785  -5.726
   
  No H/Q in entry =         774
  Start of MODEL    4
    1   1HA   GLY   1          1HA       GLY   1  13.800  -3.334 -12.285
    2   2HA   GLY   1          2HA       GLY   1  14.977  -4.418 -11.495
    3    QA   GLY   1           QA       GLY   1  14.389  -3.876 -11.890
    4    H    ASP   2           H        ASP   2  13.136  -6.029 -11.886
    5    HA   ASP   2           HA       ASP   2  11.854  -7.591 -10.956
    6   1HB   ASP   2          1HB       ASP   2  13.299  -7.607  -9.091
    7   2HB   ASP   2          2HB       ASP   2  12.671  -6.090  -8.448
    8    QB   ASP   2           QB       ASP   2  12.985  -6.849  -8.769
    9    H    GLY   3           H        GLY   3  11.022  -4.813  -9.025
   10   1HA   GLY   3          1HA       GLY   3   8.581  -3.901  -9.490
   11   2HA   GLY   3          2HA       GLY   3   8.202  -5.555  -9.029
   12    QA   GLY   3           QA       GLY   3   8.392  -4.728  -9.259
   13    H    TYR   4           H        TYR   4   7.503  -3.318  -7.389
   14    HA   TYR   4           HA       TYR   4   8.272  -4.366  -4.871
   15   1HB   TYR   4          1HB       TYR   4   9.120  -2.145  -3.926
   16   2HB   TYR   4          2HB       TYR   4  10.245  -3.036  -4.910
   17    HD1  TYR   4          1HD       TYR   4   7.747  -0.226  -5.063
   18    HD2  TYR   4          2HD       TYR   4  11.355  -1.932  -6.718
   19    HE1  TYR   4          1HE       TYR   4   7.891   1.636  -6.670
   20    HE2  TYR   4          2HE       TYR   4  11.599   0.047  -8.183
   21    HH   TYR   4           HH       TYR   4   8.914   2.246  -8.747
   22    QB   TYR   4           QB       TYR   4   9.682  -2.590  -4.418
   23    QG   TYR   4           QD       TYR   4   9.551  -1.079  -5.891
   24    QZ   TYR   4           QE       TYR   4   9.745   0.842  -7.427
   25    QR   TYR   4           QR       TYR   4   9.648  -0.119  -6.659
   26    H    LEU   5           H        LEU   5   7.232  -2.849  -3.199
   27    HA   LEU   5           HA       LEU   5   4.933  -1.312  -4.195
   28   1HB   LEU   5          1HB       LEU   5   4.110  -3.561  -4.024
   29   2HB   LEU   5          2HB       LEU   5   4.699  -3.741  -2.367
   30    HG   LEU   5           HG       LEU   5   2.986  -1.375  -2.606
   31   1HD1  LEU   5          2HD1      LEU   5   1.954  -3.949  -3.842
   32   2HD1  LEU   5          3HD1      LEU   5   0.870  -2.945  -2.898
   33   3HD1  LEU   5          1HD1      LEU   5   1.668  -2.271  -4.318
   34   1HD2  LEU   5          1HD2      LEU   5   3.565  -2.765  -0.527
   35   2HD2  LEU   5          2HD2      LEU   5   1.856  -2.337  -0.732
   36   3HD2  LEU   5          3HD2      LEU   5   2.398  -3.959  -1.150
   37    QB   LEU   5           QB       LEU   5   4.405  -3.651  -3.195
   38    QD1  LEU   5           QD1      LEU   5   1.497  -3.055  -3.686
   39    QD2  LEU   5           QD2      LEU   5   2.606  -3.020  -0.803
   40    QQD  LEU   5           QQD      LEU   5   2.052  -3.038  -2.245
   41    H    ILE   6           H        ILE   6   5.078   0.538  -3.136
   42    HA   ILE   6           HA       ILE   6   5.877   0.730  -0.326
   43    HB   ILE   6           HB       ILE   6   7.222   2.759  -0.990
   44   1HG1  ILE   6          1HG1      ILE   6   8.144   1.714  -3.573
   45   2HG1  ILE   6          2HG1      ILE   6   6.433   2.135  -3.665
   46   1HG2  ILE   6          3HG2      ILE   6   8.273   0.658  -0.187
   47   2HG2  ILE   6          1HG2      ILE   6   8.562   0.184  -1.864
   48   3HG2  ILE   6          2HG2      ILE   6   9.274   1.678  -1.219
   49   1HD1  ILE   6          3HD1      ILE   6   8.573   3.969  -2.585
   50   2HD1  ILE   6          1HD1      ILE   6   7.874   4.049  -4.223
   51   3HD1  ILE   6          2HD1      ILE   6   6.851   4.332  -2.794
   52    QG1  ILE   6           QG1      ILE   6   7.289   1.925  -3.619
   53    QG2  ILE   6           QG2      ILE   6   8.703   0.840  -1.090
   54    QD1  ILE   6           QD1      ILE   6   7.766   4.116  -3.201
   55    H    MET   7           H        MET   7   4.905   2.663   0.607
   56    HA   MET   7           HA       MET   7   3.113   4.099  -1.242
   57   1HB   MET   7          1HB       MET   7   1.508   4.308   0.392
   58   2HB   MET   7          2HB       MET   7   2.060   2.625   0.391
   59   1HG   MET   7          1HG       MET   7   3.223   2.918   2.452
   60   2HG   MET   7          2HG       MET   7   2.938   4.659   2.438
   61   1HE   MET   7          1HE       MET   7   0.903   1.278   2.214
   62   2HE   MET   7          2HE       MET   7  -0.680   1.808   2.839
   63   3HE   MET   7          3HE       MET   7  -0.100   2.424   1.276
   64    QB   MET   7           QB       MET   7   1.784   3.467   0.392
   65    QG   MET   7           QG       MET   7   3.080   3.789   2.445
   66    QE   MET   7           QE       MET   7   0.041   1.837   2.110
   67    H    CYS   8           H        CYS   8   2.549   6.258  -0.673
   68    HA   CYS   8           HA       CYS   8   5.018   7.753  -0.054
   69   1HB   CYS   8          1HB       CYS   8   3.493   7.708  -2.676
   70   2HB   CYS   8          2HB       CYS   8   4.772   8.844  -2.274
   71    QB   CYS   8           QB       CYS   8   4.133   8.276  -2.475
   72    H    LYS   9           H        LYS   9   4.820   9.872   0.034
   73    HA   LYS   9           HA       LYS   9   2.357  10.787   1.231
   74   1HB   LYS   9          1HB       LYS   9   5.120  11.967   0.882
   75   2HB   LYS   9          2HB       LYS   9   3.848  12.659   1.883
   76   1HG   LYS   9          1HG       LYS   9   4.502   9.701   2.337
   77   2HG   LYS   9          2HG       LYS   9   5.722  10.838   2.802
   78   1HD   LYS   9          1HD       LYS   9   2.884  11.299   3.664
   79   2HD   LYS   9          2HD       LYS   9   3.790   9.994   4.441
   80   1HE   LYS   9          1HE       LYS   9   4.993  12.760   4.233
   81   2HE   LYS   9          2HE       LYS   9   3.933  12.348   5.573
   82   1HZ   LYS   9          3HZ       LYS   9   6.295  10.699   4.974
   83   2HZ   LYS   9          1HZ       LYS   9   6.273  12.041   5.997
   84   3HZ   LYS   9          2HZ       LYS   9   5.401  10.692   6.320
   85    QB   LYS   9           QB       LYS   9   4.484  12.313   1.383
   86    QG   LYS   9           QG       LYS   9   5.112  10.269   2.570
   87    QD   LYS   9           QD       LYS   9   3.337  10.646   4.052
   88    QE   LYS   9           QE       LYS   9   4.463  12.554   4.903
   89    QZ   LYS   9           QZ       LYS   9   5.990  11.144   5.764
   90    H    ASN  10           H        ASN  10   3.696  10.871  -1.886
   91    HA   ASN  10           HA       ASN  10   1.400  12.253  -2.870
   92   1HB   ASN  10          1HB       ASN  10   2.519  13.836  -4.362
   93   2HB   ASN  10          2HB       ASN  10   2.790  14.209  -2.683
   94   1HD2  ASN  10          2HD2      ASN  10   6.188  14.652  -3.364
   95   2HD2  ASN  10          1HD2      ASN  10   4.705  15.250  -2.614
   96    QB   ASN  10           QB       ASN  10   2.655  14.022  -3.522
   97    QD2  ASN  10           QD2      ASN  10   5.446  14.951  -2.989
   98    H    CYS  11           H        CYS  11   1.711  12.214  -5.439
   99    HA   CYS  11           HA       CYS  11   1.999   9.385  -5.971
  100   1HB   CYS  11          1HB       CYS  11   0.327  10.906  -6.960
  101   2HB   CYS  11          2HB       CYS  11   1.585  11.764  -7.831
  102    QB   CYS  11           QB       CYS  11   0.956  11.335  -7.396
  103    H    ASP  12           H        ASP  12   4.474  11.509  -5.705
  104    HA   ASP  12           HA       ASP  12   5.975  10.288  -8.006
  105   1HB   ASP  12          1HB       ASP  12   5.278  12.657  -8.313
  106   2HB   ASP  12          2HB       ASP  12   6.415  13.083  -7.022
  107    QB   ASP  12           QB       ASP  12   5.846  12.870  -7.668
  108    HA   PRO  13           HA       PRO  13   8.741   9.231  -4.499
  109   1HB   PRO  13          1HB       PRO  13  10.456   7.584  -5.907
  110   2HB   PRO  13          2HB       PRO  13   8.896   7.044  -5.211
  111   1HG   PRO  13          1HG       PRO  13   9.482   7.895  -8.055
  112   2HG   PRO  13          2HG       PRO  13   8.546   6.472  -7.504
  113   1HD   PRO  13          1HD       PRO  13   7.382   8.765  -8.326
  114   2HD   PRO  13          2HD       PRO  13   6.659   7.844  -6.973
  115    QB   PRO  13           QB       PRO  13   9.676   7.314  -5.559
  116    QG   PRO  13           QG       PRO  13   9.014   7.184  -7.780
  117    QD   PRO  13           QD       PRO  13   7.020   8.305  -7.650
  118    H    ASN  14           H        ASN  14   9.364  10.750  -7.605
  119    HA   ASN  14           HA       ASN  14  12.130  11.350  -7.177
  120   1HB   ASN  14          1HB       ASN  14  10.872  11.517  -9.327
  121   2HB   ASN  14          2HB       ASN  14  10.065  12.976  -8.727
  122   1HD2  ASN  14          2HD2      ASN  14  12.863  15.099  -9.321
  123   2HD2  ASN  14          1HD2      ASN  14  11.361  14.969  -8.462
  124    QB   ASN  14           QB       ASN  14  10.469  12.246  -9.027
  125    QD2  ASN  14           QD2      ASN  14  12.112  15.034  -8.891
  126    H    THR  15           H        THR  15   9.093  12.786  -6.001
  127    HA   THR  15           HA       THR  15  10.663  14.705  -4.370
  128    HB   THR  15           HB       THR  15  10.184  15.696  -6.593
  129    HG1  THR  15          1HG       THR  15  10.551  17.022  -4.866
  130   1HG2  THR  15          2HG2      THR  15   7.991  14.802  -7.106
  131   2HG2  THR  15          3HG2      THR  15   7.266  15.693  -5.749
  132   3HG2  THR  15          1HG2      THR  15   7.966  16.566  -7.122
  133    QG2  THR  15           QG2      THR  15   7.741  15.687  -6.659
  134    H    GLY  16           H        GLY  16   9.006  12.244  -3.871
  135   1HA   GLY  16          1HA       GLY  16   7.268  13.438  -1.773
  136   2HA   GLY  16          2HA       GLY  16   6.860  11.980  -2.694
  137    QA   GLY  16           QA       GLY  16   7.064  12.709  -2.234
  138    H    SER  17           H        SER  17   7.597  12.648   0.278
  139    HA   SER  17           HA       SER  17   9.701  10.717   0.841
  140   1HB   SER  17          1HB       SER  17   8.215  10.671   3.081
  141   2HB   SER  17          2HB       SER  17   9.399  11.931   2.725
  142    HG   SER  17           HG       SER  17   7.794  13.255   1.917
  143    QB   SER  17           QB       SER  17   8.807  11.301   2.903
  144    H    CYS  18           H        CYS  18   9.550   8.518   0.647
  145    HA   CYS  18           HA       CYS  18   6.923   7.214   0.373
  146   1HB   CYS  18          1HB       CYS  18   9.410   7.132  -1.353
  147   2HB   CYS  18          2HB       CYS  18   8.218   5.846  -1.336
  148    QB   CYS  18           QB       CYS  18   8.814   6.489  -1.345
  149    H    ASP  19           H        ASP  19   6.925   5.152   1.469
  150    HA   ASP  19           HA       ASP  19   9.379   4.810   3.097
  151   1HB   ASP  19          1HB       ASP  19   8.129   3.699   4.630
  152   2HB   ASP  19          2HB       ASP  19   7.354   5.239   4.245
  153    QB   ASP  19           QB       ASP  19   7.742   4.469   4.437
  154    H    TRP  20           H        TRP  20  10.754   3.682   2.172
  155    HA   TRP  20           HA       TRP  20  10.311   1.178   0.635
  156   1HB   TRP  20          1HB       TRP  20  12.735   3.014   0.861
  157   2HB   TRP  20          2HB       TRP  20  12.576   1.604  -0.180
  158    HD1  TRP  20           HD       TRP  20  11.586   5.251   0.072
  159    HE1  TRP  20          1HE       TRP  20  11.133   6.132  -2.268
  160    HE3  TRP  20          3HE       TRP  20  11.596   0.818  -2.448
  161    HZ2  TRP  20          2HZ       TRP  20  10.732   5.062  -4.910
  162    HZ3  TRP  20          3HZ       TRP  20  11.257   0.788  -4.894
  163    HH2  TRP  20           HH       TRP  20  10.718   2.904  -6.119
  164    QB   TRP  20           QB       TRP  20  12.656   2.309   0.340
  165    H    LYS  21           H        LYS  21   9.889   0.705   3.234
  166    HA   LYS  21           HA       LYS  21  12.385  -0.784   3.984
  167   1HB   LYS  21          1HB       LYS  21  10.484   0.570   5.684
  168   2HB   LYS  21          2HB       LYS  21  10.448  -1.165   5.995
  169   1HG   LYS  21          1HG       LYS  21  12.179  -0.095   7.367
  170   2HG   LYS  21          2HG       LYS  21  12.914  -1.195   6.201
  171   1HD   LYS  21          1HD       LYS  21  13.060   1.112   4.715
  172   2HD   LYS  21          2HD       LYS  21  12.878   1.799   6.275
  173   1HE   LYS  21          1HE       LYS  21  15.226   1.651   5.726
  174   2HE   LYS  21          2HE       LYS  21  14.958   0.481   7.019
  175   1HZ   LYS  21          3HZ       LYS  21  14.955  -0.299   4.137
  176   2HZ   LYS  21          1HZ       LYS  21  16.316  -0.200   5.035
  177   3HZ   LYS  21          2HZ       LYS  21  15.143  -1.276   5.421
  178    QB   LYS  21           QB       LYS  21  10.466  -0.298   5.840
  179    QG   LYS  21           QG       LYS  21  12.547  -0.645   6.784
  180    QD   LYS  21           QD       LYS  21  12.969   1.455   5.495
  181    QE   LYS  21           QE       LYS  21  15.092   1.066   6.373
  182    QZ   LYS  21           QZ       LYS  21  15.472  -0.592   4.864
  183    H    GLN  22           H        GLN  22  11.424  -3.043   5.023
  184    HA   GLN  22           HA       GLN  22  10.348  -4.466   2.749
  185   1HB   GLN  22          1HB       GLN  22  11.731  -5.577   4.479
  186   2HB   GLN  22          2HB       GLN  22  10.487  -5.126   5.669
  187   1HG   GLN  22          1HG       GLN  22  10.471  -7.478   5.177
  188   2HG   GLN  22          2HG       GLN  22   8.920  -6.678   4.914
  189   1HE2  GLN  22          2HE2      GLN  22   8.979  -8.753   2.009
  190   2HE2  GLN  22          1HE2      GLN  22   8.337  -8.551   3.635
  191    QB   GLN  22           QB       GLN  22  11.109  -5.352   5.074
  192    QG   GLN  22           QG       GLN  22   9.696  -7.078   5.046
  193    QE2  GLN  22           QE2      GLN  22   8.658  -8.652   2.822
  194    H    ASN  23           H        ASN  23   8.314  -5.274   2.566
  195    HA   ASN  23           HA       ASN  23   6.049  -3.848   3.941
  196   1HB   ASN  23          1HB       ASN  23   6.903  -3.556   1.038
  197   2HB   ASN  23          2HB       ASN  23   5.227  -3.294   1.533
  198   1HD2  ASN  23          2HD2      ASN  23   7.115  -0.022   1.638
  199   2HD2  ASN  23          1HD2      ASN  23   7.012  -1.279   0.418
  200    QB   ASN  23           QB       ASN  23   6.065  -3.425   1.286
  201    QD2  ASN  23           QD2      ASN  23   7.063  -0.650   1.028
  202    H    TRP  24           H        TRP  24   7.126  -6.846   2.711
  203    HA   TRP  24           HA       TRP  24   4.330  -7.736   2.269
  204   1HB   TRP  24          1HB       TRP  24   5.543  -8.343   0.359
  205   2HB   TRP  24          2HB       TRP  24   7.038  -8.558   1.227
  206    HD1  TRP  24           HD       TRP  24   7.412 -10.717   2.584
  207    HE1  TRP  24          1HE       TRP  24   6.468 -13.142   2.323
  208    HE3  TRP  24          3HE       TRP  24   3.299  -9.635  -0.143
  209    HZ2  TRP  24          2HZ       TRP  24   4.164 -14.384   1.012
  210    HZ3  TRP  24          3HZ       TRP  24   1.815 -11.385  -0.970
  211    HH2  TRP  24           HH       TRP  24   2.186 -13.743  -0.440
  212    QB   TRP  24           QB       TRP  24   6.291  -8.450   0.793
  213    H    ASN  25           H        ASN  25   3.626  -9.280   3.608
  214    HA   ASN  25           HA       ASN  25   3.356 -10.455   5.557
  215   1HB   ASN  25          1HB       ASN  25   4.916 -11.777   4.096
  216   2HB   ASN  25          2HB       ASN  25   6.267 -11.225   5.098
  217   1HD2  ASN  25          2HD2      ASN  25   3.543 -14.085   6.341
  218   2HD2  ASN  25          1HD2      ASN  25   3.202 -13.032   4.995
  219    QB   ASN  25           QB       ASN  25   5.591 -11.501   4.597
  220    QD2  ASN  25           QD2      ASN  25   3.372 -13.559   5.668
  221    H    THR  26           H        THR  26   3.669  -7.878   6.246
  222    HA   THR  26           HA       THR  26   5.135  -7.928   8.792
  223    HB   THR  26           HB       THR  26   6.726  -7.105   7.131
  224    HG1  THR  26          1HG       THR  26   6.869  -6.154   9.124
  225   1HG2  THR  26          3HG2      THR  26   4.610  -4.997   6.481
  226   2HG2  THR  26          1HG2      THR  26   6.305  -4.964   5.954
  227   3HG2  THR  26          2HG2      THR  26   5.231  -6.259   5.409
  228    QG2  THR  26           QG2      THR  26   5.382  -5.407   5.948
  229    H    CYS  27           H        CYS  27   4.656  -5.347   9.590
  230    HA   CYS  27           HA       CYS  27   1.825  -4.799   9.439
  231   1HB   CYS  27          1HB       CYS  27   2.069  -6.697  11.064
  232   2HB   CYS  27          2HB       CYS  27   3.175  -5.706  12.008
  233    QB   CYS  27           QB       CYS  27   2.622  -6.202  11.536
  234    H    VAL  28           H        VAL  28   3.080  -2.959   8.483
  235    HA   VAL  28           HA       VAL  28   4.710  -1.361  10.379
  236    HB   VAL  28           HB       VAL  28   4.531  -1.202   7.352
  237   1HG1  VAL  28          1HG1      VAL  28   6.600  -0.204   9.359
  238   2HG1  VAL  28          2HG1      VAL  28   6.720  -0.107   7.595
  239   3HG1  VAL  28          3HG1      VAL  28   5.475   0.821   8.453
  240   1HG2  VAL  28          3HG2      VAL  28   6.489  -2.748   9.105
  241   2HG2  VAL  28          1HG2      VAL  28   5.330  -3.415   7.931
  242   3HG2  VAL  28          2HG2      VAL  28   6.681  -2.435   7.362
  243    QG1  VAL  28           QG1      VAL  28   6.265   0.170   8.469
  244    QG2  VAL  28           QG2      VAL  28   6.167  -2.866   8.133
  245    QQG  VAL  28           QQG      VAL  28   6.216  -1.348   8.301
  246    H    GLY  29           H        GLY  29   3.696   0.427  11.267
  247   1HA   GLY  29          1HA       GLY  29   1.300   1.550  10.136
  248   2HA   GLY  29          2HA       GLY  29   2.133   2.140  11.549
  249    QA   GLY  29           QA       GLY  29   1.717   1.845  10.842
  250    H    ILE  30           H        ILE  30   1.118   3.251   8.860
  251    HA   ILE  30           HA       ILE  30   3.310   5.185   8.273
  252    HB   ILE  30           HB       ILE  30   1.368   4.525   6.182
  253   1HG1  ILE  30          1HG1      ILE  30   1.923   2.231   6.787
  254   2HG1  ILE  30          2HG1      ILE  30   2.555   2.675   5.218
  255   1HG2  ILE  30          2HG2      ILE  30   3.292   6.248   6.059
  256   2HG2  ILE  30          3HG2      ILE  30   4.413   4.917   6.037
  257   3HG2  ILE  30          1HG2      ILE  30   3.240   5.090   4.722
  258   1HD1  ILE  30          3HD1      ILE  30   4.369   2.855   7.614
  259   2HD1  ILE  30          1HD1      ILE  30   4.066   1.332   6.755
  260   3HD1  ILE  30          2HD1      ILE  30   4.757   2.733   5.908
  261    QG1  ILE  30           QG1      ILE  30   2.239   2.453   6.003
  262    QG2  ILE  30           QG2      ILE  30   3.648   5.418   5.606
  263    QD1  ILE  30           QD1      ILE  30   4.397   2.307   6.759
  264    H    GLY  31           H        GLY  31   2.247   7.273   7.451
  265   1HA   GLY  31          1HA       GLY  31  -0.380   7.657   7.127
  266   2HA   GLY  31          2HA       GLY  31  -0.220   7.919   8.879
  267    QA   GLY  31           QA       GLY  31  -0.300   7.788   8.003
  268    H    ALA  32           H        ALA  32  -1.059   9.962   7.837
  269    HA   ALA  32           HA       ALA  32  -0.896  12.194   7.659
  270   1HB   ALA  32          1HB       ALA  32   0.775  11.920   9.473
  271   2HB   ALA  32          2HB       ALA  32   2.059  11.929   8.238
  272   3HB   ALA  32          3HB       ALA  32   1.006  13.341   8.435
  273    QB   ALA  32           QB       ALA  32   1.280  12.397   8.715
  274    H    ASN  33           H        ASN  33  -1.442  12.419   5.568
  275    HA   ASN  33           HA       ASN  33  -1.277  13.111   3.399
  276   1HB   ASN  33          1HB       ASN  33   1.758  13.289   3.843
  277   2HB   ASN  33          2HB       ASN  33   0.980  13.537   2.307
  278   1HD2  ASN  33          2HD2      ASN  33   1.030  16.621   4.814
  279   2HD2  ASN  33          1HD2      ASN  33   1.709  15.068   5.318
  280    QB   ASN  33           QB       ASN  33   1.369  13.413   3.075
  281    QD2  ASN  33           QD2      ASN  33   1.370  15.844   5.066
  282    H    VAL  34           H        VAL  34  -0.702  10.203   4.563
  283    HA   VAL  34           HA       VAL  34   0.653   8.991   2.249
  284    HB   VAL  34           HB       VAL  34  -0.443   7.963   4.894
  285   1HG1  VAL  34          2HG1      VAL  34   0.949   6.424   2.664
  286   2HG1  VAL  34          3HG1      VAL  34   0.644   5.864   4.330
  287   3HG1  VAL  34          1HG1      VAL  34  -0.716   6.148   3.236
  288   1HG2  VAL  34          2HG2      VAL  34   1.654   9.325   4.877
  289   2HG2  VAL  34          3HG2      VAL  34   1.899   7.655   5.358
  290   3HG2  VAL  34          1HG2      VAL  34   2.365   8.170   3.728
  291    QG1  VAL  34           QG1      VAL  34   0.292   6.145   3.410
  292    QG2  VAL  34           QG2      VAL  34   1.973   8.383   4.654
  293    QQG  VAL  34           QQG      VAL  34   1.132   7.264   4.032
  294    H    HIS  35           H        HIS  35  -0.715   9.313   0.493
  295    HA   HIS  35           HA       HIS  35  -3.127   7.617   0.507
  296   1HB   HIS  35          1HB       HIS  35  -4.552   9.154  -0.426
  297   2HB   HIS  35          2HB       HIS  35  -4.022   9.838   1.117
  298    HD1  HIS  35          1HD       HIS  35  -5.202  11.155  -1.870
  299    HD2  HIS  35          2HD       HIS  35  -1.570  11.619   0.193
  300    HE1  HIS  35          1HE       HIS  35  -4.190  13.305  -2.679
  301    QB   HIS  35           QB       HIS  35  -4.287   9.496   0.346
  302    H    TRP  36           H        TRP  36  -0.447   7.406  -0.655
  303    HA   TRP  36           HA       TRP  36  -1.374   6.823  -3.407
  304   1HB   TRP  36          1HB       TRP  36   1.144   8.344  -2.661
  305   2HB   TRP  36          2HB       TRP  36   0.763   7.718  -4.262
  306    HD1  TRP  36           HD       TRP  36  -0.367  10.429  -1.790
  307    HE1  TRP  36          1HE       TRP  36  -1.668  12.208  -3.021
  308    HE3  TRP  36          3HE       TRP  36  -1.054   7.925  -6.135
  309    HZ2  TRP  36          2HZ       TRP  36  -2.955  12.494  -5.654
  310    HZ3  TRP  36          3HZ       TRP  36  -2.327   8.933  -8.011
  311    HH2  TRP  36           HH       TRP  36  -3.248  11.247  -7.790
  312    QB   TRP  36           QB       TRP  36   0.953   8.031  -3.462
  313    H    MET  37           H        MET  37  -0.859   4.758  -3.796
  314    HA   MET  37           HA       MET  37   1.652   3.657  -2.592
  315   1HB   MET  37          1HB       MET  37  -0.477   2.449  -2.084
  316   2HB   MET  37          2HB       MET  37  -0.563   2.017  -3.807
  317   1HG   MET  37          1HG       MET  37   1.583   0.860  -3.630
  318   2HG   MET  37          2HG       MET  37   1.795   1.406  -1.959
  319   1HE   MET  37          1HE       MET  37   0.639   0.414   0.096
  320   2HE   MET  37          2HE       MET  37  -0.950   0.966  -0.500
  321   3HE   MET  37          3HE       MET  37  -0.737  -0.710   0.046
  322    QB   MET  37           QB       MET  37  -0.520   2.233  -2.945
  323    QG   MET  37           QG       MET  37   1.689   1.133  -2.795
  324    QE   MET  37           QE       MET  37  -0.349   0.223  -0.120
  325    H    VAL  38           H        VAL  38   3.314   3.263  -4.049
  326    HA   VAL  38           HA       VAL  38   2.662   3.772  -6.940
  327    HB   VAL  38           HB       VAL  38   5.120   4.873  -5.547
  328   1HG1  VAL  38          3HG1      VAL  38   3.741   5.419  -8.226
  329   2HG1  VAL  38          1HG1      VAL  38   5.189   6.236  -7.637
  330   3HG1  VAL  38          2HG1      VAL  38   5.247   4.504  -8.010
  331   1HG2  VAL  38          3HG2      VAL  38   2.484   6.275  -6.188
  332   2HG2  VAL  38          1HG2      VAL  38   3.185   6.047  -4.573
  333   3HG2  VAL  38          2HG2      VAL  38   3.991   7.098  -5.739
  334    QG1  VAL  38           QG1      VAL  38   4.726   5.386  -7.958
  335    QG2  VAL  38           QG2      VAL  38   3.220   6.473  -5.500
  336    QQG  VAL  38           QQG      VAL  38   3.973   5.930  -6.729
  337    H    THR  39           H        THR  39   2.573   1.611  -7.309
  338    HA   THR  39           HA       THR  39   4.819  -0.067  -6.269
  339    HB   THR  39           HB       THR  39   2.345  -0.510  -5.767
  340    HG1  THR  39          1HG       THR  39   4.271  -2.355  -6.519
  341   1HG2  THR  39          3HG2      THR  39   1.506  -0.275  -8.122
  342   2HG2  THR  39          1HG2      THR  39   2.360  -1.793  -8.500
  343   3HG2  THR  39          2HG2      THR  39   1.047  -1.788  -7.317
  344    QG2  THR  39           QG2      THR  39   1.638  -1.285  -7.980
  345    H    GLY  40           H        GLY  40   5.989  -1.468  -7.755
  346   1HA   GLY  40          1HA       GLY  40   5.886  -2.066 -10.366
  347   2HA   GLY  40          2HA       GLY  40   6.229  -0.306 -10.435
  348    QA   GLY  40           QA       GLY  40   6.058  -1.186 -10.401
  349    H    GLY  41           H        GLY  41   8.220  -1.417 -11.559
  350   1HA   GLY  41          1HA       GLY  41  10.365  -0.497 -10.157
  351   2HA   GLY  41          2HA       GLY  41  10.317  -2.193  -9.629
  352    QA   GLY  41           QA       GLY  41  10.341  -1.345  -9.893
  353    H    SER  42           H        SER  42   9.343  -3.233 -12.219
  354    HA   SER  42           HA       SER  42  11.546  -2.537 -14.080
  355   1HB   SER  42          1HB       SER  42  10.024  -5.096 -13.449
  356   2HB   SER  42          2HB       SER  42  10.632  -4.784 -15.064
  357    HG   SER  42           HG       SER  42  12.706  -4.446 -14.189
  358    QB   SER  42           QB       SER  42  10.328  -4.940 -14.257
  359    H    THR  43           H        THR  43   8.599  -4.198 -14.953
  360    HA   THR  43           HA       THR  43   7.011  -1.861 -15.500
  361    HB   THR  43           HB       THR  43   8.539  -1.681 -17.368
  362    HG1  THR  43          1HG       THR  43   5.924  -2.537 -18.027
  363   1HG2  THR  43          2HG2      THR  43   9.179  -4.105 -17.632
  364   2HG2  THR  43          3HG2      THR  43   7.634  -4.346 -18.492
  365   3HG2  THR  43          1HG2      THR  43   8.828  -3.206 -19.109
  366    QG2  THR  43           QG2      THR  43   8.547  -3.886 -18.411
  367    H    ASP  44           H        ASP  44   7.615  -5.213 -16.562
  368    HA   ASP  44           HA       ASP  44   4.827  -6.030 -16.264
  369   1HB   ASP  44          1HB       ASP  44   6.037  -8.244 -17.153
  370   2HB   ASP  44          2HB       ASP  44   5.812  -6.869 -18.234
  371    QB   ASP  44           QB       ASP  44   5.925  -7.556 -17.694
  372    H    GLY  45           H        GLY  45   5.653  -5.256 -13.845
  373   1HA   GLY  45          1HA       GLY  45   6.920  -7.448 -12.334
  374   2HA   GLY  45          2HA       GLY  45   6.277  -5.936 -11.696
  375    QA   GLY  45           QA       GLY  45   6.599  -6.692 -12.015
  376    H    LYS  46           H        LYS  46   3.939  -7.158 -13.702
  377    HA   LYS  46           HA       LYS  46   1.860  -7.880 -13.437
  378   1HB   LYS  46          1HB       LYS  46   2.897  -9.578 -11.150
  379   2HB   LYS  46          2HB       LYS  46   1.338  -9.744 -11.960
  380   1HG   LYS  46          1HG       LYS  46   2.568 -10.166 -14.141
  381   2HG   LYS  46          2HG       LYS  46   4.072 -10.241 -13.207
  382   1HD   LYS  46          1HD       LYS  46   1.619 -12.053 -12.940
  383   2HD   LYS  46          2HD       LYS  46   3.216 -12.497 -13.550
  384   1HE   LYS  46          1HE       LYS  46   4.024 -11.624 -11.142
  385   2HE   LYS  46          2HE       LYS  46   2.326 -11.905 -10.713
  386   1HZ   LYS  46          3HZ       LYS  46   2.721 -14.240 -11.521
  387   2HZ   LYS  46          1HZ       LYS  46   4.301 -13.891 -11.651
  388   3HZ   LYS  46          2HZ       LYS  46   3.582 -13.795 -10.183
  389    QB   LYS  46           QB       LYS  46   2.118  -9.661 -11.555
  390    QG   LYS  46           QG       LYS  46   3.320 -10.203 -13.674
  391    QD   LYS  46           QD       LYS  46   2.418 -12.275 -13.245
  392    QE   LYS  46           QE       LYS  46   3.175 -11.764 -10.927
  393    QZ   LYS  46           QZ       LYS  46   3.535 -13.975 -11.118
  394    H    GLN  47           H        GLN  47  -0.073  -7.868 -11.886
  395    HA   GLN  47           HA       GLN  47   0.242  -5.545 -10.101
  396   1HB   GLN  47          1HB       GLN  47  -1.987  -5.492  -9.773
  397   2HB   GLN  47          2HB       GLN  47  -1.936  -6.037 -11.455
  398   1HG   GLN  47          1HG       GLN  47  -2.692  -8.217 -10.804
  399   2HG   GLN  47          2HG       GLN  47  -2.339  -7.933  -9.095
  400   1HE2  GLN  47          2HE2      GLN  47  -5.788  -7.291  -8.733
  401   2HE2  GLN  47          1HE2      GLN  47  -4.504  -8.424  -8.473
  402    QB   GLN  47           QB       GLN  47  -1.962  -5.765 -10.614
  403    QG   GLN  47           QG       GLN  47  -2.515  -8.075  -9.949
  404    QE2  GLN  47           QE2      GLN  47  -5.146  -7.857  -8.603
  405    H    GLY  48           H        GLY  48  -0.346  -5.685  -7.894
  406   1HA   GLY  48          1HA       GLY  48  -0.569  -8.302  -6.678
  407   2HA   GLY  48          2HA       GLY  48   0.930  -7.510  -6.178
  408    QA   GLY  48           QA       GLY  48   0.180  -7.906  -6.428
  409    H    CYS  49           H        CYS  49  -0.680  -7.832  -4.093
  410    HA   CYS  49           HA       CYS  49  -2.562  -5.491  -4.009
  411   1HB   CYS  49          1HB       CYS  49  -2.964  -8.382  -3.197
  412   2HB   CYS  49          2HB       CYS  49  -4.097  -7.116  -2.737
  413    QB   CYS  49           QB       CYS  49  -3.530  -7.749  -2.967
  414    H    ALA  50           H        ALA  50  -3.172  -4.981  -1.836
  415    HA   ALA  50           HA       ALA  50  -1.446  -6.025   0.289
  416   1HB   ALA  50          2HB       ALA  50  -0.189  -3.986  -0.559
  417   2HB   ALA  50          3HB       ALA  50  -1.631  -3.013  -0.162
  418   3HB   ALA  50          1HB       ALA  50  -0.746  -3.844   1.117
  419    QB   ALA  50           QB       ALA  50  -0.856  -3.614   0.132
  420    H    THR  51           H        THR  51  -2.417  -6.128   2.133
  421    HA   THR  51           HA       THR  51  -5.141  -4.854   2.370
  422    HB   THR  51           HB       THR  51  -3.683  -6.537   4.415
  423    HG1  THR  51          1HG       THR  51  -5.929  -7.604   3.738
  424   1HG2  THR  51          2HG2      THR  51  -6.495  -5.318   4.363
  425   2HG2  THR  51          3HG2      THR  51  -5.861  -6.396   5.624
  426   3HG2  THR  51          1HG2      THR  51  -5.186  -4.778   5.431
  427    QG2  THR  51           QG2      THR  51  -5.847  -5.497   5.139
  428    H    ILE  52           H        ILE  52  -5.243  -2.856   3.011
  429    HA   ILE  52           HA       ILE  52  -2.982  -1.574   4.433
  430    HB   ILE  52           HB       ILE  52  -5.321  -0.275   2.967
  431   1HG1  ILE  52          1HG1      ILE  52  -2.478  -0.818   1.998
  432   2HG1  ILE  52          2HG1      ILE  52  -3.979  -1.460   1.312
  433   1HG2  ILE  52          2HG2      ILE  52  -4.200   1.078   4.777
  434   2HG2  ILE  52          3HG2      ILE  52  -2.672   0.910   3.889
  435   3HG2  ILE  52          1HG2      ILE  52  -4.040   1.785   3.176
  436   1HD1  ILE  52          3HD1      ILE  52  -4.676   0.901   0.764
  437   2HD1  ILE  52          1HD1      ILE  52  -3.033   1.425   1.217
  438   3HD1  ILE  52          2HD1      ILE  52  -3.260   0.299  -0.119
  439    QG1  ILE  52           QG1      ILE  52  -3.228  -1.139   1.655
  440    QG2  ILE  52           QG2      ILE  52  -3.637   1.258   3.947
  441    QD1  ILE  52           QD1      ILE  52  -3.656   0.875   0.621
  442    H    TRP  53           H        TRP  53  -3.648  -0.456   6.429
  443    HA   TRP  53           HA       TRP  53  -6.297  -1.216   7.565
  444   1HB   TRP  53          1HB       TRP  53  -3.524  -1.426   8.716
  445   2HB   TRP  53          2HB       TRP  53  -4.883  -1.147   9.784
  446    HD1  TRP  53           HD       TRP  53  -6.523  -3.082  10.294
  447    HE1  TRP  53          1HE       TRP  53  -6.374  -5.583  10.077
  448    HE3  TRP  53          3HE       TRP  53  -2.706  -3.282   6.916
  449    HZ2  TRP  53          2HZ       TRP  53  -4.742  -7.517   8.577
  450    HZ3  TRP  53          3HZ       TRP  53  -1.897  -5.441   6.089
  451    HH2  TRP  53           HH       TRP  53  -2.873  -7.583   6.919
  452    QB   TRP  53           QB       TRP  53  -4.204  -1.286   9.250
  453    H    GLU  54           H        GLU  54  -7.057   0.149   9.219
  454    HA   GLU  54           HA       GLU  54  -6.496   2.971   8.886
  455   1HB   GLU  54          1HB       GLU  54  -8.755   2.314   9.207
  456   2HB   GLU  54          2HB       GLU  54  -8.324   1.107  10.409
  457   1HG   GLU  54          1HG       GLU  54  -8.010   2.705  12.135
  458   2HG   GLU  54          2HG       GLU  54  -8.267   4.057  11.006
  459    QB   GLU  54           QB       GLU  54  -8.539   1.710   9.808
  460    QG   GLU  54           QG       GLU  54  -8.139   3.381  11.571
  461    H    GLY  55           H        GLY  55  -6.056   0.552  11.509
  462   1HA   GLY  55          1HA       GLY  55  -5.147   2.587  13.356
  463   2HA   GLY  55          2HA       GLY  55  -5.206   0.886  13.670
  464    QA   GLY  55           QA       GLY  55  -5.177   1.737  13.513
  465    H    SER  56           H        SER  56  -3.244   3.263  13.565
  466    HA   SER  56           HA       SER  56  -1.011   2.812  11.963
  467   1HB   SER  56          1HB       SER  56  -1.673   4.712  13.794
  468   2HB   SER  56          2HB       SER  56  -0.508   3.806  14.756
  469    HG   SER  56           HG       SER  56   0.473   5.442  13.595
  470    QB   SER  56           QB       SER  56  -1.091   4.259  14.275
  471    H    GLY  57           H        GLY  57  -0.069   0.817  11.837
  472   1HA   GLY  57          1HA       GLY  57   1.695  -0.548  13.103
  473   2HA   GLY  57          2HA       GLY  57   0.312  -0.866  14.160
  474    QA   GLY  57           QA       GLY  57   1.004  -0.707  13.632
  475    H    CYS  58           H        CYS  58  -1.654  -1.676  13.161
  476    HA   CYS  58           HA       CYS  58  -2.481  -2.050  10.781
  477   1HB   CYS  58          1HB       CYS  58  -2.103  -4.115   9.817
  478   2HB   CYS  58          2HB       CYS  58  -0.552  -3.359   9.966
  479    QB   CYS  58           QB       CYS  58  -1.328  -3.737   9.891
  480    H    VAL  59           H        VAL  59  -3.808  -1.544  12.897
  481    HA   VAL  59           HA       VAL  59  -5.490  -3.912  13.443
  482    HB   VAL  59           HB       VAL  59  -6.020  -2.866  15.538
  483   1HG1  VAL  59          1HG1      VAL  59  -4.213  -4.568  15.448
  484   2HG1  VAL  59          2HG1      VAL  59  -3.024  -3.243  15.362
  485   3HG1  VAL  59          3HG1      VAL  59  -4.031  -3.441  16.805
  486   1HG2  VAL  59          1HG2      VAL  59  -3.929  -0.779  14.915
  487   2HG2  VAL  59          2HG2      VAL  59  -5.661  -0.550  15.277
  488   3HG2  VAL  59          3HG2      VAL  59  -4.560  -1.094  16.541
  489    QG1  VAL  59           QG1      VAL  59  -3.756  -3.751  15.871
  490    QG2  VAL  59           QG2      VAL  59  -4.717  -0.807  15.578
  491    QQG  VAL  59           QQG      VAL  59  -4.236  -2.279  15.724
  492    H    GLY  60           H        GLY  60  -7.762  -2.944  14.096
  493   1HA   GLY  60          1HA       GLY  60  -9.494  -1.429  13.699
  494   2HA   GLY  60          2HA       GLY  60  -8.363  -0.342  12.890
  495    QA   GLY  60           QA       GLY  60  -8.929  -0.885  13.295
  496    H    ARG  61           H        ARG  61  -9.852  -0.006  11.130
  497    HA   ARG  61           HA       ARG  61 -10.923  -2.412   9.772
  498   1HB   ARG  61          1HB       ARG  61 -12.143  -0.087  10.355
  499   2HB   ARG  61          2HB       ARG  61 -11.428   0.403   8.810
  500   1HG   ARG  61          1HG       ARG  61 -12.547  -1.537   7.701
  501   2HG   ARG  61          2HG       ARG  61 -13.137  -2.097   9.284
  502   1HD   ARG  61          1HD       ARG  61 -14.354   0.089   9.542
  503   2HD   ARG  61          2HD       ARG  61 -13.897   0.464   7.865
  504    HE   ARG  61           HE       ARG  61 -15.115  -2.054   7.729
  505   1HH1  ARG  61          2HH2      ARG  61 -16.045   1.262   8.580
  506   2HH1  ARG  61          1HH2      ARG  61 -17.741   0.976   8.334
  507   1HH2  ARG  61          2HH1      ARG  61 -17.234  -2.363   7.255
  508   2HH2  ARG  61          1HH1      ARG  61 -18.360  -1.017   7.256
  509    QB   ARG  61           QB       ARG  61 -11.786   0.158   9.582
  510    QG   ARG  61           QG       ARG  61 -12.842  -1.817   8.493
  511    QD   ARG  61           QD       ARG  61 -14.125   0.276   8.704
  512    QH1  ARG  61           QH2      ARG  61 -16.893   1.119   8.457
  513    QH2  ARG  61           QH1      ARG  61 -17.797  -1.690   7.255
  514    H    SER  62           H        SER  62 -10.681  -2.836   7.563
  515    HA   SER  62           HA       SER  62  -8.207  -1.732   6.522
  516   1HB   SER  62          1HB       SER  62  -7.813  -4.505   6.257
  517   2HB   SER  62          2HB       SER  62  -6.974  -3.406   7.307
  518    HG   SER  62           HG       SER  62  -8.507  -3.807   8.925
  519    QB   SER  62           QB       SER  62  -7.394  -3.955   6.782
  520    H    THR  63           H        THR  63  -7.649  -2.614   4.349
  521    HA   THR  63           HA       THR  63 -10.008  -3.321   2.688
  522    HB   THR  63           HB       THR  63  -8.944  -1.122   1.372
  523    HG1  THR  63          1HG       THR  63  -7.783  -0.580   3.303
  524   1HG2  THR  63          2HG2      THR  63 -11.348  -1.645   1.647
  525   2HG2  THR  63          3HG2      THR  63 -11.279  -1.092   3.332
  526   3HG2  THR  63          1HG2      THR  63 -10.989   0.050   2.005
  527    QG2  THR  63           QG2      THR  63 -11.205  -0.896   2.328
  528    H    THR  64           H        THR  64  -9.384  -4.599   1.023
  529    HA   THR  64           HA       THR  64  -6.526  -5.123   0.591
  530    HB   THR  64           HB       THR  64  -7.509  -6.809  -1.008
  531    HG1  THR  64          1HG       THR  64  -9.514  -5.719  -1.255
  532   1HG2  THR  64          1HG2      THR  64  -8.298  -6.787   1.954
  533   2HG2  THR  64          2HG2      THR  64  -8.346  -8.224   0.917
  534   3HG2  THR  64          3HG2      THR  64  -6.805  -7.414   1.225
  535    QG2  THR  64           QG2      THR  64  -7.816  -7.475   1.365
  536    H    MET  65           H        MET  65  -5.712  -3.291  -0.314
  537    HA   MET  65           HA       MET  65  -7.022  -2.043  -2.673
  538   1HB   MET  65          1HB       MET  65  -5.980  -0.558  -1.036
  539   2HB   MET  65          2HB       MET  65  -4.454  -1.443  -1.173
  540   1HG   MET  65          1HG       MET  65  -4.402   0.663  -2.466
  541   2HG   MET  65          2HG       MET  65  -4.165  -0.764  -3.460
  542   1HE   MET  65          1HE       MET  65  -6.655   2.110  -2.495
  543   2HE   MET  65          2HE       MET  65  -8.043   1.716  -3.531
  544   3HE   MET  65          3HE       MET  65  -7.634   0.657  -2.167
  545    QB   MET  65           QB       MET  65  -5.217  -1.001  -1.105
  546    QG   MET  65           QG       MET  65  -4.283  -0.050  -2.963
  547    QE   MET  65           QE       MET  65  -7.444   1.494  -2.731
  548    H    CYS  66           H        CYS  66  -6.471  -2.815  -4.732
  549    HA   CYS  66           HA       CYS  66  -3.887  -4.322  -5.065
  550   1HB   CYS  66          1HB       CYS  66  -6.568  -4.773  -6.347
  551   2HB   CYS  66          2HB       CYS  66  -5.094  -5.613  -6.830
  552    QB   CYS  66           QB       CYS  66  -5.831  -5.193  -6.589
  553    H    CYS  67           H        CYS  67  -2.674  -3.597  -6.688
  554    HA   CYS  67           HA       CYS  67  -3.857  -1.896  -8.843
  555   1HB   CYS  67          1HB       CYS  67  -3.169  -0.563  -6.834
  556   2HB   CYS  67          2HB       CYS  67  -1.498  -1.062  -7.158
  557    QB   CYS  67           QB       CYS  67  -2.333  -0.812  -6.996
  558    HA   PRO  68           HA       PRO  68  -0.839  -4.123 -11.189
  559   1HB   PRO  68          1HB       PRO  68  -0.613  -2.426 -13.426
  560   2HB   PRO  68          2HB       PRO  68  -1.822  -3.719 -13.166
  561   1HG   PRO  68          1HG       PRO  68  -2.056  -0.756 -12.817
  562   2HG   PRO  68          2HG       PRO  68  -3.319  -1.906 -13.323
  563   1HD   PRO  68          1HD       PRO  68  -3.155  -0.814 -10.819
  564   2HD   PRO  68          2HD       PRO  68  -3.864  -2.407 -11.133
  565    QB   PRO  68           QB       PRO  68  -1.218  -3.072 -13.296
  566    QG   PRO  68           QG       PRO  68  -2.687  -1.331 -13.070
  567    QD   PRO  68           QD       PRO  68  -3.510  -1.610 -10.976
  568    H    ALA  69           H        ALA  69   1.259  -3.881 -12.455
  569    HA   ALA  69           HA       ALA  69   3.085  -2.617 -10.540
  570   1HB   ALA  69          3HB       ALA  69   3.608  -4.047 -13.169
  571   2HB   ALA  69          1HB       ALA  69   4.880  -3.258 -12.226
  572   3HB   ALA  69          2HB       ALA  69   3.990  -4.594 -11.509
  573    QB   ALA  69           QB       ALA  69   4.159  -3.966 -12.301
  574    H    ASN  70           H        ASN  70   4.253  -0.805 -10.819
  575    HA   ASN  70           HA       ASN  70   5.111   1.128 -11.639
  576   1HB   ASN  70          1HB       ASN  70   4.838  -0.399 -14.261
  577   2HB   ASN  70          2HB       ASN  70   5.525   1.229 -14.128
  578   1HD2  ASN  70          2HD2      ASN  70   8.470   0.375 -12.409
  579   2HD2  ASN  70          1HD2      ASN  70   7.226   1.597 -12.621
  580    QB   ASN  70           QB       ASN  70   5.182   0.415 -14.194
  581    QD2  ASN  70           QD2      ASN  70   7.848   0.986 -12.515
  582    H    THR  71           H        THR  71   2.688   1.073 -10.712
  583    HA   THR  71           HA       THR  71   1.166   2.996 -12.393
  584    HB   THR  71           HB       THR  71   0.051   0.711 -10.730
  585    HG1  THR  71          1HG       THR  71   0.992  -0.069 -12.638
  586   1HG2  THR  71          2HG2      THR  71  -1.294   2.667 -12.622
  587   2HG2  THR  71          3HG2      THR  71  -2.088   1.302 -11.815
  588   3HG2  THR  71          1HG2      THR  71  -1.446   2.637 -10.847
  589    QG2  THR  71           QG2      THR  71  -1.609   2.202 -11.762
  590    H    CYS  72           H        CYS  72   0.689   4.794 -11.268
  591    HA   CYS  72           HA       CYS  72   1.325   4.905  -8.367
  592   1HB   CYS  72          1HB       CYS  72   2.195   6.778  -9.696
  593   2HB   CYS  72          2HB       CYS  72   0.582   7.058 -10.390
  594    QB   CYS  72           QB       CYS  72   1.388   6.918 -10.043
  595    H    CYS  73           H        CYS  73  -0.288   4.699  -6.967
  596    HA   CYS  73           HA       CYS  73  -3.029   4.216  -8.016
  597   1HB   CYS  73          1HB       CYS  73  -1.648   2.954  -5.630
  598   2HB   CYS  73          2HB       CYS  73  -3.045   2.346  -6.478
  599    QB   CYS  73           QB       CYS  73  -2.346   2.650  -6.054
  600    H    ASN  74           H        ASN  74  -4.209   6.036  -7.359
  601    HA   ASN  74           HA       ASN  74  -3.446   7.486  -4.972
  602   1HB   ASN  74          1HB       ASN  74  -4.506   8.560  -6.997
  603   2HB   ASN  74          2HB       ASN  74  -5.996   7.730  -6.617
  604   1HD2  ASN  74          2HD2      ASN  74  -5.190  10.221  -3.496
  605   2HD2  ASN  74          1HD2      ASN  74  -4.089   8.899  -3.742
  606    QB   ASN  74           QB       ASN  74  -5.251   8.145  -6.807
  607    QD2  ASN  74           QD2      ASN  74  -4.640   9.560  -3.619
  608    H    ILE  75           H        ILE  75  -3.815   6.570  -2.990
  609    HA   ILE  75           HA       ILE  75  -5.968   4.629  -2.553
  610    HB   ILE  75           HB       ILE  75  -3.622   5.733  -1.001
  611   1HG1  ILE  75          1HG1      ILE  75  -3.116   3.414  -0.643
  612   2HG1  ILE  75          2HG1      ILE  75  -4.656   2.904  -1.388
  613   1HG2  ILE  75          1HG2      ILE  75  -5.937   4.223   0.224
  614   2HG2  ILE  75          2HG2      ILE  75  -4.321   4.394   0.953
  615   3HG2  ILE  75          3HG2      ILE  75  -5.308   5.836   0.683
  616   1HD1  ILE  75          3HD1      ILE  75  -2.464   4.442  -2.736
  617   2HD1  ILE  75          1HD1      ILE  75  -2.608   2.669  -2.846
  618   3HD1  ILE  75          2HD1      ILE  75  -3.856   3.701  -3.569
  619    QG1  ILE  75           QG1      ILE  75  -3.886   3.159  -1.016
  620    QG2  ILE  75           QG2      ILE  75  -5.189   4.818   0.620
  621    QD1  ILE  75           QD1      ILE  75  -2.976   3.604  -3.050
  622    H    ASN  76           H        ASN  76  -8.032   5.376  -2.276
  623    HA   ASN  76           HA       ASN  76  -8.438   7.459  -0.176
  624   1HB   ASN  76          1HB       ASN  76  -9.867   7.400  -2.875
  625   2HB   ASN  76          2HB       ASN  76 -10.354   8.370  -1.482
  626   1HD2  ASN  76          2HD2      ASN  76  -7.428  10.584  -1.919
  627   2HD2  ASN  76          1HD2      ASN  76  -8.140   9.704  -0.571
  628    QB   ASN  76           QB       ASN  76 -10.110   7.885  -2.178
  629    QD2  ASN  76           QD2      ASN  76  -7.784  10.144  -1.245
  630    H    THR  77           H        THR  77  -8.858   5.507   1.155
  631    HA   THR  77           HA       THR  77 -10.982   3.707   0.188
  632    HB   THR  77           HB       THR  77 -10.723   2.465   2.110
  633    HG1  THR  77          1HG       THR  77  -9.404   4.658   3.355
  634   1HG2  THR  77          3HG2      THR  77  -8.809   2.275   0.608
  635   2HG2  THR  77          1HG2      THR  77  -7.942   3.534   1.508
  636   3HG2  THR  77          2HG2      THR  77  -8.353   2.007   2.302
  637    QG2  THR  77           QG2      THR  77  -8.368   2.606   1.473
  638    H    GLY  78           H        GLY  78 -12.754   3.391   2.237
  639   1HA   GLY  78          1HA       GLY  78 -14.400   5.777   2.185
  640   2HA   GLY  78          2HA       GLY  78 -14.653   4.293   3.119
  641    QA   GLY  78           QA       GLY  78 -14.527   5.035   2.652
  642    H    PHE  79           H        PHE  79 -11.707   4.662   4.196
  643    HA   PHE  79           HA       PHE  79 -12.274   6.696   6.292
  644   1HB   PHE  79          1HB       PHE  79 -11.401   4.903   7.846
  645   2HB   PHE  79          2HB       PHE  79 -12.997   4.637   7.216
  646    HD1  PHE  79          2HD       PHE  79  -9.392   3.623   6.847
  647    HD2  PHE  79          1HD       PHE  79 -13.495   2.660   5.936
  648    HE1  PHE  79          2HE       PHE  79  -8.713   1.345   6.187
  649    HE2  PHE  79          1HE       PHE  79 -12.819   0.307   5.434
  650   1HZ   PHE  79           HZ       PHE  79 -10.415  -0.304   5.468
  651    QB   PHE  79           QB       PHE  79 -12.199   4.770   7.531
  652    QG   PHE  79           QD       PHE  79 -11.443   3.141   6.392
  653    QZ   PHE  79           QE       PHE  79 -10.766   0.826   5.810
  654    QZ   PHE  79           QR       PHE  79 -10.967   1.526   5.974
  655    H    TYR  80           H        TYR  80 -10.149   6.700   7.765
  656    HA   TYR  80           HA       TYR  80  -8.239   7.676   5.820
  657   1HB   TYR  80          1HB       TYR  80  -8.789   9.110   7.700
  658   2HB   TYR  80          2HB       TYR  80  -8.294   7.863   8.843
  659    HD1  TYR  80          1HD       TYR  80  -6.550   9.051   5.697
  660    HD2  TYR  80          2HD       TYR  80  -6.413   8.706   9.993
  661    HE1  TYR  80          1HE       TYR  80  -4.118   9.268   5.625
  662    HE2  TYR  80          2HE       TYR  80  -3.938   8.965   9.901
  663    HH   TYR  80           HH       TYR  80  -2.537   7.926   7.182
  664    QB   TYR  80           QB       TYR  80  -8.541   8.486   8.271
  665    QG   TYR  80           QD       TYR  80  -6.482   8.878   7.845
  666    QZ   TYR  80           QE       TYR  80  -4.028   9.117   7.763
  667    QR   TYR  80           QR       TYR  80  -5.255   8.998   7.804
  668    H    ILE  81           H        ILE  81  -6.179   6.783   5.531
  669    HA   ILE  81           HA       ILE  81  -5.962   3.983   6.340
  670    HB   ILE  81           HB       ILE  81  -4.224   4.117   4.376
  671   1HG1  ILE  81          1HG1      ILE  81  -4.786   6.687   4.187
  672   2HG1  ILE  81          2HG1      ILE  81  -4.550   5.712   2.780
  673   1HG2  ILE  81          2HG2      ILE  81  -7.233   3.837   4.093
  674   2HG2  ILE  81          3HG2      ILE  81  -6.014   3.317   2.895
  675   3HG2  ILE  81          1HG2      ILE  81  -6.066   2.580   4.500
  676   1HD1  ILE  81          1HD1      ILE  81  -7.334   6.252   3.922
  677   2HD1  ILE  81          2HD1      ILE  81  -6.579   7.164   2.612
  678   3HD1  ILE  81          3HD1      ILE  81  -6.944   5.444   2.412
  679    QG1  ILE  81           QG1      ILE  81  -4.668   6.200   3.483
  680    QG2  ILE  81           QG2      ILE  81  -6.437   3.245   3.829
  681    QD1  ILE  81           QD1      ILE  81  -6.952   6.287   2.982
  682    H    ARG  82           H        ARG  82  -3.999   3.133   7.115
  683    HA   ARG  82           HA       ARG  82  -1.621   4.885   7.404
  684   1HB   ARG  82          1HB       ARG  82  -3.027   3.323   9.636
  685   2HB   ARG  82          2HB       ARG  82  -1.375   3.886   9.759
  686   1HG   ARG  82          1HG       ARG  82  -2.254   6.245   9.251
  687   2HG   ARG  82          2HG       ARG  82  -3.887   5.567   9.434
  688   1HD   ARG  82          1HD       ARG  82  -3.142   4.780  11.765
  689   2HD   ARG  82          2HD       ARG  82  -1.650   5.691  11.491
  690    HE   ARG  82           HE       ARG  82  -2.769   7.672  11.927
  691   1HH1  ARG  82          2HH2      ARG  82  -5.210   5.179  11.258
  692   2HH1  ARG  82          1HH2      ARG  82  -6.534   6.251  11.700
  693   1HH2  ARG  82          2HH1      ARG  82  -4.400   8.937  12.543
  694   2HH2  ARG  82          1HH1      ARG  82  -6.093   8.459  12.471
  695    QB   ARG  82           QB       ARG  82  -2.201   3.604   9.698
  696    QG   ARG  82           QG       ARG  82  -3.071   5.906   9.342
  697    QD   ARG  82           QD       ARG  82  -2.396   5.235  11.628
  698    QH1  ARG  82           QH2      ARG  82  -5.872   5.715  11.479
  699    QH2  ARG  82           QH1      ARG  82  -5.247   8.698  12.507
  700    H    SER  83           H        SER  83  -2.325   1.672   8.705
  701    HA   SER  83           HA       SER  83   0.357   1.078   7.923
  702   1HB   SER  83          1HB       SER  83  -1.468  -0.954   9.085
  703   2HB   SER  83          2HB       SER  83   0.211  -0.637   9.449
  704    HG   SER  83           HG       SER  83  -1.800   0.241  10.861
  705    QB   SER  83           QB       SER  83  -0.628  -0.796   9.267
  706    H    TYR  84           H        TYR  84   0.973  -1.196   6.947
  707    HA   TYR  84           HA       TYR  84  -1.105  -2.371   5.321
  708   1HB   TYR  84          1HB       TYR  84  -0.308  -1.909   3.171
  709   2HB   TYR  84          2HB       TYR  84  -0.418  -0.355   3.968
  710    HD1  TYR  84          2HD       TYR  84   2.095   0.044   5.402
  711    HD2  TYR  84          1HD       TYR  84   1.369  -1.813   1.573
  712    HE1  TYR  84          2HE       TYR  84   4.178   1.001   4.533
  713    HE2  TYR  84          1HE       TYR  84   3.381  -0.652   0.678
  714    HH   TYR  84           HH       TYR  84   5.331   1.540   2.650
  715    QB   TYR  84           QB       TYR  84  -0.363  -1.132   3.570
  716    QG   TYR  84           QD       TYR  84   1.732  -0.885   3.487
  717    QZ   TYR  84           QE       TYR  84   3.779   0.174   2.606
  718    QR   TYR  84           QR       TYR  84   2.756  -0.355   3.047
  719    H    ARG  85           H        ARG  85  -0.491  -4.104   3.999
  720    HA   ARG  85           HA       ARG  85   2.207  -5.283   4.274
  721   1HB   ARG  85          1HB       ARG  85   1.001  -6.117   6.232
  722   2HB   ARG  85          2HB       ARG  85  -0.362  -6.588   5.236
  723   1HG   ARG  85          1HG       ARG  85   2.093  -7.943   4.369
  724   2HG   ARG  85          2HG       ARG  85   1.703  -8.218   6.080
  725   1HD   ARG  85          1HD       ARG  85  -0.691  -8.730   5.352
  726   2HD   ARG  85          2HD       ARG  85  -0.078  -8.864   3.716
  727    HE   ARG  85           HE       ARG  85   0.436 -10.539   6.151
  728   1HH1  ARG  85          2HH2      ARG  85   1.182 -10.177   2.664
  729   2HH1  ARG  85          1HH2      ARG  85   1.114 -11.907   2.397
  730   1HH2  ARG  85          2HH1      ARG  85   0.609 -12.857   5.693
  731   2HH2  ARG  85          1HH1      ARG  85   0.694 -13.325   3.992
  732    QB   ARG  85           QB       ARG  85   0.320  -6.353   5.734
  733    QG   ARG  85           QG       ARG  85   1.898  -8.080   5.224
  734    QD   ARG  85           QD       ARG  85  -0.385  -8.797   4.534
  735    QH1  ARG  85           QH2      ARG  85   1.148 -11.042   2.531
  736    QH2  ARG  85           QH1      ARG  85   0.651 -13.091   4.842
  737    H    ARG  86           H        ARG  86   2.680  -5.883   2.144
  738    HA   ARG  86           HA       ARG  86   0.674  -6.145   0.118
  739   1HB   ARG  86          1HB       ARG  86   3.155  -5.824  -0.480
  740   2HB   ARG  86          2HB       ARG  86   3.477  -7.352   0.283
  741   1HG   ARG  86          1HG       ARG  86   3.440  -8.205  -1.790
  742   2HG   ARG  86          2HG       ARG  86   1.705  -8.251  -1.581
  743   1HD   ARG  86          1HD       ARG  86   1.931  -7.367  -3.624
  744   2HD   ARG  86          2HD       ARG  86   1.760  -5.874  -2.687
  745    HE   ARG  86           HE       ARG  86   4.509  -6.343  -2.761
  746   1HH1  ARG  86          2HH2      ARG  86   2.139  -6.261  -5.381
  747   2HH1  ARG  86          1HH2      ARG  86   3.313  -5.916  -6.624
  748   1HH2  ARG  86          2HH1      ARG  86   5.992  -5.978  -4.273
  749   2HH2  ARG  86          1HH1      ARG  86   5.615  -5.784  -5.976
  750    QB   ARG  86           QB       ARG  86   3.316  -6.588  -0.098
  751    QG   ARG  86           QG       ARG  86   2.572  -8.228  -1.685
  752    QD   ARG  86           QD       ARG  86   1.845  -6.621  -3.156
  753    QH1  ARG  86           QH2      ARG  86   2.726  -6.088  -6.003
  754    QH2  ARG  86           QH1      ARG  86   5.804  -5.881  -5.124
  755    H    VAL  87           H        VAL  87  -0.663  -7.871  -0.317
  756    HA   VAL  87           HA       VAL  87  -0.716  -9.998   1.595
  757    HB   VAL  87           HB       VAL  87  -2.403  -8.111   0.434
  758   1HG1  VAL  87          2HG1      VAL  87  -3.024  -9.587  -1.372
  759   2HG1  VAL  87          3HG1      VAL  87  -3.572 -10.783  -0.167
  760   3HG1  VAL  87          1HG1      VAL  87  -4.346  -9.185  -0.270
  761   1HG2  VAL  87          2HG2      VAL  87  -2.770 -10.234   2.443
  762   2HG2  VAL  87          3HG2      VAL  87  -2.258  -8.517   2.634
  763   3HG2  VAL  87          1HG2      VAL  87  -3.910  -8.905   2.067
  764    QG1  VAL  87           QG1      VAL  87  -3.647  -9.852  -0.603
  765    QG2  VAL  87           QG2      VAL  87  -2.979  -9.219   2.381
  766    QQG  VAL  87           QQG      VAL  87  -3.313  -9.535   0.889
  767    H    GLU  88           H        GLU  88  -0.429  -9.444  -1.931
  768    HA   GLU  88           HA       GLU  88   0.405 -12.186  -2.410
  769   1HB   GLU  88          1HB       GLU  88  -2.315 -11.251  -2.971
  770   2HB   GLU  88          2HB       GLU  88  -1.430 -11.317  -4.488
  771   1HG   GLU  88          1HG       GLU  88  -0.793 -13.655  -4.069
  772   2HG   GLU  88          2HG       GLU  88  -1.623 -13.605  -2.503
  773    QB   GLU  88           QB       GLU  88  -1.872 -11.284  -3.730
  774    QG   GLU  88           QG       GLU  88  -1.208 -13.630  -3.286
   
  No H/Q in entry =         774
  Start of MODEL    5
    1   1HA   GLY   1          1HA       GLY   1  15.027  -1.630 -13.745
    2   2HA   GLY   1          2HA       GLY   1  13.426  -0.908 -13.952
    3    QA   GLY   1           QA       GLY   1  14.227  -1.269 -13.848
    4    H    ASP   2           H        ASP   2  13.265  -4.220 -12.969
    5    HA   ASP   2           HA       ASP   2  12.719  -5.286 -11.114
    6   1HB   ASP   2          1HB       ASP   2  14.416  -3.238  -9.663
    7   2HB   ASP   2          2HB       ASP   2  13.770  -4.717  -8.981
    8    QB   ASP   2           QB       ASP   2  14.093  -3.978  -9.322
    9    H    GLY   3           H        GLY   3  10.595  -5.275 -10.687
   10   1HA   GLY   3          1HA       GLY   3   9.095  -2.982 -10.040
   11   2HA   GLY   3          2HA       GLY   3   8.588  -4.653  -9.709
   12    QA   GLY   3           QA       GLY   3   8.841  -3.817  -9.875
   13    H    TYR   4           H        TYR   4   7.730  -2.943  -7.850
   14    HA   TYR   4           HA       TYR   4   8.987  -3.723  -5.431
   15   1HB   TYR   4          1HB       TYR   4   9.441  -1.307  -4.662
   16   2HB   TYR   4          2HB       TYR   4  10.600  -2.014  -5.743
   17    HD1  TYR   4          1HD       TYR   4   7.726   0.376  -5.554
   18    HD2  TYR   4          2HD       TYR   4  11.085  -1.016  -7.857
   19    HE1  TYR   4          1HE       TYR   4   7.511   2.334  -7.059
   20    HE2  TYR   4          2HE       TYR   4  10.897   0.948  -9.331
   21    HH   TYR   4           HH       TYR   4   9.699   2.842  -9.843
   22    QB   TYR   4           QB       TYR   4  10.020  -1.661  -5.203
   23    QG   TYR   4           QD       TYR   4   9.405  -0.320  -6.706
   24    QZ   TYR   4           QE       TYR   4   9.204   1.641  -8.195
   25    QR   TYR   4           QR       TYR   4   9.305   0.660  -7.450
   26    H    LEU   5           H        LEU   5   7.869  -2.333  -3.624
   27    HA   LEU   5           HA       LEU   5   5.320  -1.113  -4.392
   28   1HB   LEU   5          1HB       LEU   5   4.827  -3.525  -4.211
   29   2HB   LEU   5          2HB       LEU   5   5.355  -3.521  -2.529
   30    HG   LEU   5           HG       LEU   5   3.217  -1.577  -3.507
   31   1HD1  LEU   5          2HD1      LEU   5   2.637  -3.840  -4.316
   32   2HD1  LEU   5          3HD1      LEU   5   2.603  -4.428  -2.686
   33   3HD1  LEU   5          1HD1      LEU   5   1.464  -3.166  -3.159
   34   1HD2  LEU   5          3HD2      LEU   5   4.097  -2.692  -0.836
   35   2HD2  LEU   5          1HD2      LEU   5   3.630  -1.048  -1.290
   36   3HD2  LEU   5          2HD2      LEU   5   2.393  -2.298  -1.057
   37    QB   LEU   5           QB       LEU   5   5.091  -3.523  -3.370
   38    QD1  LEU   5           QD1      LEU   5   2.235  -3.811  -3.387
   39    QD2  LEU   5           QD2      LEU   5   3.373  -2.013  -1.061
   40    QQD  LEU   5           QQD      LEU   5   2.804  -2.912  -2.224
   41    H    ILE   6           H        ILE   6   6.143   0.765  -3.643
   42    HA   ILE   6           HA       ILE   6   7.074   0.958  -0.817
   43    HB   ILE   6           HB       ILE   6   8.268   2.941  -1.498
   44   1HG1  ILE   6          1HG1      ILE   6   7.242   2.330  -4.296
   45   2HG1  ILE   6          2HG1      ILE   6   6.998   3.801  -3.348
   46   1HG2  ILE   6          1HG2      ILE   6   9.286   0.586  -1.645
   47   2HG2  ILE   6          2HG2      ILE   6   9.077   0.707  -3.397
   48   3HG2  ILE   6          3HG2      ILE   6  10.110   1.868  -2.542
   49   1HD1  ILE   6          3HD1      ILE   6   9.574   4.046  -3.477
   50   2HD1  ILE   6          1HD1      ILE   6   9.509   2.781  -4.712
   51   3HD1  ILE   6          2HD1      ILE   6   8.656   4.308  -4.979
   52    QG1  ILE   6           QG1      ILE   6   7.120   3.065  -3.822
   53    QG2  ILE   6           QG2      ILE   6   9.491   1.054  -2.528
   54    QD1  ILE   6           QD1      ILE   6   9.246   3.712  -4.389
   55    H    MET   7           H        MET   7   6.062   2.599   0.407
   56    HA   MET   7           HA       MET   7   3.634   3.835  -0.797
   57   1HB   MET   7          1HB       MET   7   3.321   4.932   1.360
   58   2HB   MET   7          2HB       MET   7   3.124   3.172   1.363
   59   1HG   MET   7          1HG       MET   7   5.100   2.820   2.588
   60   2HG   MET   7          2HG       MET   7   5.704   4.459   2.287
   61   1HE   MET   7          3HE       MET   7   2.835   2.415   3.998
   62   2HE   MET   7          1HE       MET   7   2.078   3.630   5.021
   63   3HE   MET   7          2HE       MET   7   1.938   3.769   3.264
   64    QB   MET   7           QB       MET   7   3.222   4.052   1.362
   65    QG   MET   7           QG       MET   7   5.402   3.640   2.437
   66    QE   MET   7           QE       MET   7   2.284   3.271   4.094
   67    H    CYS   8           H        CYS   8   3.742   5.908  -1.495
   68    HA   CYS   8           HA       CYS   8   6.341   7.353  -1.268
   69   1HB   CYS   8          1HB       CYS   8   4.236   7.571  -3.410
   70   2HB   CYS   8          2HB       CYS   8   5.533   8.725  -3.173
   71    QB   CYS   8           QB       CYS   8   4.884   8.148  -3.291
   72    H    LYS   9           H        LYS   9   6.061   9.592  -0.707
   73    HA   LYS   9           HA       LYS   9   3.886   9.894   1.082
   74   1HB   LYS   9          1HB       LYS   9   4.808  11.814   1.709
   75   2HB   LYS   9          2HB       LYS   9   6.215  11.125   0.917
   76   1HG   LYS   9          1HG       LYS   9   5.549  12.443  -1.157
   77   2HG   LYS   9          2HG       LYS   9   4.223  13.122  -0.158
   78   1HD   LYS   9          1HD       LYS   9   6.126  13.692   1.525
   79   2HD   LYS   9          2HD       LYS   9   7.202  13.569   0.133
   80   1HE   LYS   9          1HE       LYS   9   5.801  15.266  -1.093
   81   2HE   LYS   9          2HE       LYS   9   4.663  15.286   0.267
   82   1HZ   LYS   9          1HZ       LYS   9   6.372  16.199   1.653
   83   2HZ   LYS   9          2HZ       LYS   9   7.412  16.292   0.345
   84   3HZ   LYS   9          3HZ       LYS   9   5.994  17.158   0.382
   85    QB   LYS   9           QB       LYS   9   5.512  11.470   1.313
   86    QG   LYS   9           QG       LYS   9   4.886  12.783  -0.657
   87    QD   LYS   9           QD       LYS   9   6.664  13.631   0.829
   88    QE   LYS   9           QE       LYS   9   5.232  15.276  -0.413
   89    QZ   LYS   9           QZ       LYS   9   6.593  16.549   0.793
   90    H    ASN  10           H        ASN  10   4.359  10.649  -2.280
   91    HA   ASN  10           HA       ASN  10   1.630  11.681  -2.701
   92   1HB   ASN  10          1HB       ASN  10   2.242  13.541  -3.967
   93   2HB   ASN  10          2HB       ASN  10   3.109  13.663  -2.454
   94   1HD2  ASN  10          2HD2      ASN  10   5.481  14.636  -5.145
   95   2HD2  ASN  10          1HD2      ASN  10   3.939  15.216  -4.565
   96    QB   ASN  10           QB       ASN  10   2.675  13.602  -3.211
   97    QD2  ASN  10           QD2      ASN  10   4.710  14.926  -4.855
   98    H    CYS  11           H        CYS  11   2.085  12.174  -5.539
   99    HA   CYS  11           HA       CYS  11   1.982   9.325  -6.326
  100   1HB   CYS  11          1HB       CYS  11   0.293  11.072  -6.987
  101   2HB   CYS  11          2HB       CYS  11   1.518  11.837  -7.980
  102    QB   CYS  11           QB       CYS  11   0.905  11.454  -7.483
  103    H    ASP  12           H        ASP  12   4.511  11.333  -5.877
  104    HA   ASP  12           HA       ASP  12   5.787  10.902  -8.524
  105   1HB   ASP  12          1HB       ASP  12   5.484  13.190  -7.680
  106   2HB   ASP  12          2HB       ASP  12   6.559  12.816  -6.323
  107    QB   ASP  12           QB       ASP  12   6.022  13.003  -7.001
  108    HA   PRO  13           HA       PRO  13   8.176   7.791  -6.165
  109   1HB   PRO  13          1HB       PRO  13   9.898   6.994  -8.156
  110   2HB   PRO  13          2HB       PRO  13   8.247   6.375  -7.934
  111   1HG   PRO  13          1HG       PRO  13   9.200   8.554  -9.806
  112   2HG   PRO  13          2HG       PRO  13   8.072   7.218 -10.163
  113   1HD   PRO  13          1HD       PRO  13   7.247   9.748  -9.607
  114   2HD   PRO  13          2HD       PRO  13   6.287   8.346  -9.038
  115    QB   PRO  13           QB       PRO  13   9.072   6.685  -8.045
  116    QG   PRO  13           QG       PRO  13   8.636   7.886  -9.984
  117    QD   PRO  13           QD       PRO  13   6.767   9.047  -9.322
  118    H    ASN  14           H        ASN  14   9.358  10.519  -8.059
  119    HA   ASN  14           HA       ASN  14  12.121  10.189  -7.117
  120   1HB   ASN  14          1HB       ASN  14  12.101  10.185  -9.391
  121   2HB   ASN  14          2HB       ASN  14  10.711  11.240  -9.522
  122   1HD2  ASN  14          2HD2      ASN  14  12.699  14.007 -10.261
  123   2HD2  ASN  14          1HD2      ASN  14  11.207  13.088 -10.497
  124    QB   ASN  14           QB       ASN  14  11.406  10.712  -9.456
  125    QD2  ASN  14           QD2      ASN  14  11.953  13.547 -10.379
  126    H    THR  15           H        THR  15   9.674  12.773  -7.461
  127    HA   THR  15           HA       THR  15  11.231  14.300  -5.387
  128    HB   THR  15           HB       THR  15  10.481  16.319  -6.108
  129    HG1  THR  15          1HG       THR  15   8.606  15.090  -7.855
  130   1HG2  THR  15          1HG2      THR  15  12.089  15.209  -7.719
  131   2HG2  THR  15          2HG2      THR  15  10.670  14.842  -8.745
  132   3HG2  THR  15          3HG2      THR  15  11.098  16.525  -8.398
  133    QG2  THR  15           QG2      THR  15  11.286  15.525  -8.287
  134    H    GLY  16           H        GLY  16   8.952  12.096  -5.285
  135   1HA   GLY  16          1HA       GLY  16   7.265  13.398  -3.235
  136   2HA   GLY  16          2HA       GLY  16   7.340  11.666  -3.627
  137    QA   GLY  16           QA       GLY  16   7.302  12.532  -3.431
  138    H    SER  17           H        SER  17   9.367  10.627  -3.321
  139    HA   SER  17           HA       SER  17  11.153   9.977  -2.032
  140   1HB   SER  17          1HB       SER  17  11.513  12.144  -0.919
  141   2HB   SER  17          2HB       SER  17  10.226  11.717   0.253
  142    HG   SER  17           HG       SER  17  12.281   9.846  -0.175
  143    QB   SER  17           QB       SER  17  10.870  11.930  -0.333
  144    H    CYS  18           H        CYS  18  10.732   8.003  -1.448
  145    HA   CYS  18           HA       CYS  18   8.150   7.184  -0.310
  146   1HB   CYS  18          1HB       CYS  18   9.826   6.040  -2.591
  147   2HB   CYS  18          2HB       CYS  18   8.204   5.547  -2.144
  148    QB   CYS  18           QB       CYS  18   9.015   5.794  -2.368
  149    H    ASP  19           H        ASP  19   8.222   4.901   0.508
  150    HA   ASP  19           HA       ASP  19  10.801   4.495   1.820
  151   1HB   ASP  19          1HB       ASP  19   9.840   3.273   3.381
  152   2HB   ASP  19          2HB       ASP  19   8.817   4.654   3.081
  153    QB   ASP  19           QB       ASP  19   9.329   3.963   3.231
  154    H    TRP  20           H        TRP  20  12.077   3.738   0.452
  155    HA   TRP  20           HA       TRP  20  11.651   1.173  -1.021
  156   1HB   TRP  20          1HB       TRP  20  14.185   2.810  -0.766
  157   2HB   TRP  20          2HB       TRP  20  13.872   1.484  -1.867
  158    HD1  TRP  20           HD       TRP  20  13.000   5.167  -1.355
  159    HE1  TRP  20          1HE       TRP  20  12.219   6.187  -3.544
  160    HE3  TRP  20          3HE       TRP  20  12.780   0.904  -4.165
  161    HZ2  TRP  20          2HZ       TRP  20  11.524   5.269  -6.216
  162    HZ3  TRP  20          3HZ       TRP  20  12.175   1.026  -6.551
  163    HH2  TRP  20           HH       TRP  20  11.487   3.197  -7.579
  164    QB   TRP  20           QB       TRP  20  14.028   2.147  -1.316
  165    H    LYS  21           H        LYS  21  11.036   0.791   1.422
  166    HA   LYS  21           HA       LYS  21  13.261  -0.525   2.926
  167   1HB   LYS  21          1HB       LYS  21  10.926   1.207   3.684
  168   2HB   LYS  21          2HB       LYS  21  11.060  -0.251   4.636
  169   1HG   LYS  21          1HG       LYS  21  13.281   1.784   4.290
  170   2HG   LYS  21          2HG       LYS  21  12.183   1.617   5.672
  171   1HD   LYS  21          1HD       LYS  21  13.076  -0.895   5.711
  172   2HD   LYS  21          2HD       LYS  21  14.455  -0.227   4.819
  173   1HE   LYS  21          1HE       LYS  21  13.376   0.706   7.518
  174   2HE   LYS  21          2HE       LYS  21  14.828  -0.277   7.267
  175   1HZ   LYS  21          3HZ       LYS  21  14.517   2.491   6.255
  176   2HZ   LYS  21          1HZ       LYS  21  15.300   2.078   7.619
  177   3HZ   LYS  21          2HZ       LYS  21  15.884   1.559   6.201
  178    QB   LYS  21           QB       LYS  21  10.993   0.478   4.160
  179    QG   LYS  21           QG       LYS  21  12.732   1.700   4.981
  180    QD   LYS  21           QD       LYS  21  13.766  -0.561   5.265
  181    QE   LYS  21           QE       LYS  21  14.102   0.214   7.392
  182    QZ   LYS  21           QZ       LYS  21  15.234   2.043   6.692
  183    H    GLN  22           H        GLN  22  11.931  -2.326   4.356
  184    HA   GLN  22           HA       GLN  22  10.610  -4.096   2.442
  185   1HB   GLN  22          1HB       GLN  22  11.986  -4.763   4.550
  186   2HB   GLN  22          2HB       GLN  22  10.504  -4.455   5.445
  187   1HG   GLN  22          1HG       GLN  22   9.810  -6.555   4.879
  188   2HG   GLN  22          2HG       GLN  22   9.769  -6.076   3.187
  189   1HE2  GLN  22          2HE2      GLN  22  12.990  -8.209   4.651
  190   2HE2  GLN  22          1HE2      GLN  22  11.717  -7.560   5.692
  191    QB   GLN  22           QB       GLN  22  11.245  -4.609   4.998
  192    QG   GLN  22           QG       GLN  22   9.789  -6.316   4.033
  193    QE2  GLN  22           QE2      GLN  22  12.354  -7.884   5.171
  194    H    ASN  23           H        ASN  23   8.439  -4.498   2.360
  195    HA   ASN  23           HA       ASN  23   6.593  -3.092   4.247
  196   1HB   ASN  23          1HB       ASN  23   6.380  -2.997   1.204
  197   2HB   ASN  23          2HB       ASN  23   5.062  -2.620   2.296
  198   1HD2  ASN  23          2HD2      ASN  23   7.147   0.547   1.446
  199   2HD2  ASN  23          1HD2      ASN  23   6.745  -0.808   0.385
  200    QB   ASN  23           QB       ASN  23   5.721  -2.808   1.750
  201    QD2  ASN  23           QD2      ASN  23   6.946  -0.131   0.916
  202    H    TRP  24           H        TRP  24   7.712  -6.081   3.266
  203    HA   TRP  24           HA       TRP  24   5.098  -7.180   2.625
  204   1HB   TRP  24          1HB       TRP  24   6.769  -7.729   1.043
  205   2HB   TRP  24          2HB       TRP  24   7.995  -7.980   2.299
  206    HD1  TRP  24           HD       TRP  24   7.886  -9.948   3.728
  207    HE1  TRP  24          1HE       TRP  24   6.611 -12.264   3.723
  208    HE3  TRP  24          3HE       TRP  24   4.574  -8.899   0.092
  209    HZ2  TRP  24          2HZ       TRP  24   4.243 -13.315   2.341
  210    HZ3  TRP  24          3HZ       TRP  24   2.742 -10.443  -0.494
  211    HH2  TRP  24           HH       TRP  24   2.617 -12.689   0.521
  212    QB   TRP  24           QB       TRP  24   7.382  -7.854   1.671
  213    H    ASN  25           H        ASN  25   4.019  -8.111   4.183
  214    HA   ASN  25           HA       ASN  25   3.426  -8.904   6.185
  215   1HB   ASN  25          1HB       ASN  25   4.727 -10.811   5.229
  216   2HB   ASN  25          2HB       ASN  25   6.118 -10.281   6.194
  217   1HD2  ASN  25          2HD2      ASN  25   2.722 -11.752   8.111
  218   2HD2  ASN  25          1HD2      ASN  25   2.553 -10.913   6.587
  219    QB   ASN  25           QB       ASN  25   5.422 -10.546   5.712
  220    QD2  ASN  25           QD2      ASN  25   2.638 -11.332   7.349
  221    H    THR  26           H        THR  26   4.441  -6.299   6.345
  222    HA   THR  26           HA       THR  26   5.469  -6.143   9.092
  223    HB   THR  26           HB       THR  26   6.709  -4.134   8.260
  224    HG1  THR  26          1HG       THR  26   7.212  -3.919   6.215
  225   1HG2  THR  26          3HG2      THR  26   7.723  -6.873   7.347
  226   2HG2  THR  26          1HG2      THR  26   8.719  -5.430   7.572
  227   3HG2  THR  26          2HG2      THR  26   7.913  -6.172   8.968
  228    QG2  THR  26           QG2      THR  26   8.119  -6.158   7.963
  229    H    CYS  27           H        CYS  27   4.707  -4.143  10.074
  230    HA   CYS  27           HA       CYS  27   2.027  -3.636   9.119
  231   1HB   CYS  27          1HB       CYS  27   2.678  -4.349  11.489
  232   2HB   CYS  27          2HB       CYS  27   3.247  -2.704  11.722
  233    QB   CYS  27           QB       CYS  27   2.962  -3.526  11.606
  234    H    VAL  28           H        VAL  28   2.451  -2.131   7.356
  235    HA   VAL  28           HA       VAL  28   4.425  -0.007   7.790
  236    HB   VAL  28           HB       VAL  28   2.626  -0.264   5.382
  237   1HG1  VAL  28          1HG1      VAL  28   4.212   1.702   5.691
  238   2HG1  VAL  28          2HG1      VAL  28   5.549   0.547   5.695
  239   3HG1  VAL  28          3HG1      VAL  28   4.545   0.724   4.247
  240   1HG2  VAL  28          2HG2      VAL  28   5.089  -1.949   5.999
  241   2HG2  VAL  28          3HG2      VAL  28   3.450  -2.530   5.613
  242   3HG2  VAL  28          1HG2      VAL  28   4.401  -1.722   4.378
  243    QG1  VAL  28           QG1      VAL  28   4.769   0.991   5.211
  244    QG2  VAL  28           QG2      VAL  28   4.313  -2.067   5.330
  245    QQG  VAL  28           QQG      VAL  28   4.541  -0.538   5.270
  246    H    GLY  29           H        GLY  29   3.939   2.036   8.570
  247   1HA   GLY  29          1HA       GLY  29   1.198   2.626   9.201
  248   2HA   GLY  29          2HA       GLY  29   2.567   3.598   9.649
  249    QA   GLY  29           QA       GLY  29   1.883   3.112   9.425
  250    H    ILE  30           H        ILE  30  -0.073   3.846   8.072
  251    HA   ILE  30           HA       ILE  30   0.796   5.404   5.672
  252    HB   ILE  30           HB       ILE  30  -1.985   4.532   6.552
  253   1HG1  ILE  30          1HG1      ILE  30  -0.400   3.302   4.267
  254   2HG1  ILE  30          2HG1      ILE  30  -0.356   2.614   5.892
  255   1HG2  ILE  30          2HG2      ILE  30  -0.934   5.790   3.977
  256   2HG2  ILE  30          3HG2      ILE  30  -2.515   5.021   4.081
  257   3HG2  ILE  30          1HG2      ILE  30  -2.190   6.430   5.064
  258   1HD1  ILE  30          1HD1      ILE  30  -2.842   2.413   5.886
  259   2HD1  ILE  30          2HD1      ILE  30  -2.841   2.888   4.171
  260   3HD1  ILE  30          3HD1      ILE  30  -1.996   1.434   4.683
  261    QG1  ILE  30           QG1      ILE  30  -0.378   2.958   5.080
  262    QG2  ILE  30           QG2      ILE  30  -1.880   5.747   4.374
  263    QD1  ILE  30           QD1      ILE  30  -2.560   2.245   4.913
  264    H    GLY  31           H        GLY  31  -0.181   7.559   5.369
  265   1HA   GLY  31          1HA       GLY  31  -1.435   9.311   5.995
  266   2HA   GLY  31          2HA       GLY  31  -1.524   8.779   7.681
  267    QA   GLY  31           QA       GLY  31  -1.480   9.045   6.838
  268    H    ALA  32           H        ALA  32  -1.106  11.298   7.195
  269    HA   ALA  32           HA       ALA  32   0.021  13.086   7.645
  270   1HB   ALA  32          1HB       ALA  32   2.110  11.228   8.824
  271   2HB   ALA  32          2HB       ALA  32   2.085  12.991   9.031
  272   3HB   ALA  32          3HB       ALA  32   0.742  12.006   9.658
  273    QB   ALA  32           QB       ALA  32   1.646  12.075   9.171
  274    H    ASN  33           H        ASN  33  -0.062  13.340   5.471
  275    HA   ASN  33           HA       ASN  33   0.699  14.133   3.527
  276   1HB   ASN  33          1HB       ASN  33   3.558  13.990   4.584
  277   2HB   ASN  33          2HB       ASN  33   2.976  14.843   3.157
  278   1HD2  ASN  33          2HD2      ASN  33   2.821  16.730   6.710
  279   2HD2  ASN  33          1HD2      ASN  33   3.717  15.236   6.441
  280    QB   ASN  33           QB       ASN  33   3.267  14.416   3.870
  281    QD2  ASN  33           QD2      ASN  33   3.269  15.983   6.576
  282    H    VAL  34           H        VAL  34   0.803  11.149   4.489
  283    HA   VAL  34           HA       VAL  34   2.133  10.127   2.019
  284    HB   VAL  34           HB       VAL  34   2.150   8.993   4.851
  285   1HG1  VAL  34          3HG1      VAL  34   3.465   7.901   2.319
  286   2HG1  VAL  34          1HG1      VAL  34   3.747   7.301   3.962
  287   3HG1  VAL  34          2HG1      VAL  34   2.146   7.137   3.230
  288   1HG2  VAL  34          1HG2      VAL  34   3.760  10.905   4.568
  289   2HG2  VAL  34          2HG2      VAL  34   4.509   9.361   4.949
  290   3HG2  VAL  34          3HG2      VAL  34   4.560   9.980   3.287
  291    QG1  VAL  34           QG1      VAL  34   3.119   7.446   3.170
  292    QG2  VAL  34           QG2      VAL  34   4.276  10.082   4.268
  293    QQG  VAL  34           QQG      VAL  34   3.698   8.764   3.719
  294    H    HIS  35           H        HIS  35   0.341   9.737   0.848
  295    HA   HIS  35           HA       HIS  35  -1.449   7.491   1.653
  296   1HB   HIS  35          1HB       HIS  35  -3.455   8.788   0.912
  297   2HB   HIS  35          2HB       HIS  35  -2.834   9.369   2.422
  298    HD1  HIS  35          1HD       HIS  35  -3.822  10.613  -0.903
  299    HD2  HIS  35          2HD       HIS  35  -1.229  11.750   2.215
  300    HE1  HIS  35          1HE       HIS  35  -3.465  13.126  -1.129
  301    QB   HIS  35           QB       HIS  35  -3.144   9.079   1.667
  302    H    TRP  36           H        TRP  36   0.790   7.605  -0.130
  303    HA   TRP  36           HA       TRP  36  -0.826   6.862  -2.520
  304   1HB   TRP  36          1HB       TRP  36   1.673   8.526  -2.489
  305   2HB   TRP  36          2HB       TRP  36   0.972   7.782  -3.929
  306    HD1  TRP  36           HD       TRP  36  -0.016  10.371  -1.221
  307    HE1  TRP  36          1HE       TRP  36  -1.533  12.110  -2.213
  308    HE3  TRP  36          3HE       TRP  36  -0.755   8.207  -5.754
  309    HZ2  TRP  36          2HZ       TRP  36  -2.953  12.549  -4.728
  310    HZ3  TRP  36          3HZ       TRP  36  -2.138   9.380  -7.501
  311    HH2  TRP  36           HH       TRP  36  -3.175  11.571  -6.996
  312    QB   TRP  36           QB       TRP  36   1.323   8.154  -3.209
  313    H    MET  37           H        MET  37  -0.367   4.902  -3.246
  314    HA   MET  37           HA       MET  37   2.214   3.604  -2.450
  315   1HB   MET  37          1HB       MET  37   0.065   2.479  -1.708
  316   2HB   MET  37          2HB       MET  37  -0.258   2.149  -3.429
  317   1HG   MET  37          1HG       MET  37   1.617   0.702  -3.571
  318   2HG   MET  37          2HG       MET  37   2.313   1.310  -2.062
  319   1HE   MET  37          2HE       MET  37  -0.756  -0.713  -3.530
  320   2HE   MET  37          3HE       MET  37  -1.511  -1.291  -2.026
  321   3HE   MET  37          1HE       MET  37  -1.550   0.439  -2.420
  322    QB   MET  37           QB       MET  37  -0.096   2.314  -2.569
  323    QG   MET  37           QG       MET  37   1.965   1.006  -2.817
  324    QE   MET  37           QE       MET  37  -1.272  -0.522  -2.659
  325    H    VAL  38           H        VAL  38   3.589   3.474  -4.098
  326    HA   VAL  38           HA       VAL  38   2.558   3.704  -6.901
  327    HB   VAL  38           HB       VAL  38   5.067   5.052  -5.839
  328   1HG1  VAL  38          1HG1      VAL  38   3.585   5.271  -8.490
  329   2HG1  VAL  38          2HG1      VAL  38   5.024   6.200  -8.034
  330   3HG1  VAL  38          3HG1      VAL  38   5.135   4.439  -8.232
  331   1HG2  VAL  38          3HG2      VAL  38   2.358   6.302  -6.521
  332   2HG2  VAL  38          1HG2      VAL  38   3.095   6.246  -4.912
  333   3HG2  VAL  38          2HG2      VAL  38   3.846   7.209  -6.188
  334    QG1  VAL  38           QG1      VAL  38   4.582   5.303  -8.252
  335    QG2  VAL  38           QG2      VAL  38   3.100   6.586  -5.874
  336    QQG  VAL  38           QQG      VAL  38   3.841   5.944  -7.063
  337    H    THR  39           H        THR  39   3.163   1.852  -7.941
  338    HA   THR  39           HA       THR  39   5.037   0.106  -6.350
  339    HB   THR  39           HB       THR  39   2.878  -0.766  -6.379
  340    HG1  THR  39          1HG       THR  39   4.453  -2.330  -6.767
  341   1HG2  THR  39          2HG2      THR  39   2.885  -0.286  -9.366
  342   2HG2  THR  39          3HG2      THR  39   1.757  -1.388  -8.537
  343   3HG2  THR  39          1HG2      THR  39   1.746   0.341  -8.166
  344    QG2  THR  39           QG2      THR  39   2.129  -0.444  -8.689
  345    H    GLY  40           H        GLY  40   5.833  -1.663  -8.010
  346   1HA   GLY  40          1HA       GLY  40   8.054  -0.720  -9.416
  347   2HA   GLY  40          2HA       GLY  40   7.154  -2.204  -9.805
  348    QA   GLY  40           QA       GLY  40   7.604  -1.462  -9.611
  349    H    GLY  41           H        GLY  41   8.380  -0.057 -11.467
  350   1HA   GLY  41          1HA       GLY  41   6.044   0.662 -13.176
  351   2HA   GLY  41          2HA       GLY  41   7.749   1.032 -13.520
  352    QA   GLY  41           QA       GLY  41   6.896   0.847 -13.348
  353    H    SER  42           H        SER  42   9.079  -1.187 -13.112
  354    HA   SER  42           HA       SER  42   8.559  -2.913 -15.287
  355   1HB   SER  42          1HB       SER  42  10.060  -3.713 -12.813
  356   2HB   SER  42          2HB       SER  42  10.321  -4.102 -14.526
  357    HG   SER  42           HG       SER  42  10.701  -1.691 -14.705
  358    QB   SER  42           QB       SER  42  10.191  -3.908 -13.669
  359    H    THR  43           H        THR  43   8.324  -5.236 -15.095
  360    HA   THR  43           HA       THR  43   7.104  -7.035 -14.743
  361    HB   THR  43           HB       THR  43   6.130  -6.938 -12.055
  362    HG1  THR  43          1HG       THR  43   7.573  -5.333 -11.595
  363   1HG2  THR  43          3HG2      THR  43   6.946  -8.930 -13.320
  364   2HG2  THR  43          1HG2      THR  43   8.603  -8.304 -13.219
  365   3HG2  THR  43          2HG2      THR  43   7.741  -8.768 -11.739
  366    QG2  THR  43           QG2      THR  43   7.763  -8.668 -12.759
  367    H    ASP  44           H        ASP  44   6.301  -4.964 -15.994
  368    HA   ASP  44           HA       ASP  44   4.050  -3.492 -15.265
  369   1HB   ASP  44          1HB       ASP  44   5.566  -2.951 -17.096
  370   2HB   ASP  44          2HB       ASP  44   4.952  -4.323 -18.034
  371    QB   ASP  44           QB       ASP  44   5.259  -3.637 -17.565
  372    H    GLY  45           H        GLY  45   2.843  -5.363 -14.196
  373   1HA   GLY  45          1HA       GLY  45   0.377  -5.822 -15.134
  374   2HA   GLY  45          2HA       GLY  45   1.265  -7.139 -15.929
  375    QA   GLY  45           QA       GLY  45   0.821  -6.481 -15.532
  376    H    LYS  46           H        LYS  46   3.142  -7.159 -13.503
  377    HA   LYS  46           HA       LYS  46   1.496  -8.849 -11.706
  378   1HB   LYS  46          1HB       LYS  46   4.392  -8.043 -11.506
  379   2HB   LYS  46          2HB       LYS  46   3.485  -9.083 -10.400
  380   1HG   LYS  46          1HG       LYS  46   2.922 -10.541 -12.393
  381   2HG   LYS  46          2HG       LYS  46   4.137  -9.646 -13.329
  382   1HD   LYS  46          1HD       LYS  46   5.932 -10.447 -11.883
  383   2HD   LYS  46          2HD       LYS  46   4.797 -10.961 -10.646
  384   1HE   LYS  46          1HE       LYS  46   5.650 -12.918 -11.829
  385   2HE   LYS  46          2HE       LYS  46   3.915 -12.747 -12.095
  386   1HZ   LYS  46          1HZ       LYS  46   4.415 -11.766 -14.261
  387   2HZ   LYS  46          2HZ       LYS  46   6.043 -11.959 -13.998
  388   3HZ   LYS  46          3HZ       LYS  46   5.060 -13.263 -14.131
  389    QB   LYS  46           QB       LYS  46   3.939  -8.563 -10.953
  390    QG   LYS  46           QG       LYS  46   3.529 -10.094 -12.861
  391    QD   LYS  46           QD       LYS  46   5.365 -10.704 -11.265
  392    QE   LYS  46           QE       LYS  46   4.782 -12.832 -11.962
  393    QZ   LYS  46           QZ       LYS  46   5.173 -12.329 -14.130
  394    H    GLN  47           H        GLN  47   0.090  -7.538 -10.887
  395    HA   GLN  47           HA       GLN  47   0.704  -5.067  -9.453
  396   1HB   GLN  47          1HB       GLN  47  -1.593  -5.255  -8.601
  397   2HB   GLN  47          2HB       GLN  47  -1.570  -5.567 -10.356
  398   1HG   GLN  47          1HG       GLN  47  -1.762  -7.933 -10.039
  399   2HG   GLN  47          2HG       GLN  47  -1.736  -7.725  -8.267
  400   1HE2  GLN  47          2HE2      GLN  47  -5.284  -7.636  -8.462
  401   2HE2  GLN  47          1HE2      GLN  47  -3.861  -8.574  -8.006
  402    QB   GLN  47           QB       GLN  47  -1.581  -5.411  -9.479
  403    QG   GLN  47           QG       GLN  47  -1.749  -7.829  -9.153
  404    QE2  GLN  47           QE2      GLN  47  -4.573  -8.105  -8.234
  405    H    GLY  48           H        GLY  48   0.771  -4.860  -7.188
  406   1HA   GLY  48          1HA       GLY  48   1.319  -7.367  -5.605
  407   2HA   GLY  48          2HA       GLY  48   2.164  -5.838  -5.304
  408    QA   GLY  48           QA       GLY  48   1.742  -6.603  -5.455
  409    H    CYS  49           H        CYS  49   0.107  -7.346  -3.489
  410    HA   CYS  49           HA       CYS  49  -1.903  -5.155  -3.387
  411   1HB   CYS  49          1HB       CYS  49  -2.451  -8.114  -3.039
  412   2HB   CYS  49          2HB       CYS  49  -3.599  -6.815  -2.942
  413    QB   CYS  49           QB       CYS  49  -3.025  -7.465  -2.990
  414    H    ALA  50           H        ALA  50  -2.828  -4.874  -1.397
  415    HA   ALA  50           HA       ALA  50  -1.418  -6.085   0.915
  416   1HB   ALA  50          3HB       ALA  50  -1.768  -3.097   0.381
  417   2HB   ALA  50          1HB       ALA  50  -1.243  -3.806   1.919
  418   3HB   ALA  50          2HB       ALA  50  -0.220  -3.966   0.475
  419    QB   ALA  50           QB       ALA  50  -1.077  -3.623   0.925
  420    H    THR  51           H        THR  51  -2.622  -6.225   2.725
  421    HA   THR  51           HA       THR  51  -5.514  -5.512   2.520
  422    HB   THR  51           HB       THR  51  -3.942  -6.998   4.646
  423    HG1  THR  51          1HG       THR  51  -5.151  -8.747   3.824
  424   1HG2  THR  51          2HG2      THR  51  -6.936  -6.485   4.294
  425   2HG2  THR  51          3HG2      THR  51  -6.212  -7.494   5.566
  426   3HG2  THR  51          1HG2      THR  51  -5.918  -5.746   5.553
  427    QG2  THR  51           QG2      THR  51  -6.355  -6.575   5.138
  428    H    ILE  52           H        ILE  52  -5.833  -3.445   2.938
  429    HA   ILE  52           HA       ILE  52  -3.949  -1.914   4.625
  430    HB   ILE  52           HB       ILE  52  -6.526  -0.952   3.340
  431   1HG1  ILE  52          1HG1      ILE  52  -5.284  -1.905   1.493
  432   2HG1  ILE  52          2HG1      ILE  52  -5.371  -0.149   1.402
  433   1HG2  ILE  52          2HG2      ILE  52  -4.017   0.467   4.252
  434   2HG2  ILE  52          3HG2      ILE  52  -5.349   1.240   3.367
  435   3HG2  ILE  52          1HG2      ILE  52  -5.629   0.536   4.974
  436   1HD1  ILE  52          3HD1      ILE  52  -3.009  -0.017   2.242
  437   2HD1  ILE  52          1HD1      ILE  52  -2.967  -1.802   2.214
  438   3HD1  ILE  52          2HD1      ILE  52  -3.172  -0.891   0.716
  439    QG1  ILE  52           QG1      ILE  52  -5.327  -1.027   1.447
  440    QG2  ILE  52           QG2      ILE  52  -4.998   0.747   4.197
  441    QD1  ILE  52           QD1      ILE  52  -3.049  -0.904   1.724
  442    H    TRP  53           H        TRP  53  -4.804  -0.990   6.617
  443    HA   TRP  53           HA       TRP  53  -7.277  -2.240   7.674
  444   1HB   TRP  53          1HB       TRP  53  -4.486  -2.191   8.725
  445   2HB   TRP  53          2HB       TRP  53  -5.799  -2.069   9.891
  446    HD1  TRP  53           HD       TRP  53  -7.543  -4.126  10.004
  447    HE1  TRP  53          1HE       TRP  53  -7.153  -6.633   9.737
  448    HE3  TRP  53          3HE       TRP  53  -3.452  -3.904   7.055
  449    HZ2  TRP  53          2HZ       TRP  53  -5.168  -8.358   8.465
  450    HZ3  TRP  53          3HZ       TRP  53  -2.369  -5.952   6.250
  451    HH2  TRP  53           HH       TRP  53  -3.122  -8.199   7.041
  452    QB   TRP  53           QB       TRP  53  -5.142  -2.130   9.308
  453    H    GLU  54           H        GLU  54  -8.347  -1.155   9.231
  454    HA   GLU  54           HA       GLU  54  -8.065   1.749   9.161
  455   1HB   GLU  54          1HB       GLU  54 -10.205   0.409   8.801
  456   2HB   GLU  54          2HB       GLU  54 -10.114  -0.148  10.471
  457   1HG   GLU  54          1HG       GLU  54 -10.489   2.117  11.288
  458   2HG   GLU  54          2HG       GLU  54 -10.454   2.761   9.625
  459    QB   GLU  54           QB       GLU  54 -10.160   0.130   9.636
  460    QG   GLU  54           QG       GLU  54 -10.472   2.439  10.456
  461    H    GLY  55           H        GLY  55  -7.554  -0.992  11.399
  462   1HA   GLY  55          1HA       GLY  55  -7.237   0.678  13.759
  463   2HA   GLY  55          2HA       GLY  55  -6.696  -0.971  13.570
  464    QA   GLY  55           QA       GLY  55  -6.967  -0.147  13.664
  465    H    SER  56           H        SER  56  -5.356   1.612  14.506
  466    HA   SER  56           HA       SER  56  -2.907   1.805  12.985
  467   1HB   SER  56          1HB       SER  56  -3.666   2.359  15.904
  468   2HB   SER  56          2HB       SER  56  -2.082   2.679  15.189
  469    HG   SER  56           HG       SER  56  -2.877   4.267  14.005
  470    QB   SER  56           QB       SER  56  -2.874   2.519  15.546
  471    H    GLY  57           H        GLY  57  -1.363   0.380  13.153
  472   1HA   GLY  57          1HA       GLY  57  -0.068  -1.432  13.835
  473   2HA   GLY  57          2HA       GLY  57  -1.145  -1.636  15.207
  474    QA   GLY  57           QA       GLY  57  -0.606  -1.534  14.521
  475    H    CYS  58           H        CYS  58  -2.299  -1.317  11.931
  476    HA   CYS  58           HA       CYS  58  -3.486  -2.560  10.577
  477   1HB   CYS  58          1HB       CYS  58  -2.197  -4.472   9.590
  478   2HB   CYS  58          2HB       CYS  58  -1.392  -2.906   9.598
  479    QB   CYS  58           QB       CYS  58  -1.794  -3.689   9.594
  480    H    VAL  59           H        VAL  59  -4.845  -2.831  12.706
  481    HA   VAL  59           HA       VAL  59  -5.831  -5.614  12.594
  482    HB   VAL  59           HB       VAL  59  -6.623  -5.145  14.955
  483   1HG1  VAL  59          3HG1      VAL  59  -4.813  -6.747  14.484
  484   2HG1  VAL  59          1HG1      VAL  59  -3.618  -5.439  14.554
  485   3HG1  VAL  59          2HG1      VAL  59  -4.517  -5.897  16.010
  486   1HG2  VAL  59          1HG2      VAL  59  -6.183  -2.718  15.066
  487   2HG2  VAL  59          2HG2      VAL  59  -5.397  -3.608  16.374
  488   3HG2  VAL  59          3HG2      VAL  59  -4.434  -3.034  15.009
  489    QG1  VAL  59           QG1      VAL  59  -4.316  -6.028  15.016
  490    QG2  VAL  59           QG2      VAL  59  -5.338  -3.120  15.483
  491    QQG  VAL  59           QQG      VAL  59  -4.827  -4.574  15.249
  492    H    GLY  60           H        GLY  60  -8.268  -5.467  13.342
  493   1HA   GLY  60          1HA       GLY  60 -10.328  -4.318  13.346
  494   2HA   GLY  60          2HA       GLY  60  -9.491  -2.836  12.919
  495    QA   GLY  60           QA       GLY  60  -9.909  -3.577  13.133
  496    H    ARG  61           H        ARG  61 -10.819  -2.249  11.268
  497    HA   ARG  61           HA       ARG  61 -11.979  -4.191   9.393
  498   1HB   ARG  61          1HB       ARG  61 -12.818  -1.777  10.509
  499   2HB   ARG  61          2HB       ARG  61 -12.104  -1.224   9.002
  500   1HG   ARG  61          1HG       ARG  61 -13.663  -3.069   7.914
  501   2HG   ARG  61          2HG       ARG  61 -14.427  -3.109   9.509
  502   1HD   ARG  61          1HD       ARG  61 -15.721  -1.434   8.760
  503   2HD   ARG  61          2HD       ARG  61 -14.365  -0.372   9.068
  504    HE   ARG  61           HE       ARG  61 -15.425  -1.310   6.499
  505   1HH1  ARG  61          2HH2      ARG  61 -12.843   0.642   7.960
  506   2HH1  ARG  61          1HH2      ARG  61 -11.883   0.702   6.550
  507   1HH2  ARG  61          2HH1      ARG  61 -14.172  -1.150   4.542
  508   2HH2  ARG  61          1HH1      ARG  61 -12.694  -0.232   4.567
  509    QB   ARG  61           QB       ARG  61 -12.461  -1.501   9.756
  510    QG   ARG  61           QG       ARG  61 -14.045  -3.089   8.711
  511    QD   ARG  61           QD       ARG  61 -15.043  -0.903   8.914
  512    QH1  ARG  61           QH2      ARG  61 -12.363   0.672   7.255
  513    QH2  ARG  61           QH1      ARG  61 -13.433  -0.691   4.555
  514    H    SER  62           H        SER  62 -11.489  -4.475   7.232
  515    HA   SER  62           HA       SER  62  -9.164  -2.997   6.379
  516   1HB   SER  62          1HB       SER  62  -8.369  -5.604   5.893
  517   2HB   SER  62          2HB       SER  62  -7.764  -4.575   7.164
  518    HG   SER  62           HG       SER  62  -9.303  -5.479   8.602
  519    QB   SER  62           QB       SER  62  -8.067  -5.090   6.529
  520    H    THR  63           H        THR  63  -8.510  -3.143   4.243
  521    HA   THR  63           HA       THR  63 -10.524  -4.239   2.308
  522    HB   THR  63           HB       THR  63 -10.017  -2.081   1.049
  523    HG1  THR  63          1HG       THR  63  -8.099  -1.679   2.261
  524   1HG2  THR  63          1HG2      THR  63 -12.069  -2.463   2.451
  525   2HG2  THR  63          2HG2      THR  63 -11.218  -1.673   3.804
  526   3HG2  THR  63          3HG2      THR  63 -11.555  -0.777   2.297
  527    QG2  THR  63           QG2      THR  63 -11.614  -1.638   2.851
  528    H    THR  64           H        THR  64  -9.503  -5.771   1.142
  529    HA   THR  64           HA       THR  64  -6.625  -5.963   0.731
  530    HB   THR  64           HB       THR  64  -7.695  -7.644  -1.073
  531    HG1  THR  64          1HG       THR  64  -9.660  -7.483   1.005
  532   1HG2  THR  64          1HG2      THR  64  -7.623  -8.077   1.945
  533   2HG2  THR  64          2HG2      THR  64  -7.684  -9.362   0.716
  534   3HG2  THR  64          3HG2      THR  64  -6.270  -8.300   0.817
  535    QG2  THR  64           QG2      THR  64  -7.192  -8.580   1.159
  536    H    MET  65           H        MET  65  -5.931  -4.032  -0.127
  537    HA   MET  65           HA       MET  65  -7.221  -2.933  -2.556
  538   1HB   MET  65          1HB       MET  65  -6.683  -1.516  -0.555
  539   2HB   MET  65          2HB       MET  65  -4.958  -1.818  -0.844
  540   1HG   MET  65          1HG       MET  65  -6.824  -0.623  -2.918
  541   2HG   MET  65          2HG       MET  65  -5.970   0.363  -1.734
  542   1HE   MET  65          1HE       MET  65  -6.006   0.521  -4.980
  543   2HE   MET  65          2HE       MET  65  -5.251   1.758  -3.943
  544   3HE   MET  65          3HE       MET  65  -4.324   1.013  -5.270
  545    QB   MET  65           QB       MET  65  -5.820  -1.667  -0.699
  546    QG   MET  65           QG       MET  65  -6.397  -0.130  -2.326
  547    QE   MET  65           QE       MET  65  -5.194   1.097  -4.731
  548    H    CYS  66           H        CYS  66  -6.228  -3.111  -4.524
  549    HA   CYS  66           HA       CYS  66  -3.500  -4.356  -4.663
  550   1HB   CYS  66          1HB       CYS  66  -5.905  -4.763  -6.450
  551   2HB   CYS  66          2HB       CYS  66  -4.271  -5.202  -6.924
  552    QB   CYS  66           QB       CYS  66  -5.088  -4.982  -6.687
  553    H    CYS  67           H        CYS  67  -2.115  -3.321  -6.062
  554    HA   CYS  67           HA       CYS  67  -3.144  -1.029  -7.685
  555   1HB   CYS  67          1HB       CYS  67  -2.198  -0.283  -5.548
  556   2HB   CYS  67          2HB       CYS  67  -0.687  -1.072  -5.943
  557    QB   CYS  67           QB       CYS  67  -1.442  -0.678  -5.745
  558    HA   PRO  68           HA       PRO  68  -0.700  -3.695 -10.345
  559   1HB   PRO  68          1HB       PRO  68  -1.378  -2.542 -12.826
  560   2HB   PRO  68          2HB       PRO  68  -2.237  -3.844 -11.983
  561   1HG   PRO  68          1HG       PRO  68  -2.841  -0.904 -12.093
  562   2HG   PRO  68          2HG       PRO  68  -4.008  -2.234 -11.996
  563   1HD   PRO  68          1HD       PRO  68  -3.252  -0.585  -9.898
  564   2HD   PRO  68          2HD       PRO  68  -3.872  -2.242  -9.670
  565    QB   PRO  68           QB       PRO  68  -1.807  -3.193 -12.404
  566    QG   PRO  68           QG       PRO  68  -3.424  -1.569 -12.045
  567    QD   PRO  68           QD       PRO  68  -3.562  -1.414  -9.784
  568    H    ALA  69           H        ALA  69   0.919  -3.520 -12.125
  569    HA   ALA  69           HA       ALA  69   2.917  -1.681 -11.037
  570   1HB   ALA  69          3HB       ALA  69   3.067  -3.660 -13.308
  571   2HB   ALA  69          1HB       ALA  69   4.441  -2.692 -12.756
  572   3HB   ALA  69          2HB       ALA  69   3.707  -3.872 -11.668
  573    QB   ALA  69           QB       ALA  69   3.738  -3.408 -12.577
  574    H    ASN  70           H        ASN  70   4.032  -0.104 -12.303
  575    HA   ASN  70           HA       ASN  70   3.836   2.012 -13.161
  576   1HB   ASN  70          1HB       ASN  70   2.841   0.311 -15.465
  577   2HB   ASN  70          2HB       ASN  70   2.846   2.073 -15.607
  578   1HD2  ASN  70          2HD2      ASN  70   6.144   0.358 -16.726
  579   2HD2  ASN  70          1HD2      ASN  70   4.531  -0.346 -16.734
  580    QB   ASN  70           QB       ASN  70   2.844   1.192 -15.536
  581    QD2  ASN  70           QD2      ASN  70   5.337   0.006 -16.730
  582    H    THR  71           H        THR  71   2.038   1.709 -11.226
  583    HA   THR  71           HA       THR  71  -0.158   3.312 -12.278
  584    HB   THR  71           HB       THR  71  -0.969   0.977 -10.550
  585    HG1  THR  71          1HG       THR  71  -0.198   0.155 -12.534
  586   1HG2  THR  71          3HG2      THR  71  -2.499   2.868 -12.376
  587   2HG2  THR  71          1HG2      THR  71  -3.191   1.543 -11.417
  588   3HG2  THR  71          2HG2      THR  71  -2.441   2.923 -10.599
  589    QG2  THR  71           QG2      THR  71  -2.710   2.445 -11.464
  590    H    CYS  72           H        CYS  72   0.211   5.065 -11.115
  591    HA   CYS  72           HA       CYS  72   1.199   4.934  -8.319
  592   1HB   CYS  72          1HB       CYS  72   1.982   6.903  -9.422
  593   2HB   CYS  72          2HB       CYS  72   0.459   7.093 -10.314
  594    QB   CYS  72           QB       CYS  72   1.221   6.998  -9.868
  595    H    CYS  73           H        CYS  73  -0.268   4.706  -6.624
  596    HA   CYS  73           HA       CYS  73  -3.197   4.950  -7.197
  597   1HB   CYS  73          1HB       CYS  73  -1.660   2.960  -5.494
  598   2HB   CYS  73          2HB       CYS  73  -3.402   3.160  -5.522
  599    QB   CYS  73           QB       CYS  73  -2.531   3.060  -5.508
  600    H    ASN  74           H        ASN  74  -4.430   5.922  -5.574
  601    HA   ASN  74           HA       ASN  74  -2.911   7.491  -3.506
  602   1HB   ASN  74          1HB       ASN  74  -3.911   8.980  -5.105
  603   2HB   ASN  74          2HB       ASN  74  -5.443   8.149  -5.001
  604   1HD2  ASN  74          2HD2      ASN  74  -6.508  10.113  -2.266
  605   2HD2  ASN  74          1HD2      ASN  74  -6.927   8.930  -3.506
  606    QB   ASN  74           QB       ASN  74  -4.677   8.564  -5.053
  607    QD2  ASN  74           QD2      ASN  74  -6.718   9.522  -2.886
  608    H    ILE  75           H        ILE  75  -3.246   6.712  -1.546
  609    HA   ILE  75           HA       ILE  75  -5.393   4.749  -1.010
  610    HB   ILE  75           HB       ILE  75  -2.711   5.402   0.288
  611   1HG1  ILE  75          1HG1      ILE  75  -2.145   3.132  -0.370
  612   2HG1  ILE  75          2HG1      ILE  75  -3.767   2.837  -1.020
  613   1HG2  ILE  75          1HG2      ILE  75  -4.770   3.331   1.122
  614   2HG2  ILE  75          2HG2      ILE  75  -3.077   3.377   1.665
  615   3HG2  ILE  75          3HG2      ILE  75  -4.161   4.684   2.116
  616   1HD1  ILE  75          2HD1      ILE  75  -1.957   5.018  -2.029
  617   2HD1  ILE  75          3HD1      ILE  75  -1.862   3.353  -2.643
  618   3HD1  ILE  75          1HD1      ILE  75  -3.344   4.255  -2.873
  619    QG1  ILE  75           QG1      ILE  75  -2.956   2.984  -0.695
  620    QG2  ILE  75           QG2      ILE  75  -4.003   3.798   1.634
  621    QD1  ILE  75           QD1      ILE  75  -2.387   4.209  -2.515
  622    H    ASN  76           H        ASN  76  -6.853   6.600  -1.151
  623    HA   ASN  76           HA       ASN  76  -7.235   7.817   1.564
  624   1HB   ASN  76          1HB       ASN  76  -6.631   9.583  -0.044
  625   2HB   ASN  76          2HB       ASN  76  -7.957   9.051  -1.109
  626   1HD2  ASN  76          2HD2      ASN  76  -9.360  11.883   0.690
  627   2HD2  ASN  76          1HD2      ASN  76  -8.016  11.594  -0.420
  628    QB   ASN  76           QB       ASN  76  -7.294   9.317  -0.576
  629    QD2  ASN  76           QD2      ASN  76  -8.688  11.739   0.135
  630    H    THR  77           H        THR  77  -8.369   5.826   2.039
  631    HA   THR  77           HA       THR  77 -10.644   5.017   0.429
  632    HB   THR  77           HB       THR  77 -10.953   3.670   2.649
  633    HG1  THR  77          1HG       THR  77  -9.560   4.910   3.941
  634   1HG2  THR  77          3HG2      THR  77  -8.445   3.291   0.942
  635   2HG2  THR  77          1HG2      THR  77  -9.096   2.091   2.059
  636   3HG2  THR  77          2HG2      THR  77 -10.050   2.572   0.651
  637    QG2  THR  77           QG2      THR  77  -9.197   2.651   1.218
  638    H    GLY  78           H        GLY  78 -12.828   4.871   1.642
  639   1HA   GLY  78          1HA       GLY  78 -13.723   7.498   2.360
  640   2HA   GLY  78          2HA       GLY  78 -14.610   5.981   2.605
  641    QA   GLY  78           QA       GLY  78 -14.167   6.739   2.482
  642    H    PHE  79           H        PHE  79 -12.478   4.749   4.223
  643    HA   PHE  79           HA       PHE  79 -12.890   6.156   6.814
  644   1HB   PHE  79          1HB       PHE  79 -11.905   4.114   7.784
  645   2HB   PHE  79          2HB       PHE  79 -13.392   3.813   6.966
  646    HD1  PHE  79          2HD       PHE  79 -13.181   2.766   4.470
  647    HD2  PHE  79          1HD       PHE  79  -9.881   2.988   7.278
  648    HE1  PHE  79          2HE       PHE  79 -11.795   1.351   3.022
  649    HE2  PHE  79          1HE       PHE  79  -8.629   1.387   5.917
  650   1HZ   PHE  79           HZ       PHE  79  -9.560   0.574   3.796
  651    QB   PHE  79           QB       PHE  79 -12.648   3.963   7.375
  652    QG   PHE  79           QD       PHE  79 -11.531   2.877   5.874
  653    QZ   PHE  79           QE       PHE  79 -10.212   1.369   4.469
  654    QZ   PHE  79           QR       PHE  79 -10.609   1.813   4.896
  655    H    TYR  80           H        TYR  80 -11.084   6.261   8.202
  656    HA   TYR  80           HA       TYR  80  -8.934   7.503   6.694
  657   1HB   TYR  80          1HB       TYR  80  -9.840   8.707   8.578
  658   2HB   TYR  80          2HB       TYR  80  -9.461   7.374   9.670
  659    HD1  TYR  80          2HD       TYR  80  -7.286   8.952   6.994
  660    HD2  TYR  80          1HD       TYR  80  -7.890   8.339  11.209
  661    HE1  TYR  80          2HE       TYR  80  -4.868   8.916   7.333
  662    HE2  TYR  80          1HE       TYR  80  -5.420   8.362  11.551
  663    HH   TYR  80           HH       TYR  80  -3.511   7.576   8.886
  664    QB   TYR  80           QB       TYR  80  -9.651   8.040   9.124
  665    QG   TYR  80           QD       TYR  80  -7.588   8.645   9.101
  666    QZ   TYR  80           QE       TYR  80  -5.144   8.639   9.442
  667    QR   TYR  80           QR       TYR  80  -6.366   8.642   9.272
  668    H    ILE  81           H        ILE  81  -6.856   6.685   6.519
  669    HA   ILE  81           HA       ILE  81  -6.566   3.847   7.124
  670    HB   ILE  81           HB       ILE  81  -4.417   4.372   5.644
  671   1HG1  ILE  81          1HG1      ILE  81  -5.138   6.877   5.535
  672   2HG1  ILE  81          2HG1      ILE  81  -4.613   6.066   4.081
  673   1HG2  ILE  81          2HG2      ILE  81  -7.248   3.853   4.740
  674   2HG2  ILE  81          3HG2      ILE  81  -5.809   3.629   3.707
  675   3HG2  ILE  81          1HG2      ILE  81  -6.015   2.692   5.201
  676   1HD1  ILE  81          2HD1      ILE  81  -7.578   6.226   4.706
  677   2HD1  ILE  81          3HD1      ILE  81  -6.674   7.465   3.820
  678   3HD1  ILE  81          1HD1      ILE  81  -6.753   5.794   3.209
  679    QG1  ILE  81           QG1      ILE  81  -4.875   6.471   4.808
  680    QG2  ILE  81           QG2      ILE  81  -6.357   3.391   4.549
  681    QD1  ILE  81           QD1      ILE  81  -7.002   6.495   3.912
  682    H    ARG  82           H        ARG  82  -5.051   3.059   8.554
  683    HA   ARG  82           HA       ARG  82  -2.957   4.976   9.574
  684   1HB   ARG  82          1HB       ARG  82  -4.416   2.857  11.186
  685   2HB   ARG  82          2HB       ARG  82  -2.991   3.784  11.690
  686   1HG   ARG  82          1HG       ARG  82  -4.323   5.372  12.437
  687   2HG   ARG  82          2HG       ARG  82  -4.707   5.771  10.745
  688   1HD   ARG  82          1HD       ARG  82  -6.535   4.153  10.767
  689   2HD   ARG  82          2HD       ARG  82  -6.159   3.770  12.489
  690    HE   ARG  82           HE       ARG  82  -6.649   6.440  12.608
  691   1HH1  ARG  82          2HH2      ARG  82  -8.441   3.665  11.383
  692   2HH1  ARG  82          1HH2      ARG  82 -10.013   4.362  11.550
  693   1HH2  ARG  82          2HH1      ARG  82  -8.598   7.282  13.148
  694   2HH2  ARG  82          1HH1      ARG  82 -10.132   6.532  12.720
  695    QB   ARG  82           QB       ARG  82  -3.703   3.321  11.438
  696    QG   ARG  82           QG       ARG  82  -4.515   5.572  11.591
  697    QD   ARG  82           QD       ARG  82  -6.347   3.961  11.628
  698    QH1  ARG  82           QH2      ARG  82  -9.227   4.013  11.467
  699    QH2  ARG  82           QH1      ARG  82  -9.365   6.907  12.934
  700    H    SER  83           H        SER  83  -3.705   1.582   8.740
  701    HA   SER  83           HA       SER  83  -0.880   1.499   7.922
  702   1HB   SER  83          1HB       SER  83  -0.398  -0.610   9.337
  703   2HB   SER  83          2HB       SER  83  -0.342   0.974  10.086
  704    HG   SER  83           HG       SER  83  -2.609   0.590  10.705
  705    QB   SER  83           QB       SER  83  -0.370   0.182   9.712
  706    H    TYR  84           H        TYR  84  -0.058  -0.592   6.981
  707    HA   TYR  84           HA       TYR  84  -2.190  -2.392   6.030
  708   1HB   TYR  84          1HB       TYR  84  -1.577  -2.368   3.796
  709   2HB   TYR  84          2HB       TYR  84  -1.795  -0.683   4.199
  710    HD1  TYR  84          1HD       TYR  84   0.602  -3.356   3.285
  711    HD2  TYR  84          2HD       TYR  84   0.052   0.875   3.807
  712    HE1  TYR  84          1HE       TYR  84   2.661  -2.944   2.013
  713    HE2  TYR  84          2HE       TYR  84   1.979   1.274   2.319
  714    HH   TYR  84           HH       TYR  84   3.966   0.311   1.435
  715    QB   TYR  84           QB       TYR  84  -1.686  -1.525   3.998
  716    QG   TYR  84           QD       TYR  84   0.327  -1.240   3.546
  717    QZ   TYR  84           QE       TYR  84   2.320  -0.835   2.166
  718    QR   TYR  84           QR       TYR  84   1.323  -1.038   2.856
  719    H    ARG  85           H        ARG  85  -1.397  -4.371   5.127
  720    HA   ARG  85           HA       ARG  85   1.488  -4.926   5.385
  721   1HB   ARG  85          1HB       ARG  85  -0.314  -5.952   7.167
  722   2HB   ARG  85          2HB       ARG  85  -0.476  -7.167   5.903
  723   1HG   ARG  85          1HG       ARG  85   1.386  -8.176   6.566
  724   2HG   ARG  85          2HG       ARG  85   2.349  -6.701   6.362
  725   1HD   ARG  85          1HD       ARG  85   1.525  -5.866   8.536
  726   2HD   ARG  85          2HD       ARG  85   0.498  -7.292   8.670
  727    HE   ARG  85           HE       ARG  85   2.991  -8.425   8.479
  728   1HH1  ARG  85          2HH2      ARG  85   1.047  -7.134  10.947
  729   2HH1  ARG  85          1HH2      ARG  85   2.286  -6.682  12.080
  730   1HH2  ARG  85          2HH1      ARG  85   4.776  -8.257  10.013
  731   2HH2  ARG  85          1HH1      ARG  85   4.389  -7.737  11.650
  732    QB   ARG  85           QB       ARG  85  -0.395  -6.560   6.535
  733    QG   ARG  85           QG       ARG  85   1.867  -7.438   6.464
  734    QD   ARG  85           QD       ARG  85   1.012  -6.579   8.603
  735    QH1  ARG  85           QH2      ARG  85   1.667  -6.908  11.514
  736    QH2  ARG  85           QH1      ARG  85   4.582  -7.997  10.832
  737    H    ARG  86           H        ARG  86   2.254  -5.975   3.475
  738    HA   ARG  86           HA       ARG  86   0.672  -6.354   1.193
  739   1HB   ARG  86          1HB       ARG  86   3.100  -7.883   2.148
  740   2HB   ARG  86          2HB       ARG  86   2.407  -8.074   0.543
  741   1HG   ARG  86          1HG       ARG  86   3.253  -5.336   1.543
  742   2HG   ARG  86          2HG       ARG  86   4.386  -6.425   0.723
  743   1HD   ARG  86          1HD       ARG  86   1.750  -5.455  -0.469
  744   2HD   ARG  86          2HD       ARG  86   3.342  -4.794  -0.756
  745    HE   ARG  86           HE       ARG  86   2.190  -7.300  -1.847
  746   1HH1  ARG  86          2HH2      ARG  86   5.212  -5.560  -1.202
  747   2HH1  ARG  86          1HH2      ARG  86   5.919  -6.053  -2.721
  748   1HH2  ARG  86          2HH1      ARG  86   3.308  -8.296  -3.501
  749   2HH2  ARG  86          1HH1      ARG  86   4.945  -7.860  -3.922
  750    QB   ARG  86           QB       ARG  86   2.754  -7.978   1.345
  751    QG   ARG  86           QG       ARG  86   3.819  -5.880   1.133
  752    QD   ARG  86           QD       ARG  86   2.546  -5.125  -0.613
  753    QH1  ARG  86           QH2      ARG  86   5.565  -5.806  -1.961
  754    QH2  ARG  86           QH1      ARG  86   4.126  -8.078  -3.711
  755    H    VAL  87           H        VAL  87  -0.215  -8.221   0.172
  756    HA   VAL  87           HA       VAL  87  -0.390 -10.699   1.819
  757    HB   VAL  87           HB       VAL  87  -2.603 -11.154   0.682
  758   1HG1  VAL  87          1HG1      VAL  87  -2.322 -10.646   3.092
  759   2HG1  VAL  87          2HG1      VAL  87  -2.542  -8.916   2.743
  760   3HG1  VAL  87          3HG1      VAL  87  -3.861 -10.077   2.435
  761   1HG2  VAL  87          3HG2      VAL  87  -2.547  -9.264  -0.965
  762   2HG2  VAL  87          1HG2      VAL  87  -4.005  -9.278   0.035
  763   3HG2  VAL  87          2HG2      VAL  87  -2.716  -8.117   0.378
  764    QG1  VAL  87           QG1      VAL  87  -2.908  -9.880   2.756
  765    QG2  VAL  87           QG2      VAL  87  -3.089  -8.886  -0.184
  766    QQG  VAL  87           QQG      VAL  87  -2.999  -9.383   1.286
  767    H    GLU  88           H        GLU  88   0.022  -9.167  -1.405
  768    HA   GLU  88           HA       GLU  88   1.493 -11.557  -2.105
  769   1HB   GLU  88          1HB       GLU  88   0.363 -11.701  -4.331
  770   2HB   GLU  88          2HB       GLU  88  -0.629 -12.263  -2.985
  771   1HG   GLU  88          1HG       GLU  88  -1.893 -10.211  -2.946
  772   2HG   GLU  88          2HG       GLU  88  -0.898  -9.516  -4.250
  773    QB   GLU  88           QB       GLU  88  -0.133 -11.982  -3.658
  774    QG   GLU  88           QG       GLU  88  -1.396  -9.863  -3.598
   
  No H/Q in entry =         774
  Start of MODEL    6
    1   1HA   GLY   1          1HA       GLY   1  14.418  -9.179 -11.959
    2   2HA   GLY   1          2HA       GLY   1  13.680  -7.625 -12.388
    3    QA   GLY   1           QA       GLY   1  14.049  -8.402 -12.174
    4    H    ASP   2           H        ASP   2  11.393  -9.312 -10.480
    5    HA   ASP   2           HA       ASP   2  10.667  -9.156  -8.467
    6   1HB   ASP   2          1HB       ASP   2  12.028  -9.703  -6.803
    7   2HB   ASP   2          2HB       ASP   2  13.394  -9.498  -7.877
    8    QB   ASP   2           QB       ASP   2  12.711  -9.601  -7.340
    9    H    GLY   3           H        GLY   3   9.291  -7.691  -7.803
   10   1HA   GLY   3          1HA       GLY   3   9.786  -4.880  -8.652
   11   2HA   GLY   3          2HA       GLY   3   8.211  -5.683  -8.522
   12    QA   GLY   3           QA       GLY   3   8.998  -5.282  -8.587
   13    H    TYR   4           H        TYR   4   9.114  -3.183  -7.463
   14    HA   TYR   4           HA       TYR   4   9.074  -3.543  -4.528
   15   1HB   TYR   4          1HB       TYR   4   9.080  -1.005  -4.541
   16   2HB   TYR   4          2HB       TYR   4  10.508  -1.844  -5.061
   17    HD1  TYR   4          2HD       TYR   4   7.580   0.172  -6.212
   18    HD2  TYR   4          1HD       TYR   4  11.381  -1.532  -7.310
   19    HE1  TYR   4          2HE       TYR   4   7.535   1.438  -8.344
   20    HE2  TYR   4          1HE       TYR   4  11.347  -0.238  -9.417
   21    HH   TYR   4           HH       TYR   4   8.797   2.022 -10.309
   22    QB   TYR   4           QB       TYR   4   9.794  -1.425  -4.801
   23    QG   TYR   4           QD       TYR   4   9.481  -0.680  -6.761
   24    QZ   TYR   4           QE       TYR   4   9.441   0.600  -8.880
   25    QR   TYR   4           QR       TYR   4   9.461  -0.040  -7.821
   26    H    LEU   5           H        LEU   5   7.576  -2.567  -3.327
   27    HA   LEU   5           HA       LEU   5   5.296  -1.223  -4.477
   28   1HB   LEU   5          1HB       LEU   5   4.410  -3.480  -4.364
   29   2HB   LEU   5          2HB       LEU   5   4.829  -3.592  -2.657
   30    HG   LEU   5           HG       LEU   5   3.041  -1.327  -3.609
   31   1HD1  LEU   5          1HD1      LEU   5   2.275  -4.249  -3.466
   32   2HD1  LEU   5          2HD1      LEU   5   1.083  -2.985  -3.157
   33   3HD1  LEU   5          3HD1      LEU   5   1.931  -3.047  -4.703
   34   1HD2  LEU   5          2HD2      LEU   5   3.293  -2.871  -1.001
   35   2HD2  LEU   5          3HD2      LEU   5   3.604  -1.158  -1.301
   36   3HD2  LEU   5          1HD2      LEU   5   1.958  -1.768  -1.361
   37    QB   LEU   5           QB       LEU   5   4.620  -3.536  -3.511
   38    QD1  LEU   5           QD1      LEU   5   1.763  -3.427  -3.776
   39    QD2  LEU   5           QD2      LEU   5   2.952  -1.932  -1.221
   40    QQD  LEU   5           QQD      LEU   5   2.357  -2.680  -2.498
   41    H    ILE   6           H        ILE   6   5.555   0.631  -3.494
   42    HA   ILE   6           HA       ILE   6   6.506   0.861  -0.702
   43    HB   ILE   6           HB       ILE   6   8.107   2.631  -1.584
   44   1HG1  ILE   6          1HG1      ILE   6   8.986   1.487  -3.996
   45   2HG1  ILE   6          2HG1      ILE   6   7.250   1.596  -4.252
   46   1HG2  ILE   6          1HG2      ILE   6   8.791   0.476  -0.623
   47   2HG2  ILE   6          2HG2      ILE   6   8.776  -0.259  -2.234
   48   3HG2  ILE   6          3HG2      ILE   6   9.898   1.064  -1.871
   49   1HD1  ILE   6          1HD1      ILE   6   9.056   3.881  -3.410
   50   2HD1  ILE   6          2HD1      ILE   6   8.420   3.590  -5.040
   51   3HD1  ILE   6          3HD1      ILE   6   7.314   3.990  -3.717
   52    QG1  ILE   6           QG1      ILE   6   8.118   1.542  -4.124
   53    QG2  ILE   6           QG2      ILE   6   9.155   0.427  -1.576
   54    QD1  ILE   6           QD1      ILE   6   8.263   3.820  -4.056
   55    H    MET   7           H        MET   7   4.887   2.055   0.197
   56    HA   MET   7           HA       MET   7   3.264   3.638  -1.639
   57   1HB   MET   7          1HB       MET   7   1.708   3.759  -0.080
   58   2HB   MET   7          2HB       MET   7   2.480   2.291   0.460
   59   1HG   MET   7          1HG       MET   7   3.630   3.566   2.238
   60   2HG   MET   7          2HG       MET   7   2.943   5.069   1.618
   61   1HE   MET   7          2HE       MET   7   0.324   5.331   1.194
   62   2HE   MET   7          3HE       MET   7  -0.262   3.682   0.939
   63   3HE   MET   7          1HE       MET   7  -0.893   4.634   2.289
   64    QB   MET   7           QB       MET   7   2.094   3.025   0.190
   65    QG   MET   7           QG       MET   7   3.287   4.317   1.928
   66    QE   MET   7           QE       MET   7  -0.277   4.549   1.474
   67    H    CYS   8           H        CYS   8   2.996   5.945  -1.500
   68    HA   CYS   8           HA       CYS   8   5.477   7.377  -0.733
   69   1HB   CYS   8          1HB       CYS   8   3.956   7.589  -3.338
   70   2HB   CYS   8          2HB       CYS   8   5.306   8.593  -2.877
   71    QB   CYS   8           QB       CYS   8   4.631   8.091  -3.107
   72    H    LYS   9           H        LYS   9   5.151   9.635  -0.439
   73    HA   LYS   9           HA       LYS   9   2.609   9.953   0.693
   74   1HB   LYS   9          1HB       LYS   9   3.237  11.833   1.650
   75   2HB   LYS   9          2HB       LYS   9   4.811  11.045   1.384
   76   1HG   LYS   9          1HG       LYS   9   4.815  12.455  -0.793
   77   2HG   LYS   9          2HG       LYS   9   3.470  13.366  -0.036
   78   1HD   LYS   9          1HD       LYS   9   4.882  13.885   1.903
   79   2HD   LYS   9          2HD       LYS   9   6.203  12.889   1.250
   80   1HE   LYS   9          1HE       LYS   9   6.099  14.518  -0.812
   81   2HE   LYS   9          2HE       LYS   9   5.142  15.550   0.260
   82   1HZ   LYS   9          2HZ       LYS   9   7.219  15.108   1.814
   83   2HZ   LYS   9          3HZ       LYS   9   7.976  14.886   0.352
   84   3HZ   LYS   9          1HZ       LYS   9   7.197  16.287   0.651
   85    QB   LYS   9           QB       LYS   9   4.024  11.439   1.517
   86    QG   LYS   9           QG       LYS   9   4.142  12.911  -0.414
   87    QD   LYS   9           QD       LYS   9   5.542  13.387   1.576
   88    QE   LYS   9           QE       LYS   9   5.621  15.034  -0.276
   89    QZ   LYS   9           QZ       LYS   9   7.464  15.427   0.939
   90    H    ASN  10           H        ASN  10   3.835  10.707  -2.335
   91    HA   ASN  10           HA       ASN  10   1.297  11.929  -3.306
   92   1HB   ASN  10          1HB       ASN  10   2.349  13.575  -4.616
   93   2HB   ASN  10          2HB       ASN  10   3.102  13.656  -3.030
   94   1HD2  ASN  10          2HD2      ASN  10   5.924  13.897  -5.355
   95   2HD2  ASN  10          1HD2      ASN  10   4.612  14.938  -4.853
   96    QB   ASN  10           QB       ASN  10   2.726  13.615  -3.823
   97    QD2  ASN  10           QD2      ASN  10   5.268  14.417  -5.104
   98    H    CYS  11           H        CYS  11   2.068  12.038  -6.039
   99    HA   CYS  11           HA       CYS  11   2.008   9.115  -6.676
  100   1HB   CYS  11          1HB       CYS  11   0.139  10.618  -7.216
  101   2HB   CYS  11          2HB       CYS  11   1.176  11.533  -8.304
  102    QB   CYS  11           QB       CYS  11   0.658  11.075  -7.760
  103    H    ASP  12           H        ASP  12   4.387  10.865  -6.151
  104    HA   ASP  12           HA       ASP  12   5.852  10.408  -8.722
  105   1HB   ASP  12          1HB       ASP  12   5.714  12.763  -8.168
  106   2HB   ASP  12          2HB       ASP  12   6.423  12.429  -6.569
  107    QB   ASP  12           QB       ASP  12   6.068  12.596  -7.369
  108    HA   PRO  13           HA       PRO  13   7.896   7.478  -5.894
  109   1HB   PRO  13          1HB       PRO  13   9.331   6.255  -8.013
  110   2HB   PRO  13          2HB       PRO  13   7.917   5.628  -7.130
  111   1HG   PRO  13          1HG       PRO  13   8.057   6.870  -9.818
  112   2HG   PRO  13          2HG       PRO  13   6.779   5.832  -9.143
  113   1HD   PRO  13          1HD       PRO  13   6.636   8.587  -9.534
  114   2HD   PRO  13          2HD       PRO  13   5.567   7.682  -8.428
  115    QB   PRO  13           QB       PRO  13   8.624   5.941  -7.572
  116    QG   PRO  13           QG       PRO  13   7.418   6.351  -9.481
  117    QD   PRO  13           QD       PRO  13   6.102   8.134  -8.981
  118    H    ASN  14           H        ASN  14   9.149   9.813  -8.246
  119    HA   ASN  14           HA       ASN  14  11.921   9.451  -7.616
  120   1HB   ASN  14          1HB       ASN  14  11.091  10.506  -9.686
  121   2HB   ASN  14          2HB       ASN  14  10.513  11.892  -8.767
  122   1HD2  ASN  14          2HD2      ASN  14  13.669  13.055 -10.114
  123   2HD2  ASN  14          1HD2      ASN  14  11.963  12.832 -10.526
  124    QB   ASN  14           QB       ASN  14  10.802  11.199  -9.226
  125    QD2  ASN  14           QD2      ASN  14  12.816  12.944 -10.320
  126    H    THR  15           H        THR  15   9.909  12.295  -6.805
  127    HA   THR  15           HA       THR  15  11.316  12.461  -4.174
  128    HB   THR  15           HB       THR  15  12.359  14.056  -5.616
  129    HG1  THR  15          1HG       THR  15  10.548  15.159  -3.766
  130   1HG2  THR  15          1HG2      THR  15   9.564  15.126  -6.189
  131   2HG2  THR  15          2HG2      THR  15  11.070  15.995  -6.538
  132   3HG2  THR  15          3HG2      THR  15  10.733  14.460  -7.351
  133    QG2  THR  15           QG2      THR  15  10.456  15.193  -6.692
  134    H    GLY  16           H        GLY  16   8.730  11.187  -4.827
  135   1HA   GLY  16          1HA       GLY  16   6.794  12.762  -3.354
  136   2HA   GLY  16          2HA       GLY  16   6.844  10.978  -3.539
  137    QA   GLY  16           QA       GLY  16   6.819  11.870  -3.447
  138    H    SER  17           H        SER  17   9.440  10.598  -2.551
  139    HA   SER  17           HA       SER  17  10.364   9.945  -0.630
  140   1HB   SER  17          1HB       SER  17   9.619  12.305   0.327
  141   2HB   SER  17          2HB       SER  17   8.491  11.293   1.264
  142    HG   SER  17           HG       SER  17  10.414  11.519   2.365
  143    QB   SER  17           QB       SER  17   9.055  11.799   0.796
  144    H    CYS  18           H        CYS  18   9.972   7.994  -0.361
  145    HA   CYS  18           HA       CYS  18   7.284   6.827  -0.106
  146   1HB   CYS  18          1HB       CYS  18   9.642   6.154  -1.908
  147   2HB   CYS  18          2HB       CYS  18   8.163   5.232  -1.780
  148    QB   CYS  18           QB       CYS  18   8.902   5.693  -1.844
  149    H    ASP  19           H        ASP  19   7.251   5.000   1.236
  150    HA   ASP  19           HA       ASP  19   9.788   4.598   2.703
  151   1HB   ASP  19          1HB       ASP  19   8.508   2.996   4.042
  152   2HB   ASP  19          2HB       ASP  19   8.110   4.703   4.151
  153    QB   ASP  19           QB       ASP  19   8.309   3.849   4.096
  154    H    TRP  20           H        TRP  20  11.025   3.888   1.138
  155    HA   TRP  20           HA       TRP  20  10.849   1.147   0.079
  156   1HB   TRP  20          1HB       TRP  20  13.159   3.114   0.313
  157   2HB   TRP  20          2HB       TRP  20  13.188   1.609  -0.587
  158    HD1  TRP  20           HD       TRP  20  12.076   5.210  -0.883
  159    HE1  TRP  20          1HE       TRP  20  11.550   5.727  -3.325
  160    HE3  TRP  20          3HE       TRP  20  12.374   0.481  -2.767
  161    HZ2  TRP  20          2HZ       TRP  20  11.270   4.266  -5.810
  162    HZ3  TRP  20          3HZ       TRP  20  11.973   0.064  -5.182
  163    HH2  TRP  20           HH       TRP  20  11.432   1.934  -6.705
  164    QB   TRP  20           QB       TRP  20  13.173   2.362  -0.137
  165    H    LYS  21           H        LYS  21  10.247   1.160   2.718
  166    HA   LYS  21           HA       LYS  21  12.507  -0.135   4.145
  167   1HB   LYS  21          1HB       LYS  21  10.125   1.535   4.907
  168   2HB   LYS  21          2HB       LYS  21  10.262   0.019   5.796
  169   1HG   LYS  21          1HG       LYS  21  12.566   1.935   5.474
  170   2HG   LYS  21          2HG       LYS  21  11.413   2.123   6.787
  171   1HD   LYS  21          1HD       LYS  21  12.396  -0.671   6.510
  172   2HD   LYS  21          2HD       LYS  21  13.694   0.490   6.766
  173   1HE   LYS  21          1HE       LYS  21  12.818  -0.457   8.912
  174   2HE   LYS  21          2HE       LYS  21  12.697   1.302   8.825
  175   1HZ   LYS  21          3HZ       LYS  21  10.425  -0.535   8.305
  176   2HZ   LYS  21          1HZ       LYS  21  10.719   0.225   9.723
  177   3HZ   LYS  21          2HZ       LYS  21  10.338   1.086   8.383
  178    QB   LYS  21           QB       LYS  21  10.194   0.777   5.351
  179    QG   LYS  21           QG       LYS  21  11.989   2.029   6.130
  180    QD   LYS  21           QD       LYS  21  13.045  -0.090   6.638
  181    QE   LYS  21           QE       LYS  21  12.758   0.422   8.869
  182    QZ   LYS  21           QZ       LYS  21  10.494   0.259   8.804
  183    H    GLN  22           H        GLN  22  11.614  -2.359   5.063
  184    HA   GLN  22           HA       GLN  22  10.274  -3.697   2.967
  185   1HB   GLN  22          1HB       GLN  22  11.627  -4.801   4.859
  186   2HB   GLN  22          2HB       GLN  22  10.213  -4.489   5.889
  187   1HG   GLN  22          1HG       GLN  22  10.258  -6.789   5.132
  188   2HG   GLN  22          2HG       GLN  22   8.821  -5.962   4.520
  189   1HE2  GLN  22          2HE2      GLN  22   9.853  -7.524   1.432
  190   2HE2  GLN  22          1HE2      GLN  22   8.850  -7.861   2.819
  191    QB   GLN  22           QB       GLN  22  10.920  -4.645   5.374
  192    QG   GLN  22           QG       GLN  22   9.540  -6.376   4.826
  193    QE2  GLN  22           QE2      GLN  22   9.352  -7.693   2.126
  194    H    ASN  23           H        ASN  23   8.237  -4.286   2.671
  195    HA   ASN  23           HA       ASN  23   5.998  -3.166   4.316
  196   1HB   ASN  23          1HB       ASN  23   6.286  -3.189   1.260
  197   2HB   ASN  23          2HB       ASN  23   4.817  -2.765   2.146
  198   1HD2  ASN  23          2HD2      ASN  23   7.307   0.221   1.463
  199   2HD2  ASN  23          1HD2      ASN  23   6.981  -1.161   0.406
  200    QB   ASN  23           QB       ASN  23   5.551  -2.977   1.703
  201    QD2  ASN  23           QD2      ASN  23   7.144  -0.470   0.934
  202    H    TRP  24           H        TRP  24   7.104  -5.539   1.873
  203    HA   TRP  24           HA       TRP  24   4.777  -7.234   2.271
  204   1HB   TRP  24          1HB       TRP  24   5.859  -6.579   0.097
  205   2HB   TRP  24          2HB       TRP  24   7.399  -7.011   0.779
  206    HD1  TRP  24           HD       TRP  24   8.256  -8.232  -0.710
  207    HE1  TRP  24          1HE       TRP  24   7.841 -10.571  -1.941
  208    HE3  TRP  24          3HE       TRP  24   3.700  -9.237   1.211
  209    HZ2  TRP  24          2HZ       TRP  24   5.601 -12.444  -2.079
  210    HZ3  TRP  24          3HZ       TRP  24   2.471 -11.297   0.626
  211    HH2  TRP  24           HH       TRP  24   3.365 -12.846  -1.096
  212    QB   TRP  24           QB       TRP  24   6.629  -6.795   0.438
  213    H    ASN  25           H        ASN  25   5.588  -7.059   4.685
  214    HA   ASN  25           HA       ASN  25   6.155  -9.690   5.358
  215   1HB   ASN  25          1HB       ASN  25   8.656  -8.486   4.742
  216   2HB   ASN  25          2HB       ASN  25   8.592  -8.459   6.479
  217   1HD2  ASN  25          2HD2      ASN  25   8.794 -12.010   4.395
  218   2HD2  ASN  25          1HD2      ASN  25   8.306 -10.523   3.606
  219    QB   ASN  25           QB       ASN  25   8.624  -8.473   5.611
  220    QD2  ASN  25           QD2      ASN  25   8.550 -11.266   4.000
  221    H    THR  26           H        THR  26   5.047  -6.659   6.349
  222    HA   THR  26           HA       THR  26   5.233  -7.256   9.178
  223    HB   THR  26           HB       THR  26   7.514  -6.779   8.996
  224    HG1  THR  26          1HG       THR  26   7.520  -4.422   9.742
  225   1HG2  THR  26          3HG2      THR  26   6.870  -4.575   7.003
  226   2HG2  THR  26          1HG2      THR  26   8.456  -4.786   7.777
  227   3HG2  THR  26          2HG2      THR  26   7.807  -6.043   6.744
  228    QG2  THR  26           QG2      THR  26   7.711  -5.134   7.175
  229    H    CYS  27           H        CYS  27   4.025  -5.957  10.364
  230    HA   CYS  27           HA       CYS  27   1.781  -4.609   9.233
  231   1HB   CYS  27          1HB       CYS  27   1.885  -5.895  11.369
  232   2HB   CYS  27          2HB       CYS  27   2.949  -4.661  12.042
  233    QB   CYS  27           QB       CYS  27   2.417  -5.278  11.706
  234    H    VAL  28           H        VAL  28   3.018  -2.932   7.882
  235    HA   VAL  28           HA       VAL  28   4.671  -1.009   9.305
  236    HB   VAL  28           HB       VAL  28   3.733  -1.403   6.434
  237   1HG1  VAL  28          1HG1      VAL  28   5.456   0.917   7.413
  238   2HG1  VAL  28          2HG1      VAL  28   5.193   0.430   5.726
  239   3HG1  VAL  28          3HG1      VAL  28   3.845   1.038   6.661
  240   1HG2  VAL  28          3HG2      VAL  28   5.555  -2.823   7.339
  241   2HG2  VAL  28          1HG2      VAL  28   6.146  -1.715   6.088
  242   3HG2  VAL  28          2HG2      VAL  28   6.449  -1.370   7.804
  243    QG1  VAL  28           QG1      VAL  28   4.831   0.795   6.600
  244    QG2  VAL  28           QG2      VAL  28   6.050  -1.969   7.077
  245    QQG  VAL  28           QQG      VAL  28   5.441  -0.587   6.838
  246    H    GLY  29           H        GLY  29   4.287   1.229   9.535
  247   1HA   GLY  29          1HA       GLY  29   1.522   1.937   9.951
  248   2HA   GLY  29          2HA       GLY  29   2.945   2.858  10.421
  249    QA   GLY  29           QA       GLY  29   2.234   2.397  10.186
  250    H    ILE  30           H        ILE  30   0.541   3.654   8.897
  251    HA   ILE  30           HA       ILE  30   1.830   4.949   6.534
  252    HB   ILE  30           HB       ILE  30  -1.101   4.791   7.362
  253   1HG1  ILE  30          1HG1      ILE  30   0.460   3.152   5.324
  254   2HG1  ILE  30          2HG1      ILE  30  -0.360   2.566   6.772
  255   1HG2  ILE  30          2HG2      ILE  30  -0.577   6.796   5.992
  256   2HG2  ILE  30          3HG2      ILE  30   0.177   5.752   4.769
  257   3HG2  ILE  30          1HG2      ILE  30  -1.564   5.663   5.109
  258   1HD1  ILE  30          3HD1      ILE  30  -2.517   3.468   5.817
  259   2HD1  ILE  30          1HD1      ILE  30  -1.671   3.594   4.253
  260   3HD1  ILE  30          2HD1      ILE  30  -1.813   2.031   5.061
  261    QG1  ILE  30           QG1      ILE  30   0.050   2.859   6.048
  262    QG2  ILE  30           QG2      ILE  30  -0.655   6.070   5.290
  263    QD1  ILE  30           QD1      ILE  30  -2.000   3.031   5.044
  264    H    GLY  31           H        GLY  31   1.728   7.347   6.642
  265   1HA   GLY  31          1HA       GLY  31   0.183   8.735   8.567
  266   2HA   GLY  31          2HA       GLY  31   1.832   8.517   9.193
  267    QA   GLY  31           QA       GLY  31   1.008   8.626   8.880
  268    H    ALA  32           H        ALA  32   0.440  10.935   8.392
  269    HA   ALA  32           HA       ALA  32   1.069  12.911   7.757
  270   1HB   ALA  32          1HB       ALA  32   3.150  12.288   9.016
  271   2HB   ALA  32          2HB       ALA  32   3.893  11.793   7.478
  272   3HB   ALA  32          3HB       ALA  32   3.441  13.488   7.762
  273    QB   ALA  32           QB       ALA  32   3.495  12.523   8.085
  274    H    ASN  33           H        ASN  33  -0.252  13.022   6.176
  275    HA   ASN  33           HA       ASN  33  -0.869  13.796   4.165
  276   1HB   ASN  33          1HB       ASN  33   2.115  14.289   3.775
  277   2HB   ASN  33          2HB       ASN  33   0.841  14.901   2.743
  278   1HD2  ASN  33          2HD2      ASN  33   1.390  16.640   6.429
  279   2HD2  ASN  33          1HD2      ASN  33   2.371  15.273   5.900
  280    QB   ASN  33           QB       ASN  33   1.478  14.595   3.259
  281    QD2  ASN  33           QD2      ASN  33   1.881  15.956   6.165
  282    H    VAL  34           H        VAL  34   0.613  10.953   4.536
  283    HA   VAL  34           HA       VAL  34   1.005  10.204   1.739
  284    HB   VAL  34           HB       VAL  34   0.763   8.618   4.346
  285   1HG1  VAL  34          1HG1      VAL  34   1.438   7.577   1.568
  286   2HG1  VAL  34          2HG1      VAL  34   1.723   6.697   3.081
  287   3HG1  VAL  34          3HG1      VAL  34   0.068   7.104   2.605
  288   1HG2  VAL  34          1HG2      VAL  34   2.857  10.038   4.008
  289   2HG2  VAL  34          2HG2      VAL  34   3.145   8.305   4.218
  290   3HG2  VAL  34          3HG2      VAL  34   3.238   9.024   2.609
  291    QG1  VAL  34           QG1      VAL  34   1.076   7.126   2.418
  292    QG2  VAL  34           QG2      VAL  34   3.080   9.122   3.612
  293    QQG  VAL  34           QQG      VAL  34   2.078   8.124   3.015
  294    H    HIS  35           H        HIS  35  -0.340   9.666   0.247
  295    HA   HIS  35           HA       HIS  35  -2.678   8.052   0.901
  296   1HB   HIS  35          1HB       HIS  35  -4.286   9.386  -0.238
  297   2HB   HIS  35          2HB       HIS  35  -3.664  10.273   1.143
  298    HD1  HIS  35          1HD       HIS  35  -5.066  11.309  -1.723
  299    HD2  HIS  35          2HD       HIS  35  -1.176  11.805  -0.217
  300    HE1  HIS  35          1HE       HIS  35  -4.108  13.370  -2.861
  301    QB   HIS  35           QB       HIS  35  -3.975   9.830   0.453
  302    H    TRP  36           H        TRP  36  -0.090   7.670  -0.556
  303    HA   TRP  36           HA       TRP  36  -1.484   6.549  -2.980
  304   1HB   TRP  36          1HB       TRP  36   1.171   7.977  -2.977
  305   2HB   TRP  36          2HB       TRP  36   0.445   7.134  -4.337
  306    HD1  TRP  36           HD       TRP  36  -0.191  10.175  -2.101
  307    HE1  TRP  36          1HE       TRP  36  -1.732  11.817  -3.247
  308    HE3  TRP  36          3HE       TRP  36  -1.331   7.352  -6.121
  309    HZ2  TRP  36          2HZ       TRP  36  -3.328  11.899  -5.698
  310    HZ3  TRP  36          3HZ       TRP  36  -2.963   8.177  -7.839
  311    HH2  TRP  36           HH       TRP  36  -3.906  10.466  -7.662
  312    QB   TRP  36           QB       TRP  36   0.808   7.556  -3.657
  313    H    MET  37           H        MET  37  -1.174   4.450  -3.258
  314    HA   MET  37           HA       MET  37   1.273   3.108  -2.193
  315   1HB   MET  37          1HB       MET  37  -0.846   1.962  -1.760
  316   2HB   MET  37          2HB       MET  37  -1.164   1.902  -3.518
  317   1HG   MET  37          1HG       MET  37   0.876   0.469  -3.753
  318   2HG   MET  37          2HG       MET  37   1.146   0.633  -2.012
  319   1HE   MET  37          1HE       MET  37  -2.129  -0.102  -4.202
  320   2HE   MET  37          2HE       MET  37  -0.838  -1.167  -4.827
  321   3HE   MET  37          3HE       MET  37  -2.220  -1.860  -3.953
  322    QB   MET  37           QB       MET  37  -1.005   1.932  -2.639
  323    QG   MET  37           QG       MET  37   1.011   0.551  -2.883
  324    QE   MET  37           QE       MET  37  -1.729  -1.043  -4.327
  325    H    VAL  38           H        VAL  38   2.923   2.620  -3.689
  326    HA   VAL  38           HA       VAL  38   2.311   2.975  -6.568
  327    HB   VAL  38           HB       VAL  38   4.832   4.041  -5.245
  328   1HG1  VAL  38          1HG1      VAL  38   4.865   3.631  -7.712
  329   2HG1  VAL  38          2HG1      VAL  38   3.461   4.691  -7.892
  330   3HG1  VAL  38          3HG1      VAL  38   4.984   5.362  -7.315
  331   1HG2  VAL  38          3HG2      VAL  38   2.239   5.556  -5.811
  332   2HG2  VAL  38          1HG2      VAL  38   3.059   5.383  -4.241
  333   3HG2  VAL  38          2HG2      VAL  38   3.799   6.337  -5.530
  334    QG1  VAL  38           QG1      VAL  38   4.437   4.562  -7.640
  335    QG2  VAL  38           QG2      VAL  38   3.032   5.759  -5.194
  336    QQG  VAL  38           QQG      VAL  38   3.734   5.160  -6.417
  337    H    THR  39           H        THR  39   3.293   1.434  -7.852
  338    HA   THR  39           HA       THR  39   5.214  -0.433  -6.582
  339    HB   THR  39           HB       THR  39   2.992  -1.239  -5.900
  340    HG1  THR  39          1HG       THR  39   4.717  -2.739  -6.542
  341   1HG2  THR  39          3HG2      THR  39   1.630  -0.372  -7.788
  342   2HG2  THR  39          1HG2      THR  39   2.402  -1.558  -8.858
  343   3HG2  THR  39          2HG2      THR  39   1.381  -2.110  -7.523
  344    QG2  THR  39           QG2      THR  39   1.805  -1.347  -8.056
  345    H    GLY  40           H        GLY  40   6.305  -1.869  -8.090
  346   1HA   GLY  40          1HA       GLY  40   6.011  -2.039 -10.824
  347   2HA   GLY  40          2HA       GLY  40   6.827  -0.469 -10.567
  348    QA   GLY  40           QA       GLY  40   6.419  -1.254 -10.696
  349    H    GLY  41           H        GLY  41   8.593  -1.413 -11.764
  350   1HA   GLY  41          1HA       GLY  41  10.866  -1.854 -11.513
  351   2HA   GLY  41          2HA       GLY  41  10.572  -2.675  -9.972
  352    QA   GLY  41           QA       GLY  41  10.719  -2.265 -10.743
  353    H    SER  42           H        SER  42   8.727  -4.425 -10.475
  354    HA   SER  42           HA       SER  42  10.124  -6.627 -10.837
  355   1HB   SER  42          1HB       SER  42   7.366  -6.233 -10.576
  356   2HB   SER  42          2HB       SER  42   7.464  -7.148 -12.073
  357    HG   SER  42           HG       SER  42   7.421  -8.350  -9.983
  358    QB   SER  42           QB       SER  42   7.415  -6.691 -11.324
  359    H    THR  43           H        THR  43   8.229  -5.423 -13.499
  360    HA   THR  43           HA       THR  43  10.091  -5.460 -15.504
  361    HB   THR  43           HB       THR  43  10.209  -7.731 -15.940
  362    HG1  THR  43          1HG       THR  43   9.247  -6.951 -17.787
  363   1HG2  THR  43          2HG2      THR  43   7.386  -8.188 -14.878
  364   2HG2  THR  43          3HG2      THR  43   8.412  -9.391 -15.677
  365   3HG2  THR  43          1HG2      THR  43   8.917  -8.710 -14.151
  366    QG2  THR  43           QG2      THR  43   8.238  -8.763 -14.902
  367    H    ASP  44           H        ASP  44   6.831  -6.641 -15.941
  368    HA   ASP  44           HA       ASP  44   5.458  -4.550 -14.866
  369   1HB   ASP  44          1HB       ASP  44   6.228  -3.377 -17.005
  370   2HB   ASP  44          2HB       ASP  44   5.241  -4.524 -17.924
  371    QB   ASP  44           QB       ASP  44   5.734  -3.950 -17.464
  372    H    GLY  45           H        GLY  45   3.109  -4.794 -15.363
  373   1HA   GLY  45          1HA       GLY  45   1.202  -6.033 -15.970
  374   2HA   GLY  45          2HA       GLY  45   2.212  -7.432 -16.368
  375    QA   GLY  45           QA       GLY  45   1.707  -6.733 -16.169
  376    H    LYS  46           H        LYS  46   3.735  -6.746 -13.782
  377    HA   LYS  46           HA       LYS  46   2.203  -8.741 -12.218
  378   1HB   LYS  46          1HB       LYS  46   4.888  -7.538 -11.713
  379   2HB   LYS  46          2HB       LYS  46   4.045  -8.834 -10.798
  380   1HG   LYS  46          1HG       LYS  46   3.966 -10.179 -12.944
  381   2HG   LYS  46          2HG       LYS  46   5.066  -9.027 -13.690
  382   1HD   LYS  46          1HD       LYS  46   6.879  -9.650 -12.308
  383   2HD   LYS  46          2HD       LYS  46   5.847 -10.240 -11.004
  384   1HE   LYS  46          1HE       LYS  46   5.933 -11.652 -13.689
  385   2HE   LYS  46          2HE       LYS  46   7.086 -12.013 -12.401
  386   1HZ   LYS  46          1HZ       LYS  46   4.161 -12.217 -11.993
  387   2HZ   LYS  46          2HZ       LYS  46   5.153 -13.461 -12.439
  388   3HZ   LYS  46          3HZ       LYS  46   5.343 -12.735 -11.000
  389    QB   LYS  46           QB       LYS  46   4.466  -8.186 -11.255
  390    QG   LYS  46           QG       LYS  46   4.516  -9.603 -13.317
  391    QD   LYS  46           QD       LYS  46   6.363  -9.945 -11.656
  392    QE   LYS  46           QE       LYS  46   6.510 -11.832 -13.045
  393    QZ   LYS  46           QZ       LYS  46   4.886 -12.804 -11.811
  394    H    GLN  47           H        GLN  47   0.701  -7.073 -12.028
  395    HA   GLN  47           HA       GLN  47   0.590  -4.805 -10.457
  396   1HB   GLN  47          1HB       GLN  47  -1.775  -5.401 -10.027
  397   2HB   GLN  47          2HB       GLN  47  -1.286  -5.725 -11.707
  398   1HG   GLN  47          1HG       GLN  47  -1.061  -8.129 -11.220
  399   2HG   GLN  47          2HG       GLN  47  -1.628  -7.825  -9.562
  400   1HE2  GLN  47          2HE2      GLN  47  -4.353  -8.237 -12.465
  401   2HE2  GLN  47          1HE2      GLN  47  -2.665  -8.586 -12.755
  402    QB   GLN  47           QB       GLN  47  -1.530  -5.563 -10.867
  403    QG   GLN  47           QG       GLN  47  -1.345  -7.977 -10.391
  404    QE2  GLN  47           QE2      GLN  47  -3.509  -8.411 -12.610
  405    H    GLY  48           H        GLY  48   0.259  -4.305  -8.302
  406   1HA   GLY  48          1HA       GLY  48   1.269  -6.380  -6.415
  407   2HA   GLY  48          2HA       GLY  48   1.817  -4.682  -6.420
  408    QA   GLY  48           QA       GLY  48   1.543  -5.531  -6.417
  409    H    CYS  49           H        CYS  49   0.198  -6.547  -4.473
  410    HA   CYS  49           HA       CYS  49  -2.040  -4.612  -4.045
  411   1HB   CYS  49          1HB       CYS  49  -2.018  -7.597  -3.640
  412   2HB   CYS  49          2HB       CYS  49  -3.327  -6.544  -3.143
  413    QB   CYS  49           QB       CYS  49  -2.672  -7.070  -3.392
  414    H    ALA  50           H        ALA  50  -2.701  -4.387  -1.986
  415    HA   ALA  50           HA       ALA  50  -0.910  -5.299   0.172
  416   1HB   ALA  50          1HB       ALA  50  -1.706  -2.376  -0.257
  417   2HB   ALA  50          2HB       ALA  50  -0.891  -3.005   1.179
  418   3HB   ALA  50          3HB       ALA  50  -0.047  -3.024  -0.384
  419    QB   ALA  50           QB       ALA  50  -0.881  -2.802   0.179
  420    H    THR  51           H        THR  51  -1.973  -5.477   2.093
  421    HA   THR  51           HA       THR  51  -4.917  -4.939   2.062
  422    HB   THR  51           HB       THR  51  -3.363  -6.622   4.015
  423    HG1  THR  51          1HG       THR  51  -4.066  -7.316   1.760
  424   1HG2  THR  51          1HG2      THR  51  -6.355  -5.961   3.803
  425   2HG2  THR  51          2HG2      THR  51  -5.636  -7.093   4.963
  426   3HG2  THR  51          3HG2      THR  51  -5.286  -5.361   5.081
  427    QG2  THR  51           QG2      THR  51  -5.759  -6.138   4.616
  428    H    ILE  52           H        ILE  52  -5.524  -3.167   3.137
  429    HA   ILE  52           HA       ILE  52  -3.479  -1.620   4.645
  430    HB   ILE  52           HB       ILE  52  -5.740  -0.504   2.938
  431   1HG1  ILE  52          1HG1      ILE  52  -2.807  -1.044   2.278
  432   2HG1  ILE  52          2HG1      ILE  52  -4.236  -1.572   1.379
  433   1HG2  ILE  52          2HG2      ILE  52  -4.762   0.842   4.880
  434   2HG2  ILE  52          3HG2      ILE  52  -3.219   0.782   4.014
  435   3HG2  ILE  52          1HG2      ILE  52  -4.615   1.614   3.295
  436   1HD1  ILE  52          1HD1      ILE  52  -4.697   0.846   0.829
  437   2HD1  ILE  52          2HD1      ILE  52  -3.138   1.264   1.580
  438   3HD1  ILE  52          3HD1      ILE  52  -3.169   0.209   0.172
  439    QG1  ILE  52           QG1      ILE  52  -3.522  -1.308   1.828
  440    QG2  ILE  52           QG2      ILE  52  -4.199   1.079   4.063
  441    QD1  ILE  52           QD1      ILE  52  -3.668   0.773   0.860
  442    H    TRP  53           H        TRP  53  -4.324  -0.631   6.558
  443    HA   TRP  53           HA       TRP  53  -6.906  -1.747   7.566
  444   1HB   TRP  53          1HB       TRP  53  -4.112  -1.830   8.677
  445   2HB   TRP  53          2HB       TRP  53  -5.496  -1.822   9.765
  446    HD1  TRP  53           HD       TRP  53  -6.898  -3.986  10.055
  447    HE1  TRP  53          1HE       TRP  53  -6.469  -6.431   9.523
  448    HE3  TRP  53          3HE       TRP  53  -3.045  -3.395   6.763
  449    HZ2  TRP  53          2HZ       TRP  53  -4.637  -7.976   7.861
  450    HZ3  TRP  53          3HZ       TRP  53  -2.011  -5.376   5.696
  451    HH2  TRP  53           HH       TRP  53  -2.698  -7.671   6.345
  452    QB   TRP  53           QB       TRP  53  -4.804  -1.826   9.221
  453    H    GLU  54           H        GLU  54  -8.064  -0.429   8.914
  454    HA   GLU  54           HA       GLU  54  -7.576   2.337   8.976
  455   1HB   GLU  54          1HB       GLU  54  -9.756   1.122   9.256
  456   2HB   GLU  54          2HB       GLU  54  -9.171   0.480  10.792
  457   1HG   GLU  54          1HG       GLU  54  -9.275   2.668  11.813
  458   2HG   GLU  54          2HG       GLU  54  -9.593   3.429  10.234
  459    QB   GLU  54           QB       GLU  54  -9.463   0.801  10.024
  460    QG   GLU  54           QG       GLU  54  -9.434   3.048  11.024
  461    H    GLY  55           H        GLY  55  -7.041  -0.204  11.403
  462   1HA   GLY  55          1HA       GLY  55  -6.527   1.578  13.513
  463   2HA   GLY  55          2HA       GLY  55  -6.262  -0.151  13.512
  464    QA   GLY  55           QA       GLY  55  -6.394   0.714  13.513
  465    H    SER  56           H        SER  56  -4.687   2.162  14.616
  466    HA   SER  56           HA       SER  56  -2.069   2.123  13.528
  467   1HB   SER  56          1HB       SER  56  -3.018   2.183  16.420
  468   2HB   SER  56          2HB       SER  56  -1.415   2.630  15.857
  469    HG   SER  56           HG       SER  56  -3.221   4.336  16.132
  470    QB   SER  56           QB       SER  56  -2.217   2.407  16.138
  471    H    GLY  57           H        GLY  57  -1.033   0.267  13.111
  472   1HA   GLY  57          1HA       GLY  57   0.043  -1.727  13.509
  473   2HA   GLY  57          2HA       GLY  57  -0.726  -1.812  15.086
  474    QA   GLY  57           QA       GLY  57  -0.341  -1.770  14.297
  475    H    CYS  58           H        CYS  58  -2.075  -1.435  11.833
  476    HA   CYS  58           HA       CYS  58  -3.480  -2.673  10.586
  477   1HB   CYS  58          1HB       CYS  58  -2.551  -4.812   9.853
  478   2HB   CYS  58          2HB       CYS  58  -1.344  -3.530   9.868
  479    QB   CYS  58           QB       CYS  58  -1.948  -4.171   9.861
  480    H    VAL  59           H        VAL  59  -4.873  -2.382  12.667
  481    HA   VAL  59           HA       VAL  59  -6.489  -4.848  12.847
  482    HB   VAL  59           HB       VAL  59  -7.232  -3.932  15.036
  483   1HG1  VAL  59          3HG1      VAL  59  -4.350  -4.876  14.897
  484   2HG1  VAL  59          1HG1      VAL  59  -5.337  -4.849  16.367
  485   3HG1  VAL  59          2HG1      VAL  59  -5.818  -5.874  15.012
  486   1HG2  VAL  59          1HG2      VAL  59  -4.787  -2.142  14.894
  487   2HG2  VAL  59          2HG2      VAL  59  -6.500  -1.672  15.052
  488   3HG2  VAL  59          3HG2      VAL  59  -5.694  -2.509  16.371
  489    QG1  VAL  59           QG1      VAL  59  -5.168  -5.199  15.425
  490    QG2  VAL  59           QG2      VAL  59  -5.660  -2.108  15.439
  491    QQG  VAL  59           QQG      VAL  59  -5.414  -3.654  15.432
  492    H    GLY  60           H        GLY  60  -8.855  -3.975  13.322
  493   1HA   GLY  60          1HA       GLY  60 -10.487  -2.300  13.114
  494   2HA   GLY  60          2HA       GLY  60  -9.278  -1.159  12.526
  495    QA   GLY  60           QA       GLY  60  -9.882  -1.729  12.820
  496    H    ARG  61           H        ARG  61 -10.910  -0.596  10.752
  497    HA   ARG  61           HA       ARG  61 -11.953  -2.852   9.189
  498   1HB   ARG  61          1HB       ARG  61 -13.384  -0.864   9.587
  499   2HB   ARG  61          2HB       ARG  61 -12.202   0.155   8.740
  500   1HG   ARG  61          1HG       ARG  61 -12.537  -1.073   6.667
  501   2HG   ARG  61          2HG       ARG  61 -13.585  -2.264   7.452
  502   1HD   ARG  61          1HD       ARG  61 -15.372  -0.751   7.668
  503   2HD   ARG  61          2HD       ARG  61 -14.290   0.656   7.525
  504    HE   ARG  61           HE       ARG  61 -14.322  -1.011   5.113
  505   1HH1  ARG  61          2HH2      ARG  61 -16.245   1.400   6.778
  506   2HH1  ARG  61          1HH2      ARG  61 -16.519   2.408   5.370
  507   1HH2  ARG  61          2HH1      ARG  61 -14.556   0.387   3.232
  508   2HH2  ARG  61          1HH1      ARG  61 -15.519   1.839   3.325
  509    QB   ARG  61           QB       ARG  61 -12.793  -0.355   9.163
  510    QG   ARG  61           QG       ARG  61 -13.061  -1.669   7.060
  511    QD   ARG  61           QD       ARG  61 -14.831  -0.047   7.596
  512    QH1  ARG  61           QH2      ARG  61 -16.382   1.904   6.074
  513    QH2  ARG  61           QH1      ARG  61 -15.038   1.113   3.279
  514    H    SER  62           H        SER  62 -11.144  -3.701   7.438
  515    HA   SER  62           HA       SER  62  -8.693  -2.402   6.442
  516   1HB   SER  62          1HB       SER  62  -8.610  -5.253   6.172
  517   2HB   SER  62          2HB       SER  62  -7.463  -4.182   6.932
  518    HG   SER  62           HG       SER  62  -9.000  -4.199   8.797
  519    QB   SER  62           QB       SER  62  -8.036  -4.717   6.552
  520    H    THR  63           H        THR  63  -8.013  -3.171   4.257
  521    HA   THR  63           HA       THR  63 -10.177  -4.197   2.600
  522    HB   THR  63           HB       THR  63 -10.697  -1.791   2.610
  523    HG1  THR  63          1HG       THR  63 -10.748  -3.023   0.599
  524   1HG2  THR  63          3HG2      THR  63  -7.830  -1.356   1.628
  525   2HG2  THR  63          1HG2      THR  63  -9.090  -0.127   1.715
  526   3HG2  THR  63          2HG2      THR  63  -8.477  -0.858   3.206
  527    QG2  THR  63           QG2      THR  63  -8.466  -0.780   2.183
  528    H    THR  64           H        THR  64  -9.370  -4.941   0.554
  529    HA   THR  64           HA       THR  64  -6.401  -5.215   0.393
  530    HB   THR  64           HB       THR  64  -8.444  -6.422  -1.462
  531    HG1  THR  64          1HG       THR  64  -7.793  -7.055   1.111
  532   1HG2  THR  64          2HG2      THR  64  -6.096  -6.327  -2.276
  533   2HG2  THR  64          3HG2      THR  64  -5.541  -7.126  -0.795
  534   3HG2  THR  64          1HG2      THR  64  -6.580  -7.994  -1.939
  535    QG2  THR  64           QG2      THR  64  -6.072  -7.149  -1.670
  536    H    MET  65           H        MET  65  -5.488  -3.461  -0.493
  537    HA   MET  65           HA       MET  65  -6.788  -1.899  -2.640
  538   1HB   MET  65          1HB       MET  65  -5.511  -0.912  -0.595
  539   2HB   MET  65          2HB       MET  65  -4.050  -1.553  -1.337
  540   1HG   MET  65          1HG       MET  65  -4.335   0.809  -1.880
  541   2HG   MET  65          2HG       MET  65  -4.444  -0.177  -3.328
  542   1HE   MET  65          3HE       MET  65  -6.497   1.805  -0.601
  543   2HE   MET  65          1HE       MET  65  -8.134   1.753  -1.291
  544   3HE   MET  65          2HE       MET  65  -7.398   0.266  -0.682
  545    QB   MET  65           QB       MET  65  -4.780  -1.233  -0.966
  546    QG   MET  65           QG       MET  65  -4.389   0.316  -2.604
  547    QE   MET  65           QE       MET  65  -7.343   1.275  -0.858
  548    H    CYS  66           H        CYS  66  -5.826  -2.007  -4.782
  549    HA   CYS  66           HA       CYS  66  -3.501  -3.755  -5.200
  550   1HB   CYS  66          1HB       CYS  66  -6.195  -4.268  -6.470
  551   2HB   CYS  66          2HB       CYS  66  -4.681  -4.863  -7.116
  552    QB   CYS  66           QB       CYS  66  -5.438  -4.566  -6.793
  553    H    CYS  67           H        CYS  67  -2.330  -3.058  -6.891
  554    HA   CYS  67           HA       CYS  67  -3.432  -0.914  -8.655
  555   1HB   CYS  67          1HB       CYS  67  -2.132  -0.023  -6.650
  556   2HB   CYS  67          2HB       CYS  67  -0.724  -0.897  -7.268
  557    QB   CYS  67           QB       CYS  67  -1.428  -0.460  -6.959
  558    HA   PRO  68           HA       PRO  68  -1.249  -3.631 -11.556
  559   1HB   PRO  68          1HB       PRO  68  -0.919  -1.812 -13.668
  560   2HB   PRO  68          2HB       PRO  68  -2.280  -2.923 -13.405
  561   1HG   PRO  68          1HG       PRO  68  -2.070   0.013 -12.868
  562   2HG   PRO  68          2HG       PRO  68  -3.541  -0.918 -13.262
  563   1HD   PRO  68          1HD       PRO  68  -2.850   0.014 -10.736
  564   2HD   PRO  68          2HD       PRO  68  -3.947  -1.360 -11.013
  565    QB   PRO  68           QB       PRO  68  -1.599  -2.367 -13.536
  566    QG   PRO  68           QG       PRO  68  -2.806  -0.452 -13.065
  567    QD   PRO  68           QD       PRO  68  -3.399  -0.673 -10.875
  568    H    ALA  69           H        ALA  69   0.786  -3.544 -12.869
  569    HA   ALA  69           HA       ALA  69   2.828  -2.719 -10.943
  570   1HB   ALA  69          2HB       ALA  69   2.868  -4.164 -13.577
  571   2HB   ALA  69          3HB       ALA  69   4.383  -3.613 -12.818
  572   3HB   ALA  69          1HB       ALA  69   3.335  -4.743 -11.971
  573    QB   ALA  69           QB       ALA  69   3.529  -4.174 -12.789
  574    H    ASN  70           H        ASN  70   4.341  -1.155 -11.176
  575    HA   ASN  70           HA       ASN  70   5.418   0.730 -11.854
  576   1HB   ASN  70          1HB       ASN  70   4.680  -0.123 -14.670
  577   2HB   ASN  70          2HB       ASN  70   5.903   1.064 -14.177
  578   1HD2  ASN  70          2HD2      ASN  70   6.961  -2.783 -14.487
  579   2HD2  ASN  70          1HD2      ASN  70   5.320  -2.258 -14.838
  580    QB   ASN  70           QB       ASN  70   5.292   0.470 -14.423
  581    QD2  ASN  70           QD2      ASN  70   6.140  -2.521 -14.662
  582    H    THR  71           H        THR  71   3.080   1.047 -10.753
  583    HA   THR  71           HA       THR  71   1.855   3.306 -12.159
  584    HB   THR  71           HB       THR  71   0.229   0.901 -11.233
  585    HG1  THR  71          1HG       THR  71   1.268   0.561 -13.258
  586   1HG2  THR  71          1HG2      THR  71  -0.598   3.601 -12.338
  587   2HG2  THR  71          2HG2      THR  71  -1.654   2.182 -12.389
  588   3HG2  THR  71          3HG2      THR  71  -1.103   2.810 -10.842
  589    QG2  THR  71           QG2      THR  71  -1.118   2.865 -11.856
  590    H    CYS  72           H        CYS  72   0.880   4.653 -10.826
  591    HA   CYS  72           HA       CYS  72   1.287   4.515  -7.888
  592   1HB   CYS  72          1HB       CYS  72   2.240   6.564  -8.614
  593   2HB   CYS  72          2HB       CYS  72   1.226   6.602 -10.070
  594    QB   CYS  72           QB       CYS  72   1.733   6.583  -9.342
  595    H    CYS  73           H        CYS  73  -0.591   4.513  -6.569
  596    HA   CYS  73           HA       CYS  73  -3.232   4.922  -7.884
  597   1HB   CYS  73          1HB       CYS  73  -2.265   2.526  -6.283
  598   2HB   CYS  73          2HB       CYS  73  -3.937   2.983  -6.542
  599    QB   CYS  73           QB       CYS  73  -3.101   2.754  -6.412
  600    H    ASN  74           H        ASN  74  -4.505   6.213  -6.708
  601    HA   ASN  74           HA       ASN  74  -3.652   7.299  -4.196
  602   1HB   ASN  74          1HB       ASN  74  -4.983   8.722  -5.631
  603   2HB   ASN  74          2HB       ASN  74  -6.247   7.499  -5.760
  604   1HD2  ASN  74          2HD2      ASN  74  -5.942   9.526  -2.148
  605   2HD2  ASN  74          1HD2      ASN  74  -4.462   9.128  -3.001
  606    QB   ASN  74           QB       ASN  74  -5.615   8.111  -5.695
  607    QD2  ASN  74           QD2      ASN  74  -5.202   9.327  -2.574
  608    H    ILE  75           H        ILE  75  -4.206   6.804  -2.160
  609    HA   ILE  75           HA       ILE  75  -6.159   4.652  -1.526
  610    HB   ILE  75           HB       ILE  75  -3.750   5.937  -0.169
  611   1HG1  ILE  75          1HG1      ILE  75  -2.877   3.752  -0.017
  612   2HG1  ILE  75          2HG1      ILE  75  -4.414   2.998  -0.520
  613   1HG2  ILE  75          2HG2      ILE  75  -5.808   4.117   1.108
  614   2HG2  ILE  75          3HG2      ILE  75  -4.189   4.473   1.763
  615   3HG2  ILE  75          1HG2      ILE  75  -5.365   5.783   1.597
  616   1HD1  ILE  75          2HD1      ILE  75  -2.775   4.811  -2.265
  617   2HD1  ILE  75          3HD1      ILE  75  -2.608   3.040  -2.243
  618   3HD1  ILE  75          1HD1      ILE  75  -4.114   3.735  -2.781
  619    QG1  ILE  75           QG1      ILE  75  -3.645   3.375  -0.269
  620    QG2  ILE  75           QG2      ILE  75  -5.121   4.791   1.489
  621    QD1  ILE  75           QD1      ILE  75  -3.166   3.862  -2.430
  622    H    ASN  76           H        ASN  76  -8.181   5.574  -1.224
  623    HA   ASN  76           HA       ASN  76  -8.301   7.562   0.921
  624   1HB   ASN  76          1HB       ASN  76  -8.145   8.966  -1.111
  625   2HB   ASN  76          2HB       ASN  76  -9.660   8.292  -1.701
  626   1HD2  ASN  76          2HD2      ASN  76 -11.643   9.881   0.951
  627   2HD2  ASN  76          1HD2      ASN  76 -11.553   8.455  -0.062
  628    QB   ASN  76           QB       ASN  76  -8.903   8.629  -1.406
  629    QD2  ASN  76           QD2      ASN  76 -11.598   9.168   0.444
  630    H    THR  77           H        THR  77  -9.067   5.591   1.908
  631    HA   THR  77           HA       THR  77 -11.676   4.506   1.140
  632    HB   THR  77           HB       THR  77 -11.194   3.532   3.617
  633    HG1  THR  77          1HG       THR  77  -9.375   4.739   4.072
  634   1HG2  THR  77          3HG2      THR  77  -9.582   2.723   1.159
  635   2HG2  THR  77          1HG2      THR  77  -9.901   1.737   2.603
  636   3HG2  THR  77          2HG2      THR  77 -11.241   2.188   1.532
  637    QG2  THR  77           QG2      THR  77 -10.241   2.216   1.765
  638    H    GLY  78           H        GLY  78 -13.456   4.588   2.784
  639   1HA   GLY  78          1HA       GLY  78 -14.245   7.209   3.535
  640   2HA   GLY  78          2HA       GLY  78 -14.890   5.702   4.192
  641    QA   GLY  78           QA       GLY  78 -14.568   6.455   3.864
  642    H    PHE  79           H        PHE  79 -12.770   4.543   5.399
  643    HA   PHE  79           HA       PHE  79 -12.209   6.274   7.737
  644   1HB   PHE  79          1HB       PHE  79 -11.100   4.236   8.616
  645   2HB   PHE  79          2HB       PHE  79 -12.775   4.006   8.329
  646    HD1  PHE  79          2HD       PHE  79 -13.407   2.675   6.095
  647    HD2  PHE  79          1HD       PHE  79  -9.395   2.943   7.625
  648    HE1  PHE  79          2HE       PHE  79 -12.631   0.908   4.479
  649    HE2  PHE  79          1HE       PHE  79  -8.769   0.945   6.303
  650   1HZ   PHE  79           HZ       PHE  79 -10.374  -0.030   4.683
  651    QB   PHE  79           QB       PHE  79 -11.937   4.121   8.472
  652    QG   PHE  79           QD       PHE  79 -11.401   2.809   6.860
  653    QZ   PHE  79           QE       PHE  79 -10.700   0.926   5.391
  654    QZ   PHE  79           QR       PHE  79 -10.915   1.488   5.837
  655    H    TYR  80           H        TYR  80 -10.265   6.562   8.522
  656    HA   TYR  80           HA       TYR  80  -8.300   7.048   6.444
  657   1HB   TYR  80          1HB       TYR  80  -8.737   8.822   7.985
  658   2HB   TYR  80          2HB       TYR  80  -8.306   7.832   9.370
  659    HD1  TYR  80          2HD       TYR  80  -6.783   9.019   6.119
  660    HD2  TYR  80          1HD       TYR  80  -6.075   7.677  10.148
  661    HE1  TYR  80          2HE       TYR  80  -4.343   9.169   5.747
  662    HE2  TYR  80          1HE       TYR  80  -3.644   7.759   9.750
  663    HH   TYR  80           HH       TYR  80  -2.143   7.584   7.854
  664    QB   TYR  80           QB       TYR  80  -8.522   8.327   8.677
  665    QG   TYR  80           QD       TYR  80  -6.429   8.348   8.133
  666    QZ   TYR  80           QE       TYR  80  -3.994   8.464   7.749
  667    QR   TYR  80           QR       TYR  80  -5.211   8.406   7.941
  668    H    ILE  81           H        ILE  81  -6.305   5.957   6.349
  669    HA   ILE  81           HA       ILE  81  -6.304   3.410   7.709
  670    HB   ILE  81           HB       ILE  81  -4.603   2.892   5.943
  671   1HG1  ILE  81          1HG1      ILE  81  -4.622   5.469   5.269
  672   2HG1  ILE  81          2HG1      ILE  81  -4.534   4.233   4.041
  673   1HG2  ILE  81          3HG2      ILE  81  -7.598   3.185   5.560
  674   2HG2  ILE  81          1HG2      ILE  81  -6.565   2.353   4.387
  675   3HG2  ILE  81          2HG2      ILE  81  -6.662   1.770   6.051
  676   1HD1  ILE  81          1HD1      ILE  81  -7.275   5.266   4.841
  677   2HD1  ILE  81          2HD1      ILE  81  -6.234   6.136   3.717
  678   3HD1  ILE  81          3HD1      ILE  81  -6.732   4.450   3.384
  679    QG1  ILE  81           QG1      ILE  81  -4.578   4.851   4.655
  680    QG2  ILE  81           QG2      ILE  81  -6.942   2.436   5.333
  681    QD1  ILE  81           QD1      ILE  81  -6.747   5.284   3.981
  682    H    ARG  82           H        ARG  82  -4.732   2.905   9.207
  683    HA   ARG  82           HA       ARG  82  -2.412   4.802   9.578
  684   1HB   ARG  82          1HB       ARG  82  -3.903   3.053  11.523
  685   2HB   ARG  82          2HB       ARG  82  -2.345   3.785  11.896
  686   1HG   ARG  82          1HG       ARG  82  -3.065   5.896  11.912
  687   2HG   ARG  82          2HG       ARG  82  -4.392   5.608  10.766
  688   1HD   ARG  82          1HD       ARG  82  -4.719   4.179  13.344
  689   2HD   ARG  82          2HD       ARG  82  -4.721   5.901  13.537
  690    HE   ARG  82           HE       ARG  82  -6.530   4.253  11.821
  691   1HH1  ARG  82          2HH2      ARG  82  -5.855   7.517  13.174
  692   2HH1  ARG  82          1HH2      ARG  82  -7.429   8.106  12.668
  693   1HH2  ARG  82          2HH1      ARG  82  -8.369   5.280  10.870
  694   2HH2  ARG  82          1HH1      ARG  82  -8.831   6.867  11.457
  695    QB   ARG  82           QB       ARG  82  -3.124   3.419  11.709
  696    QG   ARG  82           QG       ARG  82  -3.728   5.752  11.339
  697    QD   ARG  82           QD       ARG  82  -4.720   5.040  13.441
  698    QH1  ARG  82           QH2      ARG  82  -6.642   7.811  12.921
  699    QH2  ARG  82           QH1      ARG  82  -8.600   6.073  11.163
  700    H    SER  83           H        SER  83  -3.275   1.546   8.742
  701    HA   SER  83           HA       SER  83  -0.331   1.066   8.604
  702   1HB   SER  83          1HB       SER  83  -2.092  -1.106   9.596
  703   2HB   SER  83          2HB       SER  83  -0.349  -1.082   9.630
  704    HG   SER  83           HG       SER  83  -2.114   0.520  11.199
  705    QB   SER  83           QB       SER  83  -1.220  -1.094   9.613
  706    H    TYR  84           H        TYR  84   0.327  -0.869   7.399
  707    HA   TYR  84           HA       TYR  84  -1.591  -2.093   5.653
  708   1HB   TYR  84          1HB       TYR  84  -0.885  -1.428   3.581
  709   2HB   TYR  84          2HB       TYR  84  -0.940   0.087   4.441
  710    HD1  TYR  84          1HD       TYR  84   1.414   0.936   5.427
  711    HD2  TYR  84          2HD       TYR  84   0.957  -1.971   2.277
  712    HE1  TYR  84          1HE       TYR  84   3.465   1.797   4.313
  713    HE2  TYR  84          2HE       TYR  84   2.981  -1.091   1.175
  714    HH   TYR  84           HH       TYR  84   4.988   1.477   2.505
  715    QB   TYR  84           QB       TYR  84  -0.912  -0.670   4.011
  716    QG   TYR  84           QD       TYR  84   1.186  -0.518   3.852
  717    QZ   TYR  84           QE       TYR  84   3.223   0.353   2.744
  718    QR   TYR  84           QR       TYR  84   2.204  -0.082   3.298
  719    H    ARG  85           H        ARG  85  -0.732  -3.886   4.445
  720    HA   ARG  85           HA       ARG  85   2.153  -4.472   4.659
  721   1HB   ARG  85          1HB       ARG  85  -0.136  -6.103   5.642
  722   2HB   ARG  85          2HB       ARG  85   0.842  -6.964   4.501
  723   1HG   ARG  85          1HG       ARG  85   2.808  -6.633   5.875
  724   2HG   ARG  85          2HG       ARG  85   1.926  -5.425   6.864
  725   1HD   ARG  85          1HD       ARG  85   0.650  -6.881   7.920
  726   2HD   ARG  85          2HD       ARG  85   0.617  -8.074   6.611
  727    HE   ARG  85           HE       ARG  85   2.983  -8.655   7.135
  728   1HH1  ARG  85          2HH2      ARG  85   0.630  -7.798   9.642
  729   2HH1  ARG  85          1HH2      ARG  85   1.566  -8.465  10.941
  730   1HH2  ARG  85          2HH1      ARG  85   4.032  -9.872   8.795
  731   2HH2  ARG  85          1HH1      ARG  85   3.498  -9.705  10.434
  732    QB   ARG  85           QB       ARG  85   0.353  -6.534   5.072
  733    QG   ARG  85           QG       ARG  85   2.367  -6.029   6.369
  734    QD   ARG  85           QD       ARG  85   0.634  -7.477   7.265
  735    QH1  ARG  85           QH2      ARG  85   1.098  -8.131  10.292
  736    QH2  ARG  85           QH1      ARG  85   3.765  -9.788   9.614
  737    H    ARG  86           H        ARG  86   2.904  -5.287   2.718
  738    HA   ARG  86           HA       ARG  86   1.240  -5.217   0.325
  739   1HB   ARG  86          1HB       ARG  86   3.935  -5.157   0.798
  740   2HB   ARG  86          2HB       ARG  86   3.723  -6.895   0.512
  741   1HG   ARG  86          1HG       ARG  86   2.643  -4.972  -1.490
  742   2HG   ARG  86          2HG       ARG  86   4.394  -5.172  -1.313
  743   1HD   ARG  86          1HD       ARG  86   3.546  -7.824  -1.494
  744   2HD   ARG  86          2HD       ARG  86   2.449  -6.979  -2.565
  745    HE   ARG  86           HE       ARG  86   5.451  -7.069  -2.692
  746   1HH1  ARG  86          2HH2      ARG  86   2.505  -6.971  -4.571
  747   2HH1  ARG  86          1HH2      ARG  86   3.298  -6.301  -5.960
  748   1HH2  ARG  86          2HH1      ARG  86   6.458  -6.488  -4.661
  749   2HH2  ARG  86          1HH1      ARG  86   5.449  -6.243  -6.084
  750    QB   ARG  86           QB       ARG  86   3.829  -6.026   0.655
  751    QG   ARG  86           QG       ARG  86   3.518  -5.072  -1.402
  752    QD   ARG  86           QD       ARG  86   2.998  -7.401  -2.030
  753    QH1  ARG  86           QH2      ARG  86   2.901  -6.636  -5.266
  754    QH2  ARG  86           QH1      ARG  86   5.954  -6.365  -5.372
  755    H    VAL  87           H        VAL  87   0.545  -7.261  -0.817
  756    HA   VAL  87           HA       VAL  87   0.633  -9.693   0.916
  757    HB   VAL  87           HB       VAL  87  -1.657 -10.214   0.478
  758   1HG1  VAL  87          1HG1      VAL  87  -0.921  -9.061   2.557
  759   2HG1  VAL  87          2HG1      VAL  87  -1.381  -7.509   1.833
  760   3HG1  VAL  87          3HG1      VAL  87  -2.602  -8.768   2.123
  761   1HG2  VAL  87          2HG2      VAL  87  -2.059  -8.904  -1.587
  762   2HG2  VAL  87          3HG2      VAL  87  -3.262  -8.552  -0.337
  763   3HG2  VAL  87          1HG2      VAL  87  -1.956  -7.399  -0.648
  764    QG1  VAL  87           QG1      VAL  87  -1.635  -8.446   2.171
  765    QG2  VAL  87           QG2      VAL  87  -2.425  -8.285  -0.857
  766    QQG  VAL  87           QQG      VAL  87  -2.030  -8.365   0.657
  767    H    GLU  88           H        GLU  88   0.723  -8.470  -2.431
  768    HA   GLU  88           HA       GLU  88   2.276 -10.706  -2.984
  769   1HB   GLU  88          1HB       GLU  88  -0.282 -11.593  -3.252
  770   2HB   GLU  88          2HB       GLU  88  -0.165 -10.704  -4.758
  771   1HG   GLU  88          1HG       GLU  88   0.349 -13.070  -5.074
  772   2HG   GLU  88          2HG       GLU  88   1.773 -12.085  -5.418
  773    QB   GLU  88           QB       GLU  88  -0.224 -11.148  -4.005
  774    QG   GLU  88           QG       GLU  88   1.061 -12.578  -5.246
   
  No H/Q in entry =         774
  Start of MODEL    7
    1   1HA   GLY   1          1HA       GLY   1  15.390  -0.733  -9.814
    2   2HA   GLY   1          2HA       GLY   1  13.963  -0.283  -8.865
    3    QA   GLY   1           QA       GLY   1  14.676  -0.508  -9.339
    4    H    ASP   2           H        ASP   2  13.571  -2.665  -9.934
    5    HA   ASP   2           HA       ASP   2  11.946  -2.388 -12.405
    6   1HB   ASP   2          1HB       ASP   2  14.557  -3.890 -12.059
    7   2HB   ASP   2          2HB       ASP   2  13.245  -4.771 -12.799
    8    QB   ASP   2           QB       ASP   2  13.901  -4.330 -12.429
    9    H    GLY   3           H        GLY   3  10.042  -2.880 -11.257
   10   1HA   GLY   3          1HA       GLY   3   8.663  -4.217  -9.843
   11   2HA   GLY   3          2HA       GLY   3   9.845  -5.415  -9.653
   12    QA   GLY   3           QA       GLY   3   9.254  -4.816  -9.748
   13    H    TYR   4           H        TYR   4   8.186  -3.608  -8.111
   14    HA   TYR   4           HA       TYR   4   9.313  -3.817  -5.630
   15   1HB   TYR   4          1HB       TYR   4   9.748  -1.370  -5.021
   16   2HB   TYR   4          2HB       TYR   4  10.949  -2.184  -5.975
   17    HD1  TYR   4          2HD       TYR   4   8.128   0.251  -6.101
   18    HD2  TYR   4          1HD       TYR   4  11.582  -1.300  -8.163
   19    HE1  TYR   4          2HE       TYR   4   7.838   1.950  -7.856
   20    HE2  TYR   4          1HE       TYR   4  11.248   0.366  -9.955
   21    HH   TYR   4           HH       TYR   4   9.918   2.012 -10.789
   22    QB   TYR   4           QB       TYR   4  10.348  -1.777  -5.498
   23    QG   TYR   4           QD       TYR   4   9.855  -0.524  -7.132
   24    QZ   TYR   4           QE       TYR   4   9.543   1.158  -8.905
   25    QR   TYR   4           QR       TYR   4   9.699   0.317  -8.019
   26    H    LEU   5           H        LEU   5   8.096  -2.536  -4.009
   27    HA   LEU   5           HA       LEU   5   5.800  -1.013  -4.955
   28   1HB   LEU   5          1HB       LEU   5   4.830  -3.213  -5.034
   29   2HB   LEU   5          2HB       LEU   5   5.312  -3.552  -3.369
   30    HG   LEU   5           HG       LEU   5   3.744  -1.025  -3.781
   31   1HD1  LEU   5          3HD1      LEU   5   2.649  -2.588  -5.411
   32   2HD1  LEU   5          1HD1      LEU   5   2.215  -3.622  -4.058
   33   3HD1  LEU   5          2HD1      LEU   5   1.648  -1.946  -4.112
   34   1HD2  LEU   5          3HD2      LEU   5   3.911  -3.216  -1.700
   35   2HD2  LEU   5          1HD2      LEU   5   4.049  -1.467  -1.532
   36   3HD2  LEU   5          2HD2      LEU   5   2.474  -2.208  -1.794
   37    QB   LEU   5           QB       LEU   5   5.071  -3.382  -4.201
   38    QD1  LEU   5           QD1      LEU   5   2.170  -2.719  -4.527
   39    QD2  LEU   5           QD2      LEU   5   3.478  -2.297  -1.675
   40    QQD  LEU   5           QQD      LEU   5   2.824  -2.508  -3.101
   41    H    ILE   6           H        ILE   6   5.694   0.713  -3.775
   42    HA   ILE   6           HA       ILE   6   6.628   0.824  -0.971
   43    HB   ILE   6           HB       ILE   6   7.700   2.992  -1.612
   44   1HG1  ILE   6          1HG1      ILE   6   7.384   1.962  -4.480
   45   2HG1  ILE   6          2HG1      ILE   6   6.441   3.299  -3.790
   46   1HG2  ILE   6          2HG2      ILE   6   8.880   0.633  -1.477
   47   2HG2  ILE   6          3HG2      ILE   6   9.057   0.812  -3.224
   48   3HG2  ILE   6          1HG2      ILE   6   9.753   2.019  -2.119
   49   1HD1  ILE   6          3HD1      ILE   6   9.418   3.447  -3.766
   50   2HD1  ILE   6          1HD1      ILE   6   8.536   3.756  -5.279
   51   3HD1  ILE   6          2HD1      ILE   6   8.230   4.746  -3.858
   52    QG1  ILE   6           QG1      ILE   6   6.913   2.630  -4.135
   53    QG2  ILE   6           QG2      ILE   6   9.230   1.155  -2.273
   54    QD1  ILE   6           QD1      ILE   6   8.728   3.983  -4.301
   55    H    MET   7           H        MET   7   5.723   2.950   0.000
   56    HA   MET   7           HA       MET   7   3.702   4.154  -1.749
   57   1HB   MET   7          1HB       MET   7   2.394   4.741   0.201
   58   2HB   MET   7          2HB       MET   7   2.423   2.990  -0.081
   59   1HG   MET   7          1HG       MET   7   3.845   2.696   1.833
   60   2HG   MET   7          2HG       MET   7   4.089   4.443   2.005
   61   1HE   MET   7          2HE       MET   7   1.351   1.662   1.851
   62   2HE   MET   7          3HE       MET   7  -0.035   2.435   2.651
   63   3HE   MET   7          1HE       MET   7   0.492   3.011   1.067
   64    QB   MET   7           QB       MET   7   2.409   3.866   0.060
   65    QG   MET   7           QG       MET   7   3.967   3.569   1.919
   66    QE   MET   7           QE       MET   7   0.603   2.369   1.856
   67    H    CYS   8           H        CYS   8   3.579   6.327  -1.611
   68    HA   CYS   8           HA       CYS   8   6.097   7.620  -0.673
   69   1HB   CYS   8          1HB       CYS   8   4.532   8.143  -3.193
   70   2HB   CYS   8          2HB       CYS   8   5.936   9.056  -2.676
   71    QB   CYS   8           QB       CYS   8   5.234   8.599  -2.934
   72    H    LYS   9           H        LYS   9   5.842   9.832  -0.037
   73    HA   LYS   9           HA       LYS   9   3.421  10.127   1.205
   74   1HB   LYS   9          1HB       LYS   9   4.055  12.078   2.102
   75   2HB   LYS   9          2HB       LYS   9   5.619  11.382   1.672
   76   1HG   LYS   9          1HG       LYS   9   5.438  12.716  -0.480
   77   2HG   LYS   9          2HG       LYS   9   3.971  13.479   0.214
   78   1HD   LYS   9          1HD       LYS   9   5.424  14.213   2.165
   79   2HD   LYS   9          2HD       LYS   9   6.830  13.623   1.247
   80   1HE   LYS   9          1HE       LYS   9   6.193  15.125  -0.659
   81   2HE   LYS   9          2HE       LYS   9   4.855  15.776   0.305
   82   1HZ   LYS   9          1HZ       LYS   9   7.703  15.946   1.046
   83   2HZ   LYS   9          2HZ       LYS   9   6.819  17.177   0.395
   84   3HZ   LYS   9          3HZ       LYS   9   6.446  16.622   1.875
   85    QB   LYS   9           QB       LYS   9   4.837  11.730   1.887
   86    QG   LYS   9           QG       LYS   9   4.704  13.097  -0.133
   87    QD   LYS   9           QD       LYS   9   6.127  13.918   1.706
   88    QE   LYS   9           QE       LYS   9   5.524  15.450  -0.177
   89    QZ   LYS   9           QZ       LYS   9   6.989  16.581   1.105
   90    H    ASN  10           H        ASN  10   4.498  11.175  -1.946
   91    HA   ASN  10           HA       ASN  10   1.789  12.062  -2.787
   92   1HB   ASN  10          1HB       ASN  10   2.721  13.838  -4.145
   93   2HB   ASN  10          2HB       ASN  10   3.088  14.104  -2.477
   94   1HD2  ASN  10          2HD2      ASN  10   6.083  13.961  -5.125
   95   2HD2  ASN  10          1HD2      ASN  10   4.395  14.025  -5.611
   96    QB   ASN  10           QB       ASN  10   2.904  13.971  -3.311
   97    QD2  ASN  10           QD2      ASN  10   5.239  13.993  -5.368
   98    H    CYS  11           H        CYS  11   1.720  12.140  -5.132
   99    HA   CYS  11           HA       CYS  11   2.280   9.497  -6.054
  100   1HB   CYS  11          1HB       CYS  11   0.284  10.885  -6.510
  101   2HB   CYS  11          2HB       CYS  11   1.219  11.934  -7.553
  102    QB   CYS  11           QB       CYS  11   0.752  11.410  -7.031
  103    H    ASP  12           H        ASP  12   4.513  11.873  -5.976
  104    HA   ASP  12           HA       ASP  12   5.679  11.178  -8.666
  105   1HB   ASP  12          1HB       ASP  12   5.537  13.562  -8.267
  106   2HB   ASP  12          2HB       ASP  12   6.588  13.379  -6.849
  107    QB   ASP  12           QB       ASP  12   6.062  13.470  -7.558
  108    HA   PRO  13           HA       PRO  13   7.984   8.343  -5.926
  109   1HB   PRO  13          1HB       PRO  13   9.296   6.983  -8.029
  110   2HB   PRO  13          2HB       PRO  13   7.818   6.477  -7.194
  111   1HG   PRO  13          1HG       PRO  13   8.148   7.922  -9.811
  112   2HG   PRO  13          2HG       PRO  13   6.873   6.758  -9.369
  113   1HD   PRO  13          1HD       PRO  13   6.471   9.428  -9.519
  114   2HD   PRO  13          2HD       PRO  13   5.600   8.439  -8.322
  115    QB   PRO  13           QB       PRO  13   8.557   6.730  -7.612
  116    QG   PRO  13           QG       PRO  13   7.511   7.340  -9.590
  117    QD   PRO  13           QD       PRO  13   6.036   8.933  -8.920
  118    H    ASN  14           H        ASN  14   9.241  10.356  -8.594
  119    HA   ASN  14           HA       ASN  14  11.972  10.082  -7.957
  120   1HB   ASN  14          1HB       ASN  14  11.205  11.042 -10.040
  121   2HB   ASN  14          2HB       ASN  14  10.516  12.438  -9.221
  122   1HD2  ASN  14          2HD2      ASN  14  13.981  13.133 -10.644
  123   2HD2  ASN  14          1HD2      ASN  14  12.544  12.428 -11.373
  124    QB   ASN  14           QB       ASN  14  10.860  11.740  -9.631
  125    QD2  ASN  14           QD2      ASN  14  13.263  12.780 -11.008
  126    H    THR  15           H        THR  15   9.776  12.729  -6.974
  127    HA   THR  15           HA       THR  15  11.803  13.460  -4.875
  128    HB   THR  15           HB       THR  15  10.670  15.657  -4.853
  129    HG1  THR  15          1HG       THR  15   9.064  14.404  -6.837
  130   1HG2  THR  15          1HG2      THR  15  11.491  14.715  -7.627
  131   2HG2  THR  15          2HG2      THR  15  11.380  16.405  -7.081
  132   3HG2  THR  15          3HG2      THR  15  12.561  15.306  -6.349
  133    QG2  THR  15           QG2      THR  15  11.810  15.476  -7.019
  134    H    GLY  16           H        GLY  16   9.360  11.434  -4.814
  135   1HA   GLY  16          1HA       GLY  16   8.021  12.433  -2.388
  136   2HA   GLY  16          2HA       GLY  16   7.729  10.894  -3.178
  137    QA   GLY  16           QA       GLY  16   7.875  11.664  -2.783
  138    H    SER  17           H        SER  17   8.675  11.970  -0.358
  139    HA   SER  17           HA       SER  17  10.852  10.127   0.313
  140   1HB   SER  17          1HB       SER  17   9.660  10.314   2.583
  141   2HB   SER  17          2HB       SER  17  10.381  11.794   1.938
  142    HG   SER  17           HG       SER  17   7.679  10.998   1.506
  143    QB   SER  17           QB       SER  17  10.020  11.054   2.260
  144    H    CYS  18           H        CYS  18  10.500   7.978  -0.163
  145    HA   CYS  18           HA       CYS  18   7.774   6.855  -0.033
  146   1HB   CYS  18          1HB       CYS  18  10.133   6.373  -1.859
  147   2HB   CYS  18          2HB       CYS  18   8.662   5.435  -1.893
  148    QB   CYS  18           QB       CYS  18   9.398   5.904  -1.876
  149    H    ASP  19           H        ASP  19   7.580   4.812   0.959
  150    HA   ASP  19           HA       ASP  19   9.997   4.162   2.567
  151   1HB   ASP  19          1HB       ASP  19   8.609   2.304   3.435
  152   2HB   ASP  19          2HB       ASP  19   8.163   3.974   3.824
  153    QB   ASP  19           QB       ASP  19   8.386   3.139   3.630
  154    H    TRP  20           H        TRP  20  11.392   3.793   1.062
  155    HA   TRP  20           HA       TRP  20  11.426   1.335  -0.587
  156   1HB   TRP  20          1HB       TRP  20  13.514   3.514  -0.093
  157   2HB   TRP  20          2HB       TRP  20  13.728   2.104  -1.108
  158    HD1  TRP  20           HD       TRP  20  12.563   5.642  -1.260
  159    HE1  TRP  20          1HE       TRP  20  11.821   6.231  -3.594
  160    HE3  TRP  20          3HE       TRP  20  12.303   0.927  -3.130
  161    HZ2  TRP  20          2HZ       TRP  20  11.108   4.792  -6.046
  162    HZ3  TRP  20          3HZ       TRP  20  11.541   0.539  -5.457
  163    HH2  TRP  20           HH       TRP  20  10.907   2.467  -6.907
  164    QB   TRP  20           QB       TRP  20  13.621   2.809  -0.601
  165    H    LYS  21           H        LYS  21  10.755   0.629   1.671
  166    HA   LYS  21           HA       LYS  21  13.125  -0.650   2.909
  167   1HB   LYS  21          1HB       LYS  21  10.916   0.962   4.196
  168   2HB   LYS  21          2HB       LYS  21  11.181  -0.625   4.907
  169   1HG   LYS  21          1HG       LYS  21  13.385   1.443   4.554
  170   2HG   LYS  21          2HG       LYS  21  12.442   1.159   6.027
  171   1HD   LYS  21          1HD       LYS  21  13.162  -1.293   5.841
  172   2HD   LYS  21          2HD       LYS  21  14.383  -0.770   4.664
  173   1HE   LYS  21          1HE       LYS  21  15.409   0.689   6.334
  174   2HE   LYS  21          2HE       LYS  21  14.106   0.357   7.486
  175   1HZ   LYS  21          3HZ       LYS  21  14.825  -1.980   7.510
  176   2HZ   LYS  21          1HZ       LYS  21  16.121  -1.604   6.565
  177   3HZ   LYS  21          2HZ       LYS  21  15.951  -0.922   8.036
  178    QB   LYS  21           QB       LYS  21  11.049   0.168   4.552
  179    QG   LYS  21           QG       LYS  21  12.914   1.301   5.291
  180    QD   LYS  21           QD       LYS  21  13.772  -1.032   5.253
  181    QE   LYS  21           QE       LYS  21  14.758   0.523   6.910
  182    QZ   LYS  21           QZ       LYS  21  15.632  -1.502   7.370
  183    H    GLN  22           H        GLN  22  12.217  -2.864   3.929
  184    HA   GLN  22           HA       GLN  22  10.664  -4.063   1.830
  185   1HB   GLN  22          1HB       GLN  22  12.263  -5.355   3.315
  186   2HB   GLN  22          2HB       GLN  22  11.089  -5.126   4.635
  187   1HG   GLN  22          1HG       GLN  22  10.977  -7.366   3.531
  188   2HG   GLN  22          2HG       GLN  22   9.455  -6.481   3.583
  189   1HE2  GLN  22          2HE2      GLN  22   9.119  -6.996   0.108
  190   2HE2  GLN  22          1HE2      GLN  22   8.435  -7.330   1.697
  191    QB   GLN  22           QB       GLN  22  11.676  -5.241   3.975
  192    QG   GLN  22           QG       GLN  22  10.216  -6.924   3.557
  193    QE2  GLN  22           QE2      GLN  22   8.777  -7.163   0.902
  194    H    ASN  23           H        ASN  23   8.523  -4.654   1.898
  195    HA   ASN  23           HA       ASN  23   6.766  -3.235   3.888
  196   1HB   ASN  23          1HB       ASN  23   6.562  -3.017   0.875
  197   2HB   ASN  23          2HB       ASN  23   5.366  -2.442   2.029
  198   1HD2  ASN  23          2HD2      ASN  23   7.926   0.259   0.979
  199   2HD2  ASN  23          1HD2      ASN  23   7.164  -0.975  -0.004
  200    QB   ASN  23           QB       ASN  23   5.964  -2.730   1.452
  201    QD2  ASN  23           QD2      ASN  23   7.545  -0.358   0.488
  202    H    TRP  24           H        TRP  24   7.001  -5.714   1.332
  203    HA   TRP  24           HA       TRP  24   4.378  -6.680   1.951
  204   1HB   TRP  24          1HB       TRP  24   4.750  -7.134  -0.267
  205   2HB   TRP  24          2HB       TRP  24   6.460  -7.051  -0.077
  206    HD1  TRP  24           HD       TRP  24   7.760  -8.995  -0.582
  207    HE1  TRP  24          1HE       TRP  24   7.353 -11.483  -1.098
  208    HE3  TRP  24          3HE       TRP  24   2.869  -9.372   0.917
  209    HZ2  TRP  24          2HZ       TRP  24   5.158 -13.350  -0.958
  210    HZ3  TRP  24          3HZ       TRP  24   1.645 -11.482   0.660
  211    HH2  TRP  24           HH       TRP  24   2.710 -13.421  -0.444
  212    QB   TRP  24           QB       TRP  24   5.605  -7.093  -0.172
  213    H    ASN  25           H        ASN  25   5.947  -6.663   4.319
  214    HA   ASN  25           HA       ASN  25   5.348  -9.294   5.218
  215   1HB   ASN  25          1HB       ASN  25   7.898  -9.125   3.910
  216   2HB   ASN  25          2HB       ASN  25   8.269  -9.222   5.614
  217   1HD2  ASN  25          2HD2      ASN  25   6.612 -12.465   5.933
  218   2HD2  ASN  25          1HD2      ASN  25   6.865 -10.978   6.865
  219    QB   ASN  25           QB       ASN  25   8.083  -9.174   4.762
  220    QD2  ASN  25           QD2      ASN  25   6.738 -11.721   6.399
  221    H    THR  26           H        THR  26   5.005  -6.409   5.944
  222    HA   THR  26           HA       THR  26   5.773  -6.689   8.722
  223    HB   THR  26           HB       THR  26   7.840  -5.937   8.221
  224    HG1  THR  26          1HG       THR  26   8.007  -3.882   8.882
  225   1HG2  THR  26          2HG2      THR  26   6.721  -4.268   5.947
  226   2HG2  THR  26          3HG2      THR  26   8.404  -4.190   6.507
  227   3HG2  THR  26          1HG2      THR  26   7.782  -5.687   5.818
  228    QG2  THR  26           QG2      THR  26   7.636  -4.715   6.091
  229    H    CYS  27           H        CYS  27   4.803  -5.290  10.111
  230    HA   CYS  27           HA       CYS  27   2.252  -4.302   9.225
  231   1HB   CYS  27          1HB       CYS  27   2.724  -5.501  11.402
  232   2HB   CYS  27          2HB       CYS  27   3.611  -4.086  11.924
  233    QB   CYS  27           QB       CYS  27   3.168  -4.793  11.663
  234    H    VAL  28           H        VAL  28   2.957  -2.477   7.742
  235    HA   VAL  28           HA       VAL  28   4.633  -0.340   8.969
  236    HB   VAL  28           HB       VAL  28   3.855  -0.793   6.075
  237   1HG1  VAL  28          3HG1      VAL  28   6.021   0.928   7.379
  238   2HG1  VAL  28          1HG1      VAL  28   5.784   0.729   5.635
  239   3HG1  VAL  28          2HG1      VAL  28   4.561   1.561   6.601
  240   1HG2  VAL  28          1HG2      VAL  28   6.432  -1.541   7.520
  241   2HG2  VAL  28          2HG2      VAL  28   5.244  -2.668   6.841
  242   3HG2  VAL  28          3HG2      VAL  28   6.153  -1.621   5.765
  243    QG1  VAL  28           QG1      VAL  28   5.455   1.073   6.539
  244    QG2  VAL  28           QG2      VAL  28   5.943  -1.944   6.709
  245    QQG  VAL  28           QQG      VAL  28   5.699  -0.436   6.624
  246    H    GLY  29           H        GLY  29   3.931   1.832   9.000
  247   1HA   GLY  29          1HA       GLY  29   1.097   2.149   9.392
  248   2HA   GLY  29          2HA       GLY  29   2.385   3.302   9.713
  249    QA   GLY  29           QA       GLY  29   1.741   2.725   9.552
  250    H    ILE  30           H        ILE  30   0.037   4.229   8.615
  251    HA   ILE  30           HA       ILE  30   1.056   5.418   6.096
  252    HB   ILE  30           HB       ILE  30  -1.895   4.869   6.647
  253   1HG1  ILE  30          1HG1      ILE  30  -0.106   3.334   4.739
  254   2HG1  ILE  30          2HG1      ILE  30  -0.758   2.708   6.255
  255   1HG2  ILE  30          1HG2      ILE  30  -1.284   6.851   5.201
  256   2HG2  ILE  30          2HG2      ILE  30  -0.450   5.740   4.101
  257   3HG2  ILE  30          3HG2      ILE  30  -2.206   5.645   4.335
  258   1HD1  ILE  30          3HD1      ILE  30  -3.049   2.991   5.482
  259   2HD1  ILE  30          1HD1      ILE  30  -2.466   3.549   3.888
  260   3HD1  ILE  30          2HD1      ILE  30  -2.127   1.919   4.433
  261    QG1  ILE  30           QG1      ILE  30  -0.432   3.021   5.497
  262    QG2  ILE  30           QG2      ILE  30  -1.313   6.079   4.546
  263    QD1  ILE  30           QD1      ILE  30  -2.547   2.820   4.601
  264    H    GLY  31           H        GLY  31   1.039   7.713   6.386
  265   1HA   GLY  31          1HA       GLY  31  -1.051   9.177   7.207
  266   2HA   GLY  31          2HA       GLY  31  -0.210   8.878   8.742
  267    QA   GLY  31           QA       GLY  31  -0.630   9.028   7.974
  268    H    ALA  32           H        ALA  32  -0.278  11.346   8.205
  269    HA   ALA  32           HA       ALA  32   0.806  13.232   7.875
  270   1HB   ALA  32          2HB       ALA  32   2.177  12.235   9.632
  271   2HB   ALA  32          3HB       ALA  32   3.249  11.503   8.412
  272   3HB   ALA  32          1HB       ALA  32   3.174  13.268   8.586
  273    QB   ALA  32           QB       ALA  32   2.867  12.335   8.877
  274    H    ASN  33           H        ASN  33   0.099  13.514   5.864
  275    HA   ASN  33           HA       ASN  33   0.348  14.308   3.762
  276   1HB   ASN  33          1HB       ASN  33   3.359  13.953   3.941
  277   2HB   ASN  33          2HB       ASN  33   2.447  14.930   2.806
  278   1HD2  ASN  33          2HD2      ASN  33   1.577  17.441   5.335
  279   2HD2  ASN  33          1HD2      ASN  33   0.685  16.412   4.219
  280    QB   ASN  33           QB       ASN  33   2.903  14.442   3.374
  281    QD2  ASN  33           QD2      ASN  33   1.131  16.926   4.777
  282    H    VAL  34           H        VAL  34   0.772  11.223   4.657
  283    HA   VAL  34           HA       VAL  34   1.623  10.268   1.931
  284    HB   VAL  34           HB       VAL  34   1.292   8.733   4.535
  285   1HG1  VAL  34          2HG1      VAL  34   2.488   7.815   1.892
  286   2HG1  VAL  34          3HG1      VAL  34   2.512   6.898   3.407
  287   3HG1  VAL  34          1HG1      VAL  34   0.973   7.237   2.611
  288   1HG2  VAL  34          2HG2      VAL  34   3.292  10.323   4.519
  289   2HG2  VAL  34          3HG2      VAL  34   3.679   8.612   4.743
  290   3HG2  VAL  34          1HG2      VAL  34   3.949   9.377   3.178
  291    QG1  VAL  34           QG1      VAL  34   1.991   7.317   2.636
  292    QG2  VAL  34           QG2      VAL  34   3.640   9.437   4.147
  293    QQG  VAL  34           QQG      VAL  34   2.816   8.377   3.392
  294    H    HIS  35           H        HIS  35   0.168   9.923   0.463
  295    HA   HIS  35           HA       HIS  35  -2.005   8.086   1.235
  296   1HB   HIS  35          1HB       HIS  35  -3.765   9.364   0.274
  297   2HB   HIS  35          2HB       HIS  35  -3.027  10.302   1.577
  298    HD1  HIS  35          1HD       HIS  35  -4.298  10.693  -1.808
  299    HD2  HIS  35          2HD       HIS  35  -1.255  12.362   0.575
  300    HE1  HIS  35          1HE       HIS  35  -3.938  13.058  -2.654
  301    QB   HIS  35           QB       HIS  35  -3.396   9.833   0.926
  302    H    TRP  36           H        TRP  36   0.474   7.882  -0.478
  303    HA   TRP  36           HA       TRP  36  -1.045   6.875  -2.878
  304   1HB   TRP  36          1HB       TRP  36   1.530   8.429  -2.870
  305   2HB   TRP  36          2HB       TRP  36   0.798   7.642  -4.265
  306    HD1  TRP  36           HD       TRP  36   0.108  10.547  -1.845
  307    HE1  TRP  36          1HE       TRP  36  -1.369  12.243  -2.973
  308    HE3  TRP  36          3HE       TRP  36  -1.264   7.745  -5.836
  309    HZ2  TRP  36          2HZ       TRP  36  -3.045  12.368  -5.381
  310    HZ3  TRP  36          3HZ       TRP  36  -2.740   8.689  -7.605
  311    HH2  TRP  36           HH       TRP  36  -3.636  10.984  -7.370
  312    QB   TRP  36           QB       TRP  36   1.164   8.036  -3.567
  313    H    MET  37           H        MET  37  -0.685   4.804  -3.250
  314    HA   MET  37           HA       MET  37   1.800   3.454  -2.304
  315   1HB   MET  37          1HB       MET  37  -0.348   2.272  -1.955
  316   2HB   MET  37          2HB       MET  37  -0.575   2.233  -3.725
  317   1HG   MET  37          1HG       MET  37   0.356   0.176  -3.364
  318   2HG   MET  37          2HG       MET  37   1.849   1.087  -3.577
  319   1HE   MET  37          1HE       MET  37  -0.583  -0.746  -1.173
  320   2HE   MET  37          2HE       MET  37   0.189  -0.557   0.419
  321   3HE   MET  37          3HE       MET  37  -0.625   0.823  -0.335
  322    QB   MET  37           QB       MET  37  -0.461   2.252  -2.840
  323    QG   MET  37           QG       MET  37   1.102   0.631  -3.471
  324    QE   MET  37           QE       MET  37  -0.339  -0.160  -0.363
  325    H    VAL  38           H        VAL  38   3.381   3.053  -3.922
  326    HA   VAL  38           HA       VAL  38   2.698   3.747  -6.725
  327    HB   VAL  38           HB       VAL  38   5.243   4.782  -5.436
  328   1HG1  VAL  38          1HG1      VAL  38   5.048   4.632  -7.945
  329   2HG1  VAL  38          2HG1      VAL  38   3.629   5.699  -7.862
  330   3HG1  VAL  38          3HG1      VAL  38   5.215   6.299  -7.357
  331   1HG2  VAL  38          3HG2      VAL  38   2.578   6.261  -5.660
  332   2HG2  VAL  38          1HG2      VAL  38   3.497   5.943  -4.169
  333   3HG2  VAL  38          2HG2      VAL  38   4.135   7.052  -5.387
  334    QG1  VAL  38           QG1      VAL  38   4.631   5.543  -7.721
  335    QG2  VAL  38           QG2      VAL  38   3.404   6.419  -5.072
  336    QQG  VAL  38           QQG      VAL  38   4.017   5.981  -6.397
  337    H    THR  39           H        THR  39   3.512   2.147  -8.063
  338    HA   THR  39           HA       THR  39   5.532   0.307  -6.878
  339    HB   THR  39           HB       THR  39   3.512  -0.625  -6.124
  340    HG1  THR  39          1HG       THR  39   4.981  -2.104  -7.188
  341   1HG2  THR  39          2HG2      THR  39   2.419  -0.207  -8.903
  342   2HG2  THR  39          3HG2      THR  39   1.667  -1.305  -7.723
  343   3HG2  THR  39          1HG2      THR  39   1.784   0.426  -7.372
  344    QG2  THR  39           QG2      THR  39   1.957  -0.362  -7.999
  345    H    GLY  40           H        GLY  40   6.414  -1.164  -8.346
  346   1HA   GLY  40          1HA       GLY  40   6.432  -0.336 -11.183
  347   2HA   GLY  40          2HA       GLY  40   7.948  -0.379 -10.260
  348    QA   GLY  40           QA       GLY  40   7.190  -0.358 -10.722
  349    H    GLY  41           H        GLY  41   8.119  -2.065 -12.148
  350   1HA   GLY  41          1HA       GLY  41   8.276  -4.712 -11.924
  351   2HA   GLY  41          2HA       GLY  41   6.536  -4.530 -11.610
  352    QA   GLY  41           QA       GLY  41   7.406  -4.621 -11.767
  353    H    SER  42           H        SER  42   6.401  -2.195 -13.373
  354    HA   SER  42           HA       SER  42   6.523  -1.312 -15.310
  355   1HB   SER  42          1HB       SER  42   8.787  -2.097 -14.780
  356   2HB   SER  42          2HB       SER  42   8.479  -3.380 -15.921
  357    HG   SER  42           HG       SER  42   8.204  -1.651 -17.533
  358    QB   SER  42           QB       SER  42   8.633  -2.738 -15.350
  359    H    THR  43           H        THR  43   7.040  -4.762 -16.047
  360    HA   THR  43           HA       THR  43   4.293  -5.015 -17.024
  361    HB   THR  43           HB       THR  43   4.997  -6.530 -18.839
  362    HG1  THR  43          1HG       THR  43   7.587  -5.664 -18.058
  363   1HG2  THR  43          3HG2      THR  43   4.560  -4.042 -19.179
  364   2HG2  THR  43          1HG2      THR  43   6.312  -3.793 -19.147
  365   3HG2  THR  43          2HG2      THR  43   5.595  -4.778 -20.426
  366    QG2  THR  43           QG2      THR  43   5.489  -4.204 -19.584
  367    H    ASP  44           H        ASP  44   7.288  -7.027 -16.591
  368    HA   ASP  44           HA       ASP  44   5.472  -9.059 -15.510
  369   1HB   ASP  44          1HB       ASP  44   7.672 -10.423 -15.881
  370   2HB   ASP  44          2HB       ASP  44   6.708  -9.923 -17.258
  371    QB   ASP  44           QB       ASP  44   7.190 -10.173 -16.569
  372    H    GLY  45           H        GLY  45   6.233  -6.864 -13.810
  373   1HA   GLY  45          1HA       GLY  45   7.755  -8.120 -11.613
  374   2HA   GLY  45          2HA       GLY  45   6.900  -6.601 -11.540
  375    QA   GLY  45           QA       GLY  45   7.328  -7.360 -11.577
  376    H    LYS  46           H        LYS  46   4.496  -7.798 -12.744
  377    HA   LYS  46           HA       LYS  46   2.540  -8.602 -12.232
  378   1HB   LYS  46          1HB       LYS  46   3.865 -10.319 -10.119
  379   2HB   LYS  46          2HB       LYS  46   2.204 -10.456 -10.717
  380   1HG   LYS  46          1HG       LYS  46   3.026 -10.812 -13.018
  381   2HG   LYS  46          2HG       LYS  46   4.702 -10.685 -12.467
  382   1HD   LYS  46          1HD       LYS  46   4.462 -12.693 -11.088
  383   2HD   LYS  46          2HD       LYS  46   2.745 -12.829 -11.535
  384   1HE   LYS  46          1HE       LYS  46   3.329 -13.082 -13.916
  385   2HE   LYS  46          2HE       LYS  46   5.045 -12.829 -13.568
  386   1HZ   LYS  46          2HZ       LYS  46   3.524 -15.153 -12.521
  387   2HZ   LYS  46          3HZ       LYS  46   4.397 -15.130 -13.887
  388   3HZ   LYS  46          1HZ       LYS  46   5.171 -14.871 -12.482
  389    QB   LYS  46           QB       LYS  46   3.034 -10.387 -10.418
  390    QG   LYS  46           QG       LYS  46   3.864 -10.749 -12.742
  391    QD   LYS  46           QD       LYS  46   3.604 -12.761 -11.311
  392    QE   LYS  46           QE       LYS  46   4.187 -12.955 -13.742
  393    QZ   LYS  46           QZ       LYS  46   4.364 -15.051 -12.963
  394    H    GLN  47           H        GLN  47   0.833  -7.758 -11.243
  395    HA   GLN  47           HA       GLN  47   0.984  -5.488  -9.725
  396   1HB   GLN  47          1HB       GLN  47  -1.416  -5.778  -9.379
  397   2HB   GLN  47          2HB       GLN  47  -0.943  -6.252 -11.015
  398   1HG   GLN  47          1HG       GLN  47  -0.900  -8.692 -10.020
  399   2HG   GLN  47          2HG       GLN  47  -1.870  -8.001  -8.721
  400   1HE2  GLN  47          2HE2      GLN  47  -4.805  -7.932 -10.769
  401   2HE2  GLN  47          1HE2      GLN  47  -4.134  -8.122  -9.156
  402    QB   GLN  47           QB       GLN  47  -1.179  -6.015 -10.197
  403    QG   GLN  47           QG       GLN  47  -1.385  -8.346  -9.371
  404    QE2  GLN  47           QE2      GLN  47  -4.470  -8.027  -9.962
  405    H    GLY  48           H        GLY  48   0.392  -4.951  -7.542
  406   1HA   GLY  48          1HA       GLY  48   0.909  -7.141  -5.544
  407   2HA   GLY  48          2HA       GLY  48   1.545  -5.497  -5.369
  408    QA   GLY  48           QA       GLY  48   1.227  -6.319  -5.457
  409    H    CYS  49           H        CYS  49  -0.429  -7.026  -3.657
  410    HA   CYS  49           HA       CYS  49  -2.315  -4.799  -3.530
  411   1HB   CYS  49          1HB       CYS  49  -3.000  -7.757  -3.055
  412   2HB   CYS  49          2HB       CYS  49  -4.090  -6.404  -2.928
  413    QB   CYS  49           QB       CYS  49  -3.545  -7.080  -2.991
  414    H    ALA  50           H        ALA  50  -3.105  -4.458  -1.489
  415    HA   ALA  50           HA       ALA  50  -1.792  -5.957   0.721
  416   1HB   ALA  50          2HB       ALA  50  -1.974  -2.912   0.435
  417   2HB   ALA  50          3HB       ALA  50  -1.469  -3.743   1.919
  418   3HB   ALA  50          1HB       ALA  50  -0.464  -3.839   0.465
  419    QB   ALA  50           QB       ALA  50  -1.303  -3.498   0.940
  420    H    THR  51           H        THR  51  -2.754  -6.023   2.651
  421    HA   THR  51           HA       THR  51  -5.630  -5.250   2.588
  422    HB   THR  51           HB       THR  51  -3.969  -6.811   4.612
  423    HG1  THR  51          1HG       THR  51  -5.227  -8.461   4.026
  424   1HG2  THR  51          1HG2      THR  51  -6.851  -5.794   4.729
  425   2HG2  THR  51          2HG2      THR  51  -6.188  -7.035   5.819
  426   3HG2  THR  51          3HG2      THR  51  -5.548  -5.385   5.837
  427    QG2  THR  51           QG2      THR  51  -6.196  -6.071   5.462
  428    H    ILE  52           H        ILE  52  -6.022  -3.323   3.343
  429    HA   ILE  52           HA       ILE  52  -3.914  -1.696   4.629
  430    HB   ILE  52           HB       ILE  52  -6.573  -0.983   3.284
  431   1HG1  ILE  52          1HG1      ILE  52  -5.165  -1.821   1.558
  432   2HG1  ILE  52          2HG1      ILE  52  -5.289  -0.059   1.414
  433   1HG2  ILE  52          1HG2      ILE  52  -4.341   0.809   4.255
  434   2HG2  ILE  52          2HG2      ILE  52  -5.700   1.327   3.224
  435   3HG2  ILE  52          3HG2      ILE  52  -6.017   0.701   4.853
  436   1HD1  ILE  52          3HD1      ILE  52  -3.024   0.138   2.487
  437   2HD1  ILE  52          1HD1      ILE  52  -2.942  -1.648   2.463
  438   3HD1  ILE  52          2HD1      ILE  52  -3.024  -0.737   0.948
  439    QG1  ILE  52           QG1      ILE  52  -5.227  -0.940   1.486
  440    QG2  ILE  52           QG2      ILE  52  -5.353   0.946   4.111
  441    QD1  ILE  52           QD1      ILE  52  -2.996  -0.749   1.966
  442    H    TRP  53           H        TRP  53  -4.643  -0.642   6.665
  443    HA   TRP  53           HA       TRP  53  -7.064  -1.858   7.878
  444   1HB   TRP  53          1HB       TRP  53  -4.218  -1.828   8.850
  445   2HB   TRP  53          2HB       TRP  53  -5.518  -1.798  10.031
  446    HD1  TRP  53           HD       TRP  53  -7.100  -3.946  10.220
  447    HE1  TRP  53          1HE       TRP  53  -6.630  -6.407   9.788
  448    HE3  TRP  53          3HE       TRP  53  -3.050  -3.435   7.147
  449    HZ2  TRP  53          2HZ       TRP  53  -4.699  -7.995   8.305
  450    HZ3  TRP  53          3HZ       TRP  53  -1.968  -5.441   6.186
  451    HH2  TRP  53           HH       TRP  53  -2.788  -7.709   6.723
  452    QB   TRP  53           QB       TRP  53  -4.868  -1.813   9.440
  453    H    GLU  54           H        GLU  54  -7.891  -0.827   9.664
  454    HA   GLU  54           HA       GLU  54  -7.769   2.103   9.564
  455   1HB   GLU  54          1HB       GLU  54  -9.769   0.652   9.105
  456   2HB   GLU  54          2HB       GLU  54  -9.768   0.160  10.795
  457   1HG   GLU  54          1HG       GLU  54  -9.950   3.072   9.908
  458   2HG   GLU  54          2HG       GLU  54 -11.374   2.035   9.991
  459    QB   GLU  54           QB       GLU  54  -9.768   0.406   9.950
  460    QG   GLU  54           QG       GLU  54 -10.662   2.553   9.950
  461    H    GLY  55           H        GLY  55  -7.186  -0.713  11.748
  462   1HA   GLY  55          1HA       GLY  55  -6.802   0.800  14.172
  463   2HA   GLY  55          2HA       GLY  55  -6.162  -0.763  13.817
  464    QA   GLY  55           QA       GLY  55  -6.482   0.018  13.995
  465    H    SER  56           H        SER  56  -4.923   1.829  14.899
  466    HA   SER  56           HA       SER  56  -2.822   2.445  13.005
  467   1HB   SER  56          1HB       SER  56  -2.811   2.991  15.996
  468   2HB   SER  56          2HB       SER  56  -1.976   3.852  14.692
  469    HG   SER  56           HG       SER  56  -3.757   5.057  15.004
  470    QB   SER  56           QB       SER  56  -2.394   3.421  15.344
  471    H    GLY  57           H        GLY  57  -2.595  -0.132  12.839
  472   1HA   GLY  57          1HA       GLY  57  -0.011  -0.867  13.343
  473   2HA   GLY  57          2HA       GLY  57  -0.863  -1.253  14.848
  474    QA   GLY  57           QA       GLY  57  -0.437  -1.060  14.095
  475    H    CYS  58           H        CYS  58  -1.941  -1.508  11.422
  476    HA   CYS  58           HA       CYS  58  -3.089  -3.112  10.402
  477   1HB   CYS  58          1HB       CYS  58  -1.976  -5.254  10.081
  478   2HB   CYS  58          2HB       CYS  58  -0.949  -3.897   9.782
  479    QB   CYS  58           QB       CYS  58  -1.463  -4.575   9.932
  480    H    VAL  59           H        VAL  59  -4.429  -2.626  12.798
  481    HA   VAL  59           HA       VAL  59  -5.623  -5.272  13.246
  482    HB   VAL  59           HB       VAL  59  -6.147  -4.399  15.533
  483   1HG1  VAL  59          1HG1      VAL  59  -4.515  -6.209  15.132
  484   2HG1  VAL  59          2HG1      VAL  59  -3.217  -5.009  14.983
  485   3HG1  VAL  59          3HG1      VAL  59  -4.057  -5.222  16.530
  486   1HG2  VAL  59          1HG2      VAL  59  -3.878  -2.433  15.054
  487   2HG2  VAL  59          2HG2      VAL  59  -5.580  -2.070  15.437
  488   3HG2  VAL  59          3HG2      VAL  59  -4.557  -2.858  16.630
  489    QG1  VAL  59           QG1      VAL  59  -3.930  -5.480  15.549
  490    QG2  VAL  59           QG2      VAL  59  -4.672  -2.454  15.707
  491    QQG  VAL  59           QQG      VAL  59  -4.301  -3.967  15.628
  492    H    GLY  60           H        GLY  60  -7.945  -4.763  14.156
  493   1HA   GLY  60          1HA       GLY  60  -9.904  -3.495  14.069
  494   2HA   GLY  60          2HA       GLY  60  -8.972  -2.137  13.447
  495    QA   GLY  60           QA       GLY  60  -9.438  -2.816  13.758
  496    H    ARG  61           H        ARG  61 -10.382  -1.626  11.813
  497    HA   ARG  61           HA       ARG  61 -11.611  -3.713  10.095
  498   1HB   ARG  61          1HB       ARG  61 -12.820  -1.625  11.070
  499   2HB   ARG  61          2HB       ARG  61 -11.846  -0.686   9.935
  500   1HG   ARG  61          1HG       ARG  61 -12.865  -2.104   8.067
  501   2HG   ARG  61          2HG       ARG  61 -13.914  -2.844   9.291
  502   1HD   ARG  61          1HD       ARG  61 -14.812  -0.633   9.875
  503   2HD   ARG  61          2HD       ARG  61 -13.693   0.150   8.729
  504    HE   ARG  61           HE       ARG  61 -15.006  -1.568   7.090
  505   1HH1  ARG  61          2HH2      ARG  61 -15.817   1.177   9.173
  506   2HH1  ARG  61          1HH2      ARG  61 -17.433   1.394   8.586
  507   1HH2  ARG  61          2HH1      ARG  61 -17.083  -1.153   6.057
  508   2HH2  ARG  61          1HH1      ARG  61 -17.952   0.304   6.502
  509    QB   ARG  61           QB       ARG  61 -12.333  -1.155  10.502
  510    QG   ARG  61           QG       ARG  61 -13.390  -2.474   8.679
  511    QD   ARG  61           QD       ARG  61 -14.253  -0.241   9.302
  512    QH1  ARG  61           QH2      ARG  61 -16.625   1.286   8.879
  513    QH2  ARG  61           QH1      ARG  61 -17.518  -0.425   6.279
  514    H    SER  62           H        SER  62 -11.416  -3.733   7.817
  515    HA   SER  62           HA       SER  62  -9.054  -2.434   6.893
  516   1HB   SER  62          1HB       SER  62  -8.481  -5.080   6.145
  517   2HB   SER  62          2HB       SER  62  -7.693  -4.144   7.403
  518    HG   SER  62           HG       SER  62  -9.129  -4.988   8.932
  519    QB   SER  62           QB       SER  62  -8.087  -4.612   6.774
  520    H    THR  63           H        THR  63  -8.501  -3.077   4.605
  521    HA   THR  63           HA       THR  63 -10.771  -3.973   2.951
  522    HB   THR  63           HB       THR  63 -10.089  -1.211   3.333
  523    HG1  THR  63          1HG       THR  63 -12.021  -2.621   1.921
  524   1HG2  THR  63          3HG2      THR  63  -8.433  -1.396   1.504
  525   2HG2  THR  63          1HG2      THR  63  -9.730  -1.989   0.432
  526   3HG2  THR  63          2HG2      THR  63  -9.783  -0.355   1.097
  527    QG2  THR  63           QG2      THR  63  -9.315  -1.247   1.011
  528    H    THR  64           H        THR  64  -9.990  -5.018   1.009
  529    HA   THR  64           HA       THR  64  -7.079  -5.289   0.758
  530    HB   THR  64           HB       THR  64  -8.870  -7.131   0.355
  531    HG1  THR  64          1HG       THR  64  -6.862  -7.695  -0.001
  532   1HG2  THR  64          2HG2      THR  64 -10.189  -5.892  -1.381
  533   2HG2  THR  64          3HG2      THR  64  -8.783  -6.008  -2.465
  534   3HG2  THR  64          1HG2      THR  64  -9.580  -7.480  -1.893
  535    QG2  THR  64           QG2      THR  64  -9.517  -6.460  -1.913
  536    H    MET  65           H        MET  65  -5.917  -3.840  -0.355
  537    HA   MET  65           HA       MET  65  -7.188  -2.100  -2.434
  538   1HB   MET  65          1HB       MET  65  -6.379  -1.116  -0.259
  539   2HB   MET  65          2HB       MET  65  -4.732  -1.581  -0.719
  540   1HG   MET  65          1HG       MET  65  -4.572   0.390  -1.780
  541   2HG   MET  65          2HG       MET  65  -5.781  -0.182  -2.939
  542   1HE   MET  65          1HE       MET  65  -8.273   0.248  -2.799
  543   2HE   MET  65          2HE       MET  65  -8.444  -0.321  -1.127
  544   3HE   MET  65          3HE       MET  65  -9.088   1.270  -1.593
  545    QB   MET  65           QB       MET  65  -5.555  -1.348  -0.489
  546    QG   MET  65           QG       MET  65  -5.177   0.104  -2.360
  547    QE   MET  65           QE       MET  65  -8.602   0.399  -1.840
  548    H    CYS  66           H        CYS  66  -6.650  -2.988  -4.423
  549    HA   CYS  66           HA       CYS  66  -3.983  -4.309  -4.749
  550   1HB   CYS  66          1HB       CYS  66  -6.633  -4.569  -6.169
  551   2HB   CYS  66          2HB       CYS  66  -5.142  -5.177  -6.859
  552    QB   CYS  66           QB       CYS  66  -5.887  -4.873  -6.514
  553    H    CYS  67           H        CYS  67  -2.652  -3.729  -6.493
  554    HA   CYS  67           HA       CYS  67  -3.566  -1.707  -8.415
  555   1HB   CYS  67          1HB       CYS  67  -2.696  -0.654  -6.267
  556   2HB   CYS  67          2HB       CYS  67  -1.092  -1.211  -6.727
  557    QB   CYS  67           QB       CYS  67  -1.894  -0.933  -6.497
  558    HA   PRO  68           HA       PRO  68  -0.695  -4.102 -10.911
  559   1HB   PRO  68          1HB       PRO  68  -0.507  -2.391 -13.114
  560   2HB   PRO  68          2HB       PRO  68  -1.702  -3.672 -12.839
  561   1HG   PRO  68          1HG       PRO  68  -1.897  -0.689 -12.403
  562   2HG   PRO  68          2HG       PRO  68  -3.193  -1.782 -12.955
  563   1HD   PRO  68          1HD       PRO  68  -3.019  -0.805 -10.400
  564   2HD   PRO  68          2HD       PRO  68  -3.712  -2.410 -10.753
  565    QB   PRO  68           QB       PRO  68  -1.104  -3.032 -12.977
  566    QG   PRO  68           QG       PRO  68  -2.545  -1.235 -12.679
  567    QD   PRO  68           QD       PRO  68  -3.365  -1.607 -10.577
  568    H    ALA  69           H        ALA  69   1.345  -3.945 -11.972
  569    HA   ALA  69           HA       ALA  69   3.015  -2.779  -9.880
  570   1HB   ALA  69          3HB       ALA  69   3.095  -5.188 -10.833
  571   2HB   ALA  69          1HB       ALA  69   3.851  -4.513 -12.283
  572   3HB   ALA  69          2HB       ALA  69   4.653  -4.368 -10.713
  573    QB   ALA  69           QB       ALA  69   3.866  -4.690 -11.276
  574    H    ASN  70           H        ASN  70   2.377  -0.648 -11.184
  575    HA   ASN  70           HA       ASN  70   4.502   0.826 -12.256
  576   1HB   ASN  70          1HB       ASN  70   4.177   0.541 -14.767
  577   2HB   ASN  70          2HB       ASN  70   5.105  -0.652 -13.926
  578   1HD2  ASN  70          2HD2      ASN  70   1.359  -1.693 -15.360
  579   2HD2  ASN  70          1HD2      ASN  70   1.770   0.011 -14.999
  580    QB   ASN  70           QB       ASN  70   4.641  -0.055 -14.347
  581    QD2  ASN  70           QD2      ASN  70   1.565  -0.841 -15.180
  582    H    THR  71           H        THR  71   2.352   1.434 -10.809
  583    HA   THR  71           HA       THR  71   1.557   3.636 -12.367
  584    HB   THR  71           HB       THR  71  -0.159   1.762 -12.889
  585    HG1  THR  71          1HG       THR  71  -0.529   3.892 -13.461
  586   1HG2  THR  71          2HG2      THR  71  -0.544   1.008 -10.611
  587   2HG2  THR  71          3HG2      THR  71  -1.271   2.586 -10.196
  588   3HG2  THR  71          1HG2      THR  71  -2.045   1.540 -11.400
  589    QG2  THR  71           QG2      THR  71  -1.287   1.711 -10.736
  590    H    CYS  72           H        CYS  72   0.378   5.144 -10.951
  591    HA   CYS  72           HA       CYS  72   1.247   5.013  -8.091
  592   1HB   CYS  72          1HB       CYS  72   2.067   6.960  -9.337
  593   2HB   CYS  72          2HB       CYS  72   0.426   7.251  -9.960
  594    QB   CYS  72           QB       CYS  72   1.247   7.105  -9.649
  595    H    CYS  73           H        CYS  73  -0.344   4.740  -6.610
  596    HA   CYS  73           HA       CYS  73  -3.169   4.537  -7.527
  597   1HB   CYS  73          1HB       CYS  73  -2.265   2.946  -5.196
  598   2HB   CYS  73          2HB       CYS  73  -3.249   2.496  -6.567
  599    QB   CYS  73           QB       CYS  73  -2.757   2.721  -5.882
  600    H    ASN  74           H        ASN  74  -4.485   6.029  -6.459
  601    HA   ASN  74           HA       ASN  74  -3.412   7.477  -4.145
  602   1HB   ASN  74          1HB       ASN  74  -4.823   8.608  -5.923
  603   2HB   ASN  74          2HB       ASN  74  -6.196   7.660  -5.371
  604   1HD2  ASN  74          2HD2      ASN  74  -6.879  10.102  -2.873
  605   2HD2  ASN  74          1HD2      ASN  74  -7.506   8.893  -3.978
  606    QB   ASN  74           QB       ASN  74  -5.510   8.134  -5.647
  607    QD2  ASN  74           QD2      ASN  74  -7.192   9.498  -3.426
  608    H    ILE  75           H        ILE  75  -3.679   6.895  -2.073
  609    HA   ILE  75           HA       ILE  75  -5.616   4.772  -1.339
  610    HB   ILE  75           HB       ILE  75  -3.160   5.987  -0.053
  611   1HG1  ILE  75          1HG1      ILE  75  -2.402   3.675  -0.020
  612   2HG1  ILE  75          2HG1      ILE  75  -3.962   3.096  -0.659
  613   1HG2  ILE  75          3HG2      ILE  75  -5.220   4.156   1.235
  614   2HG2  ILE  75          1HG2      ILE  75  -3.551   4.351   1.824
  615   3HG2  ILE  75          2HG2      ILE  75  -4.628   5.736   1.820
  616   1HD1  ILE  75          2HD1      ILE  75  -2.190   5.075  -2.070
  617   2HD1  ILE  75          3HD1      ILE  75  -2.064   3.318  -2.316
  618   3HD1  ILE  75          1HD1      ILE  75  -3.523   4.121  -2.793
  619    QG1  ILE  75           QG1      ILE  75  -3.182   3.386  -0.340
  620    QG2  ILE  75           QG2      ILE  75  -4.466   4.748   1.626
  621    QD1  ILE  75           QD1      ILE  75  -2.592   4.171  -2.393
  622    H    ASN  76           H        ASN  76  -7.484   5.992  -1.634
  623    HA   ASN  76           HA       ASN  76  -8.114   7.539   0.819
  624   1HB   ASN  76          1HB       ASN  76  -8.674   8.477  -1.995
  625   2HB   ASN  76          2HB       ASN  76  -9.876   8.729  -0.738
  626   1HD2  ASN  76          2HD2      ASN  76  -6.231  10.594  -0.103
  627   2HD2  ASN  76          1HD2      ASN  76  -6.266   9.080  -0.989
  628    QB   ASN  76           QB       ASN  76  -9.275   8.603  -1.367
  629    QD2  ASN  76           QD2      ASN  76  -6.248   9.837  -0.546
  630    H    THR  77           H        THR  77  -8.664   5.505   1.572
  631    HA   THR  77           HA       THR  77 -10.440   3.718   0.161
  632    HB   THR  77           HB       THR  77 -10.320   2.712   2.597
  633    HG1  THR  77          1HG       THR  77  -9.583   4.556   3.695
  634   1HG2  THR  77          1HG2      THR  77  -7.760   3.143   0.990
  635   2HG2  THR  77          2HG2      THR  77  -8.025   1.891   2.220
  636   3HG2  THR  77          3HG2      THR  77  -8.966   1.867   0.718
  637    QG2  THR  77           QG2      THR  77  -8.250   2.300   1.309
  638    H    GLY  78           H        GLY  78 -12.427   2.964   1.644
  639   1HA   GLY  78          1HA       GLY  78 -14.337   5.033   1.647
  640   2HA   GLY  78          2HA       GLY  78 -14.484   3.504   2.537
  641    QA   GLY  78           QA       GLY  78 -14.411   4.268   2.092
  642    H    PHE  79           H        PHE  79 -12.049   4.095   4.126
  643    HA   PHE  79           HA       PHE  79 -13.080   6.055   6.136
  644   1HB   PHE  79          1HB       PHE  79 -12.029   4.419   7.769
  645   2HB   PHE  79          2HB       PHE  79 -13.425   3.787   6.950
  646    HD1  PHE  79          1HD       PHE  79 -13.116   2.059   5.055
  647    HD2  PHE  79          2HD       PHE  79  -9.866   3.338   7.572
  648    HE1  PHE  79          1HE       PHE  79 -11.569   0.580   3.824
  649    HE2  PHE  79          2HE       PHE  79  -8.309   1.878   6.329
  650   1HZ   PHE  79           HZ       PHE  79  -9.120   0.566   4.392
  651    QB   PHE  79           QB       PHE  79 -12.727   4.103   7.360
  652    QG   PHE  79           QD       PHE  79 -11.491   2.698   6.313
  653    QZ   PHE  79           QE       PHE  79  -9.939   1.229   5.077
  654    QZ   PHE  79           QR       PHE  79 -10.396   1.684   5.435
  655    H    TYR  80           H        TYR  80 -11.402   6.647   7.684
  656    HA   TYR  80           HA       TYR  80  -9.220   7.678   6.131
  657   1HB   TYR  80          1HB       TYR  80 -10.031   9.025   7.966
  658   2HB   TYR  80          2HB       TYR  80  -9.813   7.690   9.100
  659    HD1  TYR  80          2HD       TYR  80  -7.523   9.264   6.538
  660    HD2  TYR  80          1HD       TYR  80  -8.111   8.099  10.650
  661    HE1  TYR  80          2HE       TYR  80  -5.146   9.682   6.992
  662    HE2  TYR  80          1HE       TYR  80  -5.712   8.558  11.107
  663    HH   TYR  80           HH       TYR  80  -3.668  10.087   8.722
  664    QB   TYR  80           QB       TYR  80  -9.922   8.358   8.533
  665    QG   TYR  80           QD       TYR  80  -7.817   8.681   8.594
  666    QZ   TYR  80           QE       TYR  80  -5.429   9.120   9.050
  667    QR   TYR  80           QR       TYR  80  -6.623   8.901   8.822
  668    H    ILE  81           H        ILE  81  -7.119   6.835   6.047
  669    HA   ILE  81           HA       ILE  81  -6.857   4.023   6.742
  670    HB   ILE  81           HB       ILE  81  -4.405   4.848   5.765
  671   1HG1  ILE  81          1HG1      ILE  81  -5.436   7.116   5.163
  672   2HG1  ILE  81          2HG1      ILE  81  -4.589   6.229   3.931
  673   1HG2  ILE  81          1HG2      ILE  81  -6.756   3.613   4.343
  674   2HG2  ILE  81          2HG2      ILE  81  -5.076   3.646   3.745
  675   3HG2  ILE  81          3HG2      ILE  81  -5.467   2.838   5.276
  676   1HD1  ILE  81          3HD1      ILE  81  -7.641   6.194   4.167
  677   2HD1  ILE  81          1HD1      ILE  81  -6.714   7.198   3.058
  678   3HD1  ILE  81          2HD1      ILE  81  -6.668   5.449   2.895
  679    QG1  ILE  81           QG1      ILE  81  -5.012   6.673   4.547
  680    QG2  ILE  81           QG2      ILE  81  -5.766   3.366   4.455
  681    QD1  ILE  81           QD1      ILE  81  -7.008   6.281   3.373
  682    H    ARG  82           H        ARG  82  -5.045   3.069   7.891
  683    HA   ARG  82           HA       ARG  82  -3.371   4.984   9.347
  684   1HB   ARG  82          1HB       ARG  82  -5.476   3.435  10.584
  685   2HB   ARG  82          2HB       ARG  82  -3.935   2.898  11.219
  686   1HG   ARG  82          1HG       ARG  82  -3.470   4.909  12.239
  687   2HG   ARG  82          2HG       ARG  82  -4.277   5.887  11.000
  688   1HD   ARG  82          1HD       ARG  82  -5.779   4.193  12.963
  689   2HD   ARG  82          2HD       ARG  82  -5.465   5.930  13.172
  690    HE   ARG  82           HE       ARG  82  -6.543   5.835  10.658
  691   1HH1  ARG  82          2HH2      ARG  82  -7.703   4.648  13.839
  692   2HH1  ARG  82          1HH2      ARG  82  -9.296   4.315  13.174
  693   1HH2  ARG  82          2HH1      ARG  82  -8.762   5.398   9.962
  694   2HH2  ARG  82          1HH1      ARG  82  -9.885   4.856  11.192
  695    QB   ARG  82           QB       ARG  82  -4.706   3.167  10.902
  696    QG   ARG  82           QG       ARG  82  -3.874   5.398  11.620
  697    QD   ARG  82           QD       ARG  82  -5.622   5.062  13.068
  698    QH1  ARG  82           QH2      ARG  82  -8.500   4.482  13.506
  699    QH2  ARG  82           QH1      ARG  82  -9.324   5.127  10.577
  700    H    SER  83           H        SER  83  -3.776   1.587   8.460
  701    HA   SER  83           HA       SER  83  -0.787   1.485   8.175
  702   1HB   SER  83          1HB       SER  83  -0.878  -0.647   9.509
  703   2HB   SER  83          2HB       SER  83  -1.070   0.853  10.415
  704    HG   SER  83           HG       SER  83  -3.250   0.421  10.608
  705    QB   SER  83           QB       SER  83  -0.974   0.103   9.962
  706    H    TYR  84           H        TYR  84   0.013  -0.711   7.216
  707    HA   TYR  84           HA       TYR  84  -1.969  -2.089   5.584
  708   1HB   TYR  84          1HB       TYR  84  -1.029  -1.579   3.478
  709   2HB   TYR  84          2HB       TYR  84  -1.387  -0.045   4.241
  710    HD1  TYR  84          2HD       TYR  84   0.734   1.130   5.434
  711    HD2  TYR  84          1HD       TYR  84   1.057  -2.097   2.593
  712    HE1  TYR  84          2HE       TYR  84   3.047   1.821   4.889
  713    HE2  TYR  84          1HE       TYR  84   3.384  -1.455   2.140
  714    HH   TYR  84           HH       TYR  84   4.933   1.472   3.479
  715    QB   TYR  84           QB       TYR  84  -1.208  -0.812   3.859
  716    QG   TYR  84           QD       TYR  84   0.896  -0.483   4.013
  717    QZ   TYR  84           QE       TYR  84   3.215   0.183   3.514
  718    QR   TYR  84           QR       TYR  84   2.055  -0.150   3.764
  719    H    ARG  85           H        ARG  85  -1.156  -3.990   4.532
  720    HA   ARG  85           HA       ARG  85   1.709  -4.439   4.487
  721   1HB   ARG  85          1HB       ARG  85   1.088  -5.159   6.806
  722   2HB   ARG  85          2HB       ARG  85   0.014  -6.381   6.141
  723   1HG   ARG  85          1HG       ARG  85   2.990  -6.239   5.521
  724   2HG   ARG  85          2HG       ARG  85   2.319  -7.090   6.924
  725   1HD   ARG  85          1HD       ARG  85   0.762  -8.068   4.885
  726   2HD   ARG  85          2HD       ARG  85   2.301  -7.776   4.050
  727    HE   ARG  85           HE       ARG  85   2.123  -9.368   6.598
  728   1HH1  ARG  85          2HH2      ARG  85   1.988  -9.733   3.141
  729   2HH1  ARG  85          1HH2      ARG  85   3.246 -10.964   3.043
  730   1HH2  ARG  85          2HH1      ARG  85   3.775 -11.151   6.516
  731   2HH2  ARG  85          1HH1      ARG  85   3.934 -11.975   4.979
  732    QB   ARG  85           QB       ARG  85   0.551  -5.770   6.473
  733    QG   ARG  85           QG       ARG  85   2.654  -6.664   6.222
  734    QD   ARG  85           QD       ARG  85   1.531  -7.922   4.467
  735    QH1  ARG  85           QH2      ARG  85   2.617 -10.349   3.092
  736    QH2  ARG  85           QH1      ARG  85   3.854 -11.563   5.748
  737    H    ARG  86           H        ARG  86   2.185  -5.697   2.654
  738    HA   ARG  86           HA       ARG  86   0.165  -6.048   0.751
  739   1HB   ARG  86          1HB       ARG  86   2.839  -7.292   0.784
  740   2HB   ARG  86          2HB       ARG  86   1.646  -7.543  -0.461
  741   1HG   ARG  86          1HG       ARG  86   1.767  -4.717  -0.150
  742   2HG   ARG  86          2HG       ARG  86   3.441  -5.266  -0.135
  743   1HD   ARG  86          1HD       ARG  86   1.303  -5.853  -2.240
  744   2HD   ARG  86          2HD       ARG  86   2.716  -4.837  -2.408
  745    HE   ARG  86           HE       ARG  86   2.819  -7.835  -2.041
  746   1HH1  ARG  86          2HH2      ARG  86   3.770  -5.091  -4.107
  747   2HH1  ARG  86          1HH2      ARG  86   5.018  -6.093  -4.850
  748   1HH2  ARG  86          2HH1      ARG  86   4.289  -8.965  -3.128
  749   2HH2  ARG  86          1HH1      ARG  86   5.382  -8.179  -4.281
  750    QB   ARG  86           QB       ARG  86   2.242  -7.418   0.162
  751    QG   ARG  86           QG       ARG  86   2.604  -4.992  -0.143
  752    QD   ARG  86           QD       ARG  86   2.010  -5.345  -2.324
  753    QH1  ARG  86           QH2      ARG  86   4.394  -5.592  -4.478
  754    QH2  ARG  86           QH1      ARG  86   4.835  -8.572  -3.704
  755    H    VAL  87           H        VAL  87  -0.928  -7.884  -0.047
  756    HA   VAL  87           HA       VAL  87  -0.818 -10.401   1.555
  757    HB   VAL  87           HB       VAL  87  -3.108 -10.776   0.492
  758   1HG1  VAL  87          2HG1      VAL  87  -2.683 -10.317   2.903
  759   2HG1  VAL  87          3HG1      VAL  87  -2.840  -8.577   2.580
  760   3HG1  VAL  87          1HG1      VAL  87  -4.221  -9.674   2.329
  761   1HG2  VAL  87          3HG2      VAL  87  -3.065  -8.932  -1.140
  762   2HG2  VAL  87          1HG2      VAL  87  -4.443  -8.803  -0.042
  763   3HG2  VAL  87          2HG2      VAL  87  -3.064  -7.750   0.183
  764    QG1  VAL  87           QG1      VAL  87  -3.248  -9.523   2.604
  765    QG2  VAL  87           QG2      VAL  87  -3.524  -8.495  -0.333
  766    QQG  VAL  87           QQG      VAL  87  -3.386  -9.009   1.135
  767    H    GLU  88           H        GLU  88   0.058  -8.986  -1.453
  768    HA   GLU  88           HA       GLU  88   1.078 -11.565  -2.263
  769   1HB   GLU  88          1HB       GLU  88   0.060 -11.167  -4.651
  770   2HB   GLU  88          2HB       GLU  88  -0.870 -11.982  -3.417
  771   1HG   GLU  88          1HG       GLU  88  -2.171  -9.947  -2.971
  772   2HG   GLU  88          2HG       GLU  88  -1.167  -9.051  -4.135
  773    QB   GLU  88           QB       GLU  88  -0.405 -11.575  -4.034
  774    QG   GLU  88           QG       GLU  88  -1.669  -9.499  -3.553
   
  No H/Q in entry =         774
  Start of MODEL    8
    1   1HA   GLY   1          1HA       GLY   1  11.721  -8.170  -9.454
    2   2HA   GLY   1          2HA       GLY   1  12.009  -8.160  -7.714
    3    QA   GLY   1           QA       GLY   1  11.865  -8.165  -8.584
    4    H    ASP   2           H        ASP   2  12.411  -6.454 -10.705
    5    HA   ASP   2           HA       ASP   2  14.016  -4.230  -9.858
    6   1HB   ASP   2          1HB       ASP   2  11.832  -4.351 -12.015
    7   2HB   ASP   2          2HB       ASP   2  13.037  -3.083 -11.823
    8    QB   ASP   2           QB       ASP   2  12.434  -3.717 -11.919
    9    H    GLY   3           H        GLY   3  10.562  -5.021  -9.840
   10   1HA   GLY   3          1HA       GLY   3   9.694  -2.341  -9.081
   11   2HA   GLY   3          2HA       GLY   3   8.709  -3.815  -9.290
   12    QA   GLY   3           QA       GLY   3   9.201  -3.078  -9.185
   13    H    TYR   4           H        TYR   4   8.222  -2.124  -7.288
   14    HA   TYR   4           HA       TYR   4   8.855  -3.506  -4.765
   15   1HB   TYR   4          1HB       TYR   4   9.093  -0.984  -3.938
   16   2HB   TYR   4          2HB       TYR   4  10.464  -1.836  -4.590
   17    HD1  TYR   4          1HD       TYR   4   7.824   0.690  -5.418
   18    HD2  TYR   4          2HD       TYR   4  11.475  -1.220  -6.709
   19    HE1  TYR   4          1HE       TYR   4   7.792   2.014  -7.509
   20    HE2  TYR   4          2HE       TYR   4  11.418   0.077  -8.792
   21    HH   TYR   4           HH       TYR   4  10.094   1.381 -10.153
   22    QB   TYR   4           QB       TYR   4   9.778  -1.410  -4.264
   23    QG   TYR   4           QD       TYR   4   9.649  -0.265  -6.064
   24    QZ   TYR   4           QE       TYR   4   9.605   1.045  -8.150
   25    QR   TYR   4           QR       TYR   4   9.627   0.390  -7.107
   26    H    LEU   5           H        LEU   5   7.372  -2.441  -3.116
   27    HA   LEU   5           HA       LEU   5   5.041  -0.999  -4.268
   28   1HB   LEU   5          1HB       LEU   5   4.350  -3.359  -3.921
   29   2HB   LEU   5          2HB       LEU   5   4.834  -3.250  -2.222
   30    HG   LEU   5           HG       LEU   5   2.830  -1.253  -3.306
   31   1HD1  LEU   5          3HD1      LEU   5   2.167  -4.129  -2.546
   32   2HD1  LEU   5          1HD1      LEU   5   0.984  -2.844  -2.841
   33   3HD1  LEU   5          2HD1      LEU   5   2.006  -3.415  -4.163
   34   1HD2  LEU   5          1HD2      LEU   5   3.118  -2.729  -0.642
   35   2HD2  LEU   5          2HD2      LEU   5   3.571  -1.037  -0.939
   36   3HD2  LEU   5          3HD2      LEU   5   1.877  -1.528  -1.017
   37    QB   LEU   5           QB       LEU   5   4.592  -3.305  -3.072
   38    QD1  LEU   5           QD1      LEU   5   1.719  -3.463  -3.183
   39    QD2  LEU   5           QD2      LEU   5   2.855  -1.765  -0.866
   40    QQD  LEU   5           QQD      LEU   5   2.287  -2.614  -2.025
   41    H    ILE   6           H        ILE   6   5.061   0.935  -3.198
   42    HA   ILE   6           HA       ILE   6   5.939   1.095  -0.379
   43    HB   ILE   6           HB       ILE   6   7.292   3.100  -0.919
   44   1HG1  ILE   6          1HG1      ILE   6   6.619   2.409  -3.807
   45   2HG1  ILE   6          2HG1      ILE   6   6.401   3.925  -2.930
   46   1HG2  ILE   6          3HG2      ILE   6   8.333   0.841  -0.671
   47   2HG2  ILE   6          1HG2      ILE   6   8.404   0.731  -2.446
   48   3HG2  ILE   6          2HG2      ILE   6   9.284   2.017  -1.587
   49   1HD1  ILE   6          2HD1      ILE   6   8.933   4.095  -2.825
   50   2HD1  ILE   6          3HD1      ILE   6   8.988   2.688  -3.912
   51   3HD1  ILE   6          1HD1      ILE   6   8.227   4.187  -4.452
   52    QG1  ILE   6           QG1      ILE   6   6.510   3.167  -3.368
   53    QG2  ILE   6           QG2      ILE   6   8.674   1.196  -1.568
   54    QD1  ILE   6           QD1      ILE   6   8.716   3.657  -3.730
   55    H    MET   7           H        MET   7   5.124   3.354   0.504
   56    HA   MET   7           HA       MET   7   3.342   4.608  -1.398
   57   1HB   MET   7          1HB       MET   7   2.843   5.410   1.302
   58   2HB   MET   7          2HB       MET   7   1.813   4.691   0.065
   59   1HG   MET   7          1HG       MET   7   2.343   2.446   0.839
   60   2HG   MET   7          2HG       MET   7   3.414   3.138   2.071
   61   1HE   MET   7          1HE       MET   7  -0.327   2.748   0.896
   62   2HE   MET   7          2HE       MET   7  -1.178   3.622   2.191
   63   3HE   MET   7          3HE       MET   7  -0.219   4.528   1.002
   64    QB   MET   7           QB       MET   7   2.328   5.050   0.683
   65    QG   MET   7           QG       MET   7   2.878   2.792   1.455
   66    QE   MET   7           QE       MET   7  -0.575   3.633   1.363
   67    H    CYS   8           H        CYS   8   3.008   6.815  -0.893
   68    HA   CYS   8           HA       CYS   8   5.573   8.267  -0.768
   69   1HB   CYS   8          1HB       CYS   8   3.790   7.810  -3.190
   70   2HB   CYS   8          2HB       CYS   8   5.059   9.021  -3.144
   71    QB   CYS   8           QB       CYS   8   4.424   8.416  -3.167
   72    H    LYS   9           H        LYS   9   5.322  10.484  -1.010
   73    HA   LYS   9           HA       LYS   9   3.013  11.724   0.155
   74   1HB   LYS   9          1HB       LYS   9   5.441  12.701  -1.367
   75   2HB   LYS   9          2HB       LYS   9   4.214  13.823  -0.744
   76   1HG   LYS   9          1HG       LYS   9   4.638  13.307   1.488
   77   2HG   LYS   9          2HG       LYS   9   5.385  11.753   1.135
   78   1HD   LYS   9          1HD       LYS   9   6.985  13.447   1.890
   79   2HD   LYS   9          2HD       LYS   9   7.367  12.718   0.327
   80   1HE   LYS   9          1HE       LYS   9   6.611  14.726  -0.877
   81   2HE   LYS   9          2HE       LYS   9   6.006  15.436   0.629
   82   1HZ   LYS   9          1HZ       LYS   9   8.852  14.803   0.132
   83   2HZ   LYS   9          2HZ       LYS   9   8.173  16.297  -0.081
   84   3HZ   LYS   9          3HZ       LYS   9   8.228  15.606   1.416
   85    QB   LYS   9           QB       LYS   9   4.828  13.262  -1.055
   86    QG   LYS   9           QG       LYS   9   5.012  12.530   1.312
   87    QD   LYS   9           QD       LYS   9   7.176  13.082   1.109
   88    QE   LYS   9           QE       LYS   9   6.308  15.081  -0.124
   89    QZ   LYS   9           QZ       LYS   9   8.418  15.569   0.489
   90    H    ASN  10           H        ASN  10   3.920  11.043  -3.221
   91    HA   ASN  10           HA       ASN  10   1.376  12.147  -4.244
   92   1HB   ASN  10          1HB       ASN  10   2.604  13.674  -5.747
   93   2HB   ASN  10          2HB       ASN  10   2.856  14.111  -4.067
   94   1HD2  ASN  10          2HD2      ASN  10   6.056  13.095  -6.274
   95   2HD2  ASN  10          1HD2      ASN  10   4.541  13.674  -6.967
   96    QB   ASN  10           QB       ASN  10   2.730  13.893  -4.907
   97    QD2  ASN  10           QD2      ASN  10   5.298  13.385  -6.621
   98    H    CYS  11           H        CYS  11   1.569  12.097  -6.693
   99    HA   CYS  11           HA       CYS  11   1.960   9.343  -7.465
  100   1HB   CYS  11          1HB       CYS  11   0.088  10.951  -7.995
  101   2HB   CYS  11          2HB       CYS  11   1.156  11.744  -9.146
  102    QB   CYS  11           QB       CYS  11   0.622  11.347  -8.571
  103    H    ASP  12           H        ASP  12   4.359  11.308  -7.074
  104    HA   ASP  12           HA       ASP  12   5.887  10.154  -9.342
  105   1HB   ASP  12          1HB       ASP  12   5.280  12.539  -9.748
  106   2HB   ASP  12          2HB       ASP  12   6.212  12.985  -8.318
  107    QB   ASP  12           QB       ASP  12   5.746  12.762  -9.033
  108    HA   PRO  13           HA       PRO  13   8.229   9.258  -5.488
  109   1HB   PRO  13          1HB       PRO  13  10.023   7.435  -6.447
  110   2HB   PRO  13          2HB       PRO  13   8.309   7.004  -6.208
  111   1HG   PRO  13          1HG       PRO  13   9.672   7.913  -8.776
  112   2HG   PRO  13          2HG       PRO  13   8.609   6.501  -8.545
  113   1HD   PRO  13          1HD       PRO  13   7.648   8.832  -9.534
  114   2HD   PRO  13          2HD       PRO  13   6.684   7.863  -8.373
  115    QB   PRO  13           QB       PRO  13   9.166   7.220  -6.328
  116    QG   PRO  13           QG       PRO  13   9.141   7.207  -8.661
  117    QD   PRO  13           QD       PRO  13   7.166   8.348  -8.954
  118    H    ASN  14           H        ASN  14   9.451  10.462  -8.577
  119    HA   ASN  14           HA       ASN  14  12.224  10.621  -7.859
  120   1HB   ASN  14          1HB       ASN  14  11.093  10.706 -10.189
  121   2HB   ASN  14          2HB       ASN  14  10.757  12.406  -9.859
  122   1HD2  ASN  14          2HD2      ASN  14  14.057  11.862 -11.699
  123   2HD2  ASN  14          1HD2      ASN  14  12.463  11.167 -11.892
  124    QB   ASN  14           QB       ASN  14  10.925  11.556 -10.024
  125    QD2  ASN  14           QD2      ASN  14  13.260  11.514 -11.796
  126    H    THR  15           H        THR  15   9.414  12.772  -7.785
  127    HA   THR  15           HA       THR  15  10.841  14.720  -6.035
  128    HB   THR  15           HB       THR  15   9.030  16.258  -6.806
  129    HG1  THR  15          1HG       THR  15   8.306  13.979  -8.396
  130   1HG2  THR  15          3HG2      THR  15  11.149  16.036  -8.157
  131   2HG2  THR  15          1HG2      THR  15  10.339  14.849  -9.192
  132   3HG2  THR  15          2HG2      THR  15   9.740  16.511  -9.118
  133    QG2  THR  15           QG2      THR  15  10.409  15.799  -8.822
  134    H    GLY  16           H        GLY  16   9.180  12.058  -5.537
  135   1HA   GLY  16          1HA       GLY  16   7.693  13.104  -3.186
  136   2HA   GLY  16          2HA       GLY  16   7.248  11.631  -4.028
  137    QA   GLY  16           QA       GLY  16   7.470  12.367  -3.607
  138    H    SER  17           H        SER  17   8.651  12.714  -1.386
  139    HA   SER  17           HA       SER  17  10.743  10.726  -0.967
  140   1HB   SER  17          1HB       SER  17   9.342  11.848   1.400
  141   2HB   SER  17          2HB       SER  17  11.062  11.797   0.997
  142    HG   SER  17           HG       SER  17  10.656  13.505  -0.535
  143    QB   SER  17           QB       SER  17  10.202  11.823   1.199
  144    H    CYS  18           H        CYS  18  10.259   8.522  -0.726
  145    HA   CYS  18           HA       CYS  18   7.448   7.783  -0.080
  146   1HB   CYS  18          1HB       CYS  18   9.572   6.642  -1.912
  147   2HB   CYS  18          2HB       CYS  18   8.053   5.841  -1.600
  148    QB   CYS  18           QB       CYS  18   8.813   6.242  -1.756
  149    H    ASP  19           H        ASP  19   7.200   5.598   0.967
  150    HA   ASP  19           HA       ASP  19   9.450   5.081   2.783
  151   1HB   ASP  19          1HB       ASP  19   8.071   4.178   4.256
  152   2HB   ASP  19          2HB       ASP  19   7.299   5.659   3.692
  153    QB   ASP  19           QB       ASP  19   7.685   4.919   3.974
  154    H    TRP  20           H        TRP  20  10.720   4.112   1.615
  155    HA   TRP  20           HA       TRP  20  10.289   1.447   0.388
  156   1HB   TRP  20          1HB       TRP  20  12.847   2.982   0.955
  157   2HB   TRP  20          2HB       TRP  20  12.688   1.543  -0.046
  158    HD1  TRP  20           HD       TRP  20  11.819   5.286  -0.073
  159    HE1  TRP  20          1HE       TRP  20  11.577   6.087  -2.461
  160    HE3  TRP  20          3HE       TRP  20  11.987   0.759  -2.420
  161    HZ2  TRP  20          2HZ       TRP  20  11.364   4.903  -5.115
  162    HZ3  TRP  20          3HZ       TRP  20  11.967   0.639  -4.884
  163    HH2  TRP  20           HH       TRP  20  11.551   2.685  -6.247
  164    QB   TRP  20           QB       TRP  20  12.767   2.262   0.454
  165    H    LYS  21           H        LYS  21   9.313   1.428   2.835
  166    HA   LYS  21           HA       LYS  21  11.051   0.481   4.980
  167   1HB   LYS  21          1HB       LYS  21   8.446   1.440   4.726
  168   2HB   LYS  21          2HB       LYS  21   8.163  -0.264   4.868
  169   1HG   LYS  21          1HG       LYS  21   8.220   0.272   7.124
  170   2HG   LYS  21          2HG       LYS  21   9.935  -0.054   6.905
  171   1HD   LYS  21          1HD       LYS  21   9.996   2.050   7.895
  172   2HD   LYS  21          2HD       LYS  21  10.087   2.472   6.183
  173   1HE   LYS  21          1HE       LYS  21   7.469   2.630   6.229
  174   2HE   LYS  21          2HE       LYS  21   7.598   2.519   7.978
  175   1HZ   LYS  21          2HZ       LYS  21   8.931   4.597   6.355
  176   2HZ   LYS  21          3HZ       LYS  21   7.422   4.759   7.000
  177   3HZ   LYS  21          1HZ       LYS  21   8.751   4.615   7.976
  178    QB   LYS  21           QB       LYS  21   8.305   0.588   4.797
  179    QG   LYS  21           QG       LYS  21   9.078   0.109   7.015
  180    QD   LYS  21           QD       LYS  21  10.042   2.261   7.039
  181    QE   LYS  21           QE       LYS  21   7.534   2.575   7.103
  182    QZ   LYS  21           QZ       LYS  21   8.368   4.657   7.111
  183    H    GLN  22           H        GLN  22  10.143  -1.878   5.817
  184    HA   GLN  22           HA       GLN  22  10.332  -3.840   3.604
  185   1HB   GLN  22          1HB       GLN  22  10.989  -4.442   5.981
  186   2HB   GLN  22          2HB       GLN  22   9.275  -4.141   6.382
  187   1HG   GLN  22          1HG       GLN  22   9.407  -6.423   6.293
  188   2HG   GLN  22          2HG       GLN  22   8.623  -5.994   4.786
  189   1HE2  GLN  22          2HE2      GLN  22  11.383  -7.233   2.789
  190   2HE2  GLN  22          1HE2      GLN  22  10.166  -5.988   2.743
  191    QB   GLN  22           QB       GLN  22  10.132  -4.291   6.182
  192    QG   GLN  22           QG       GLN  22   9.015  -6.209   5.539
  193    QE2  GLN  22           QE2      GLN  22  10.775  -6.611   2.766
  194    H    ASN  23           H        ASN  23   8.470  -4.600   2.711
  195    HA   ASN  23           HA       ASN  23   5.940  -3.007   3.171
  196   1HB   ASN  23          1HB       ASN  23   6.951  -4.072   0.525
  197   2HB   ASN  23          2HB       ASN  23   5.637  -2.931   0.802
  198   1HD2  ASN  23          2HD2      ASN  23   7.835  -0.107   1.348
  199   2HD2  ASN  23          1HD2      ASN  23   6.310  -0.781   1.873
  200    QB   ASN  23           QB       ASN  23   6.294  -3.501   0.663
  201    QD2  ASN  23           QD2      ASN  23   7.073  -0.444   1.610
  202    H    TRP  24           H        TRP  24   7.303  -6.109   2.671
  203    HA   TRP  24           HA       TRP  24   5.364  -7.749   1.772
  204   1HB   TRP  24          1HB       TRP  24   7.940  -7.911   3.105
  205   2HB   TRP  24          2HB       TRP  24   6.985  -9.255   3.588
  206    HD1  TRP  24           HD       TRP  24   9.558  -9.076   1.641
  207    HE1  TRP  24          1HE       TRP  24   9.520 -10.466  -0.509
  208    HE3  TRP  24          3HE       TRP  24   4.477  -9.669   1.140
  209    HZ2  TRP  24          2HZ       TRP  24   7.532 -11.527  -2.311
  210    HZ3  TRP  24          3HZ       TRP  24   3.563 -10.755  -0.855
  211    HH2  TRP  24           HH       TRP  24   5.062 -11.730  -2.577
  212    QB   TRP  24           QB       TRP  24   7.463  -8.583   3.346
  213    H    ASN  25           H        ASN  25   5.155  -9.759   3.522
  214    HA   ASN  25           HA       ASN  25   2.944  -9.719   5.202
  215   1HB   ASN  25          1HB       ASN  25   5.479 -11.392   5.210
  216   2HB   ASN  25          2HB       ASN  25   4.027 -11.759   6.154
  217   1HD2  ASN  25          2HD2      ASN  25   4.124 -13.598   2.774
  218   2HD2  ASN  25          1HD2      ASN  25   5.354 -13.420   4.005
  219    QB   ASN  25           QB       ASN  25   4.753 -11.575   5.682
  220    QD2  ASN  25           QD2      ASN  25   4.739 -13.509   3.390
  221    H    THR  26           H        THR  26   3.662  -7.522   5.910
  222    HA   THR  26           HA       THR  26   4.719  -7.592   8.687
  223    HB   THR  26           HB       THR  26   6.670  -6.948   7.499
  224    HG1  THR  26          1HG       THR  26   6.055  -5.652   9.395
  225   1HG2  THR  26          1HG2      THR  26   4.931  -5.026   5.957
  226   2HG2  THR  26          2HG2      THR  26   6.669  -4.730   6.182
  227   3HG2  THR  26          3HG2      THR  26   6.137  -6.209   5.391
  228    QG2  THR  26           QG2      THR  26   5.912  -5.322   5.843
  229    H    CYS  27           H        CYS  27   4.310  -5.161   9.651
  230    HA   CYS  27           HA       CYS  27   1.533  -4.536   9.117
  231   1HB   CYS  27          1HB       CYS  27   1.555  -6.407  10.694
  232   2HB   CYS  27          2HB       CYS  27   2.787  -5.608  11.656
  233    QB   CYS  27           QB       CYS  27   2.171  -6.007  11.175
  234    H    VAL  28           H        VAL  28   2.767  -2.729   8.223
  235    HA   VAL  28           HA       VAL  28   4.634  -1.271   9.911
  236    HB   VAL  28           HB       VAL  28   3.542  -0.684   7.116
  237   1HG1  VAL  28          1HG1      VAL  28   4.738   1.259   8.105
  238   2HG1  VAL  28          2HG1      VAL  28   6.144   0.216   8.417
  239   3HG1  VAL  28          3HG1      VAL  28   5.627   0.554   6.754
  240   1HG2  VAL  28          3HG2      VAL  28   6.006  -2.286   7.937
  241   2HG2  VAL  28          1HG2      VAL  28   4.557  -2.927   7.131
  242   3HG2  VAL  28          2HG2      VAL  28   5.596  -1.785   6.283
  243    QG1  VAL  28           QG1      VAL  28   5.503   0.676   7.759
  244    QG2  VAL  28           QG2      VAL  28   5.386  -2.332   7.117
  245    QQG  VAL  28           QQG      VAL  28   5.445  -0.828   7.438
  246    H    GLY  29           H        GLY  29   4.343   0.951  10.681
  247   1HA   GLY  29          1HA       GLY  29   1.598   1.759  11.064
  248   2HA   GLY  29          2HA       GLY  29   3.008   2.545  11.744
  249    QA   GLY  29           QA       GLY  29   2.303   2.152  11.404
  250    H    ILE  30           H        ILE  30   0.696   3.457   9.931
  251    HA   ILE  30           HA       ILE  30   2.318   4.859   7.823
  252    HB   ILE  30           HB       ILE  30  -0.250   3.258   7.554
  253   1HG1  ILE  30          1HG1      ILE  30   1.774   1.847   7.655
  254   2HG1  ILE  30          2HG1      ILE  30   0.965   1.779   6.121
  255   1HG2  ILE  30          2HG2      ILE  30   1.108   4.936   5.424
  256   2HG2  ILE  30          3HG2      ILE  30  -0.093   3.664   5.123
  257   3HG2  ILE  30          1HG2      ILE  30  -0.559   5.071   6.050
  258   1HD1  ILE  30          1HD1      ILE  30   3.503   3.390   6.694
  259   2HD1  ILE  30          2HD1      ILE  30   3.415   1.837   5.882
  260   3HD1  ILE  30          3HD1      ILE  30   2.700   3.269   5.125
  261    QG1  ILE  30           QG1      ILE  30   1.369   1.813   6.888
  262    QG2  ILE  30           QG2      ILE  30   0.152   4.557   5.532
  263    QD1  ILE  30           QD1      ILE  30   3.206   2.832   5.901
  264    H    GLY  31           H        GLY  31   1.257   6.635   6.772
  265   1HA   GLY  31          1HA       GLY  31  -0.850   8.028   6.855
  266   2HA   GLY  31          2HA       GLY  31  -0.487   8.208   8.575
  267    QA   GLY  31           QA       GLY  31  -0.668   8.118   7.715
  268    H    ALA  32           H        ALA  32   0.017  10.336   8.494
  269    HA   ALA  32           HA       ALA  32   1.010  12.294   8.016
  270   1HB   ALA  32          1HB       ALA  32   2.430  11.081   9.700
  271   2HB   ALA  32          2HB       ALA  32   3.463  10.514   8.366
  272   3HB   ALA  32          3HB       ALA  32   3.373  12.244   8.745
  273    QB   ALA  32           QB       ALA  32   3.089  11.279   8.937
  274    H    ASN  33           H        ASN  33   0.433  13.000   6.191
  275    HA   ASN  33           HA       ASN  33   0.541  13.821   4.166
  276   1HB   ASN  33          1HB       ASN  33   2.030  15.410   3.926
  277   2HB   ASN  33          2HB       ASN  33   2.522  14.953   5.549
  278   1HD2  ASN  33          2HD2      ASN  33   5.627  13.390   4.260
  279   2HD2  ASN  33          1HD2      ASN  33   4.239  12.773   5.141
  280    QB   ASN  33           QB       ASN  33   2.276  15.182   4.738
  281    QD2  ASN  33           QD2      ASN  33   4.933  13.082   4.701
  282    H    VAL  34           H        VAL  34   1.176  10.914   4.480
  283    HA   VAL  34           HA       VAL  34   2.014  10.398   1.624
  284    HB   VAL  34           HB       VAL  34   2.338   8.844   4.187
  285   1HG1  VAL  34          1HG1      VAL  34   2.547   7.715   1.397
  286   2HG1  VAL  34          2HG1      VAL  34   3.180   6.959   2.878
  287   3HG1  VAL  34          3HG1      VAL  34   1.439   7.186   2.681
  288   1HG2  VAL  34          2HG2      VAL  34   4.135  10.437   3.486
  289   2HG2  VAL  34          3HG2      VAL  34   4.676   8.748   3.475
  290   3HG2  VAL  34          1HG2      VAL  34   4.279   9.558   1.952
  291    QG1  VAL  34           QG1      VAL  34   2.389   7.286   2.319
  292    QG2  VAL  34           QG2      VAL  34   4.363   9.581   2.971
  293    QQG  VAL  34           QQG      VAL  34   3.376   8.434   2.645
  294    H    HIS  35           H        HIS  35   0.363   9.917   0.326
  295    HA   HIS  35           HA       HIS  35  -1.799   8.162   1.219
  296   1HB   HIS  35          1HB       HIS  35  -3.626   9.583   0.618
  297   2HB   HIS  35          2HB       HIS  35  -2.697  10.382   1.887
  298    HD1  HIS  35          1HD       HIS  35  -4.703  11.418  -0.679
  299    HD2  HIS  35          2HD       HIS  35  -0.659  12.162   0.246
  300    HE1  HIS  35          1HE       HIS  35  -4.104  13.628  -1.776
  301    QB   HIS  35           QB       HIS  35  -3.161   9.982   1.253
  302    H    TRP  36           H        TRP  36   0.492   8.207  -0.742
  303    HA   TRP  36           HA       TRP  36  -1.181   7.239  -3.036
  304   1HB   TRP  36          1HB       TRP  36   1.438   8.743  -3.095
  305   2HB   TRP  36          2HB       TRP  36   0.692   7.960  -4.476
  306    HD1  TRP  36           HD       TRP  36  -0.121  10.827  -2.011
  307    HE1  TRP  36          1HE       TRP  36  -1.813  12.394  -3.061
  308    HE3  TRP  36          3HE       TRP  36  -0.859   8.276  -6.341
  309    HZ2  TRP  36          2HZ       TRP  36  -3.378  12.506  -5.541
  310    HZ3  TRP  36          3HZ       TRP  36  -2.569   9.054  -7.981
  311    HH2  TRP  36           HH       TRP  36  -3.726  11.230  -7.656
  312    QB   TRP  36           QB       TRP  36   1.065   8.352  -3.785
  313    H    MET  37           H        MET  37  -0.890   5.151  -3.141
  314    HA   MET  37           HA       MET  37   1.653   3.901  -2.227
  315   1HB   MET  37          1HB       MET  37  -0.270   2.714  -1.513
  316   2HB   MET  37          2HB       MET  37  -0.956   2.671  -3.141
  317   1HG   MET  37          1HG       MET  37   0.972   1.270  -3.880
  318   2HG   MET  37          2HG       MET  37   1.562   1.249  -2.213
  319   1HE   MET  37          3HE       MET  37   0.240   0.090  -0.222
  320   2HE   MET  37          1HE       MET  37  -1.297   0.908  -0.604
  321   3HE   MET  37          2HE       MET  37  -1.250  -0.857  -0.447
  322    QB   MET  37           QB       MET  37  -0.613   2.693  -2.327
  323    QG   MET  37           QG       MET  37   1.267   1.260  -3.047
  324    QE   MET  37           QE       MET  37  -0.769   0.047  -0.425
  325    H    VAL  38           H        VAL  38   3.037   2.985  -3.878
  326    HA   VAL  38           HA       VAL  38   2.289   3.489  -6.695
  327    HB   VAL  38           HB       VAL  38   4.937   4.420  -5.508
  328   1HG1  VAL  38          3HG1      VAL  38   4.777   3.821  -7.970
  329   2HG1  VAL  38          1HG1      VAL  38   3.544   5.081  -8.139
  330   3HG1  VAL  38          2HG1      VAL  38   5.194   5.515  -7.638
  331   1HG2  VAL  38          3HG2      VAL  38   2.492   6.134  -6.177
  332   2HG2  VAL  38          1HG2      VAL  38   3.223   5.930  -4.569
  333   3HG2  VAL  38          2HG2      VAL  38   4.115   6.756  -5.850
  334    QG1  VAL  38           QG1      VAL  38   4.505   4.806  -7.915
  335    QG2  VAL  38           QG2      VAL  38   3.277   6.273  -5.532
  336    QQG  VAL  38           QQG      VAL  38   3.891   5.540  -6.724
  337    H    THR  39           H        THR  39   3.076   1.789  -7.975
  338    HA   THR  39           HA       THR  39   4.991  -0.026  -6.662
  339    HB   THR  39           HB       THR  39   2.683  -0.516  -5.758
  340    HG1  THR  39          1HG       THR  39   2.969  -2.715  -5.887
  341   1HG2  THR  39          3HG2      THR  39   1.443  -0.286  -7.935
  342   2HG2  THR  39          1HG2      THR  39   2.269  -1.761  -8.490
  343   3HG2  THR  39          2HG2      THR  39   1.179  -1.843  -7.109
  344    QG2  THR  39           QG2      THR  39   1.631  -1.297  -7.845
  345    H    GLY  40           H        GLY  40   5.827  -1.638  -7.732
  346   1HA   GLY  40          1HA       GLY  40   6.553  -2.980  -9.374
  347   2HA   GLY  40          2HA       GLY  40   5.401  -2.337 -10.540
  348    QA   GLY  40           QA       GLY  40   5.977  -2.659  -9.957
  349    H    GLY  41           H        GLY  41   7.868  -3.036 -11.131
  350   1HA   GLY  41          1HA       GLY  41   9.101  -0.485 -12.082
  351   2HA   GLY  41          2HA       GLY  41  10.126  -1.818 -11.497
  352    QA   GLY  41           QA       GLY  41   9.613  -1.151 -11.789
  353    H    SER  42           H        SER  42   9.311  -4.008 -12.327
  354    HA   SER  42           HA       SER  42   7.641  -4.473 -14.411
  355   1HB   SER  42          1HB       SER  42   9.286  -3.229 -15.726
  356   2HB   SER  42          2HB       SER  42  10.513  -4.419 -15.342
  357    HG   SER  42           HG       SER  42   9.466  -4.774 -17.375
  358    QB   SER  42           QB       SER  42   9.900  -3.824 -15.534
  359    H    THR  43           H        THR  43  10.460  -6.316 -15.075
  360    HA   THR  43           HA       THR  43  11.003  -8.423 -14.718
  361    HB   THR  43           HB       THR  43  10.159  -8.806 -11.934
  362    HG1  THR  43          1HG       THR  43  11.854  -6.613 -12.484
  363   1HG2  THR  43          1HG2      THR  43  11.989 -10.053 -13.072
  364   2HG2  THR  43          2HG2      THR  43  12.913  -8.548 -13.209
  365   3HG2  THR  43          3HG2      THR  43  12.547  -9.234 -11.610
  366    QG2  THR  43           QG2      THR  43  12.483  -9.278 -12.630
  367    H    ASP  44           H        ASP  44   8.471  -7.744 -15.835
  368    HA   ASP  44           HA       ASP  44   6.304  -7.734 -15.436
  369   1HB   ASP  44          1HB       ASP  44   6.924 -10.430 -16.634
  370   2HB   ASP  44          2HB       ASP  44   5.512  -9.352 -16.784
  371    QB   ASP  44           QB       ASP  44   6.218  -9.891 -16.709
  372    H    GLY  45           H        GLY  45   6.650  -7.681 -13.072
  373   1HA   GLY  45          1HA       GLY  45   6.243  -9.887 -11.363
  374   2HA   GLY  45          2HA       GLY  45   5.890  -8.186 -10.990
  375    QA   GLY  45           QA       GLY  45   6.067  -9.037 -11.177
  376    H    LYS  46           H        LYS  46   4.088  -7.668 -12.954
  377    HA   LYS  46           HA       LYS  46   1.900  -7.446 -13.212
  378   1HB   LYS  46          1HB       LYS  46   1.469 -10.155 -12.000
  379   2HB   LYS  46          2HB       LYS  46   0.347  -9.195 -12.972
  380   1HG   LYS  46          1HG       LYS  46   1.633  -9.342 -14.936
  381   2HG   LYS  46          2HG       LYS  46   3.034 -10.045 -14.178
  382   1HD   LYS  46          1HD       LYS  46   0.421 -11.557 -14.101
  383   2HD   LYS  46          2HD       LYS  46   1.451 -11.582 -15.513
  384   1HE   LYS  46          1HE       LYS  46   2.027 -13.501 -14.160
  385   2HE   LYS  46          2HE       LYS  46   3.382 -12.391 -14.201
  386   1HZ   LYS  46          1HZ       LYS  46   2.835 -11.645 -11.985
  387   2HZ   LYS  46          2HZ       LYS  46   1.571 -12.714 -11.898
  388   3HZ   LYS  46          3HZ       LYS  46   3.079 -13.256 -12.054
  389    QB   LYS  46           QB       LYS  46   0.908  -9.675 -12.486
  390    QG   LYS  46           QG       LYS  46   2.334  -9.694 -14.557
  391    QD   LYS  46           QD       LYS  46   0.936 -11.570 -14.807
  392    QE   LYS  46           QE       LYS  46   2.704 -12.946 -14.180
  393    QZ   LYS  46           QZ       LYS  46   2.495 -12.538 -11.979
  394    H    GLN  47           H        GLN  47  -0.212  -7.759 -11.468
  395    HA   GLN  47           HA       GLN  47   0.509  -5.586  -9.927
  396   1HB   GLN  47          1HB       GLN  47  -1.736  -5.646  -8.957
  397   2HB   GLN  47          2HB       GLN  47  -1.817  -6.010 -10.693
  398   1HG   GLN  47          1HG       GLN  47  -2.083  -8.386 -10.229
  399   2HG   GLN  47          2HG       GLN  47  -1.978  -8.089  -8.484
  400   1HE2  GLN  47          2HE2      GLN  47  -5.609  -8.243  -9.325
  401   2HE2  GLN  47          1HE2      GLN  47  -4.244  -9.335  -9.476
  402    QB   GLN  47           QB       GLN  47  -1.776  -5.828  -9.825
  403    QG   GLN  47           QG       GLN  47  -2.031  -8.237  -9.357
  404    QE2  GLN  47           QE2      GLN  47  -4.927  -8.789  -9.400
  405    H    GLY  48           H        GLY  48   0.651  -5.047  -7.808
  406   1HA   GLY  48          1HA       GLY  48   1.418  -7.247  -5.934
  407   2HA   GLY  48          2HA       GLY  48   1.984  -5.566  -5.807
  408    QA   GLY  48           QA       GLY  48   1.701  -6.407  -5.870
  409    H    CYS  49           H        CYS  49   0.111  -7.287  -3.960
  410    HA   CYS  49           HA       CYS  49  -1.943  -5.167  -3.777
  411   1HB   CYS  49          1HB       CYS  49  -2.434  -8.162  -3.439
  412   2HB   CYS  49          2HB       CYS  49  -3.589  -6.881  -3.251
  413    QB   CYS  49           QB       CYS  49  -3.011  -7.521  -3.345
  414    H    ALA  50           H        ALA  50  -2.827  -4.956  -1.712
  415    HA   ALA  50           HA       ALA  50  -1.193  -6.108   0.465
  416   1HB   ALA  50          2HB       ALA  50  -1.841  -3.156   0.042
  417   2HB   ALA  50          3HB       ALA  50  -1.036  -3.830   1.471
  418   3HB   ALA  50          1HB       ALA  50  -0.223  -3.878  -0.107
  419    QB   ALA  50           QB       ALA  50  -1.033  -3.622   0.469
  420    H    THR  51           H        THR  51  -2.222  -6.237   2.409
  421    HA   THR  51           HA       THR  51  -5.164  -5.659   2.464
  422    HB   THR  51           HB       THR  51  -3.362  -6.840   4.629
  423    HG1  THR  51          1HG       THR  51  -4.785  -8.013   2.545
  424   1HG2  THR  51          1HG2      THR  51  -5.386  -5.639   5.439
  425   2HG2  THR  51          2HG2      THR  51  -6.398  -6.622   4.363
  426   3HG2  THR  51          3HG2      THR  51  -5.531  -7.364   5.721
  427    QG2  THR  51           QG2      THR  51  -5.772  -6.541   5.174
  428    H    ILE  52           H        ILE  52  -5.405  -3.482   2.736
  429    HA   ILE  52           HA       ILE  52  -3.491  -1.944   4.398
  430    HB   ILE  52           HB       ILE  52  -5.898  -1.202   2.688
  431   1HG1  ILE  52          1HG1      ILE  52  -2.901  -0.686   2.466
  432   2HG1  ILE  52          2HG1      ILE  52  -3.900  -1.691   1.412
  433   1HG2  ILE  52          3HG2      ILE  52  -4.247   0.528   4.538
  434   2HG2  ILE  52          1HG2      ILE  52  -5.335   1.146   3.278
  435   3HG2  ILE  52          2HG2      ILE  52  -5.996   0.211   4.612
  436   1HD1  ILE  52          3HD1      ILE  52  -5.191   0.446   0.819
  437   2HD1  ILE  52          1HD1      ILE  52  -3.877   1.337   1.623
  438   3HD1  ILE  52          2HD1      ILE  52  -3.522   0.319   0.228
  439    QG1  ILE  52           QG1      ILE  52  -3.400  -1.188   1.939
  440    QG2  ILE  52           QG2      ILE  52  -5.193   0.629   4.143
  441    QD1  ILE  52           QD1      ILE  52  -4.197   0.701   0.890
  442    H    TRP  53           H        TRP  53  -4.290  -0.963   6.393
  443    HA   TRP  53           HA       TRP  53  -6.881  -1.983   7.391
  444   1HB   TRP  53          1HB       TRP  53  -4.258  -1.980   8.826
  445   2HB   TRP  53          2HB       TRP  53  -5.766  -1.811   9.712
  446    HD1  TRP  53           HD       TRP  53  -7.307  -3.974  10.037
  447    HE1  TRP  53          1HE       TRP  53  -6.722  -6.459   9.939
  448    HE3  TRP  53          3HE       TRP  53  -3.075  -3.668   7.219
  449    HZ2  TRP  53          2HZ       TRP  53  -4.782  -8.130   8.619
  450    HZ3  TRP  53          3HZ       TRP  53  -1.917  -5.691   6.503
  451    HH2  TRP  53           HH       TRP  53  -2.728  -7.955   7.205
  452    QB   TRP  53           QB       TRP  53  -5.012  -1.895   9.269
  453    H    GLU  54           H        GLU  54  -7.981  -0.651   8.726
  454    HA   GLU  54           HA       GLU  54  -7.455   2.206   8.659
  455   1HB   GLU  54          1HB       GLU  54  -9.774   1.174   8.899
  456   2HB   GLU  54          2HB       GLU  54  -9.164   0.197  10.214
  457   1HG   GLU  54          1HG       GLU  54  -8.793   2.491  11.434
  458   2HG   GLU  54          2HG       GLU  54  -9.998   3.079  10.269
  459    QB   GLU  54           QB       GLU  54  -9.469   0.685   9.556
  460    QG   GLU  54           QG       GLU  54  -9.395   2.785  10.851
  461    H    GLY  55           H        GLY  55  -7.279  -0.438  11.088
  462   1HA   GLY  55          1HA       GLY  55  -6.690   1.405  13.097
  463   2HA   GLY  55          2HA       GLY  55  -6.698  -0.314  13.296
  464    QA   GLY  55           QA       GLY  55  -6.694   0.546  13.196
  465    H    SER  56           H        SER  56  -4.980   1.634  14.453
  466    HA   SER  56           HA       SER  56  -2.517   1.827  12.960
  467   1HB   SER  56          1HB       SER  56  -2.723   2.658  15.843
  468   2HB   SER  56          2HB       SER  56  -2.033   3.516  14.466
  469    HG   SER  56           HG       SER  56  -4.764   3.192  15.249
  470    QB   SER  56           QB       SER  56  -2.378   3.087  15.154
  471    H    GLY  57           H        GLY  57  -2.389  -0.543  12.787
  472   1HA   GLY  57          1HA       GLY  57  -0.136  -1.655  13.621
  473   2HA   GLY  57          2HA       GLY  57  -1.189  -1.892  15.042
  474    QA   GLY  57           QA       GLY  57  -0.662  -1.774  14.331
  475    H    CYS  58           H        CYS  58  -1.991  -1.978  11.576
  476    HA   CYS  58           HA       CYS  58  -3.351  -3.282  10.449
  477   1HB   CYS  58          1HB       CYS  58  -2.691  -5.603  10.102
  478   2HB   CYS  58          2HB       CYS  58  -1.370  -4.456   9.894
  479    QB   CYS  58           QB       CYS  58  -2.030  -5.029   9.998
  480    H    VAL  59           H        VAL  59  -4.758  -2.482  12.463
  481    HA   VAL  59           HA       VAL  59  -6.368  -4.772  13.343
  482    HB   VAL  59           HB       VAL  59  -6.752  -3.359  15.431
  483   1HG1  VAL  59          1HG1      VAL  59  -4.034  -4.672  15.023
  484   2HG1  VAL  59          2HG1      VAL  59  -4.785  -4.330  16.586
  485   3HG1  VAL  59          3HG1      VAL  59  -5.533  -5.490  15.473
  486   1HG2  VAL  59          2HG2      VAL  59  -4.154  -2.020  14.585
  487   2HG2  VAL  59          3HG2      VAL  59  -5.721  -1.258  14.943
  488   3HG2  VAL  59          1HG2      VAL  59  -4.800  -2.022  16.221
  489    QG1  VAL  59           QG1      VAL  59  -4.784  -4.831  15.694
  490    QG2  VAL  59           QG2      VAL  59  -4.892  -1.767  15.250
  491    QQG  VAL  59           QQG      VAL  59  -4.838  -3.299  15.472
  492    H    GLY  60           H        GLY  60  -8.612  -3.779  13.999
  493   1HA   GLY  60          1HA       GLY  60 -10.371  -2.242  13.533
  494   2HA   GLY  60          2HA       GLY  60  -9.250  -1.254  12.598
  495    QA   GLY  60           QA       GLY  60  -9.810  -1.748  13.066
  496    H    ARG  61           H        ARG  61 -10.632  -1.178  10.773
  497    HA   ARG  61           HA       ARG  61 -11.558  -3.724   9.493
  498   1HB   ARG  61          1HB       ARG  61 -11.927  -0.754   8.965
  499   2HB   ARG  61          2HB       ARG  61 -12.231  -1.947   7.697
  500   1HG   ARG  61          1HG       ARG  61 -13.940  -3.042   8.919
  501   2HG   ARG  61          2HG       ARG  61 -13.569  -2.156  10.412
  502   1HD   ARG  61          1HD       ARG  61 -14.314  -0.085   9.513
  503   2HD   ARG  61          2HD       ARG  61 -14.273  -0.678   7.857
  504    HE   ARG  61           HE       ARG  61 -16.183  -2.216   8.483
  505   1HH1  ARG  61          2HH2      ARG  61 -15.996   0.596  10.576
  506   2HH1  ARG  61          1HH2      ARG  61 -17.438   1.368   9.883
  507   1HH2  ARG  61          2HH1      ARG  61 -18.204  -1.229   7.678
  508   2HH2  ARG  61          1HH1      ARG  61 -18.697   0.302   8.419
  509    QB   ARG  61           QB       ARG  61 -12.079  -1.350   8.331
  510    QG   ARG  61           QG       ARG  61 -13.754  -2.599   9.666
  511    QD   ARG  61           QD       ARG  61 -14.293  -0.382   8.685
  512    QH1  ARG  61           QH2      ARG  61 -16.717   0.982  10.229
  513    QH2  ARG  61           QH1      ARG  61 -18.451  -0.463   8.049
  514    H    SER  62           H        SER  62 -11.019  -4.198   7.370
  515    HA   SER  62           HA       SER  62  -8.506  -2.988   6.570
  516   1HB   SER  62          1HB       SER  62  -7.793  -5.362   5.797
  517   2HB   SER  62          2HB       SER  62  -7.590  -4.876   7.427
  518    HG   SER  62           HG       SER  62  -9.493  -5.944   8.033
  519    QB   SER  62           QB       SER  62  -7.692  -5.119   6.612
  520    H    THR  63           H        THR  63  -7.951  -3.114   4.386
  521    HA   THR  63           HA       THR  63 -10.247  -3.332   2.509
  522    HB   THR  63           HB       THR  63  -8.908  -1.144   1.637
  523    HG1  THR  63          1HG       THR  63  -7.959  -0.077   3.190
  524   1HG2  THR  63          2HG2      THR  63 -11.060  -1.198   3.798
  525   2HG2  THR  63          3HG2      THR  63 -10.654   0.204   2.790
  526   3HG2  THR  63          1HG2      THR  63 -11.321  -1.257   2.044
  527    QG2  THR  63           QG2      THR  63 -11.012  -0.750   2.877
  528    H    THR  64           H        THR  64  -9.641  -4.933   1.168
  529    HA   THR  64           HA       THR  64  -6.878  -5.594   0.626
  530    HB   THR  64           HB       THR  64  -8.844  -7.127   0.620
  531    HG1  THR  64          1HG       THR  64  -7.626  -7.397  -1.889
  532   1HG2  THR  64          1HG2      THR  64 -10.347  -5.640  -0.756
  533   2HG2  THR  64          2HG2      THR  64  -9.402  -6.107  -2.171
  534   3HG2  THR  64          3HG2      THR  64 -10.283  -7.342  -1.261
  535    QG2  THR  64           QG2      THR  64 -10.010  -6.363  -1.396
  536    H    MET  65           H        MET  65  -5.672  -4.127  -0.370
  537    HA   MET  65           HA       MET  65  -6.794  -2.534  -2.637
  538   1HB   MET  65          1HB       MET  65  -6.030  -1.337  -0.480
  539   2HB   MET  65          2HB       MET  65  -4.384  -1.657  -1.067
  540   1HG   MET  65          1HG       MET  65  -5.056   0.508  -1.934
  541   2HG   MET  65          2HG       MET  65  -5.120  -0.623  -3.289
  542   1HE   MET  65          1HE       MET  65  -6.355   1.955  -3.861
  543   2HE   MET  65          2HE       MET  65  -6.790   0.575  -4.911
  544   3HE   MET  65          3HE       MET  65  -8.059   1.653  -4.305
  545    QB   MET  65           QB       MET  65  -5.207  -1.497  -0.774
  546    QG   MET  65           QG       MET  65  -5.088  -0.057  -2.612
  547    QE   MET  65           QE       MET  65  -7.068   1.395  -4.359
  548    H    CYS  66           H        CYS  66  -6.290  -3.518  -4.466
  549    HA   CYS  66           HA       CYS  66  -3.547  -4.599  -4.925
  550   1HB   CYS  66          1HB       CYS  66  -6.125  -4.747  -6.472
  551   2HB   CYS  66          2HB       CYS  66  -4.565  -5.182  -7.151
  552    QB   CYS  66           QB       CYS  66  -5.345  -4.965  -6.811
  553    H    CYS  67           H        CYS  67  -2.197  -3.696  -6.553
  554    HA   CYS  67           HA       CYS  67  -3.365  -1.681  -8.304
  555   1HB   CYS  67          1HB       CYS  67  -2.407  -0.635  -6.188
  556   2HB   CYS  67          2HB       CYS  67  -0.826  -1.045  -6.793
  557    QB   CYS  67           QB       CYS  67  -1.617  -0.840  -6.491
  558    HA   PRO  68           HA       PRO  68  -0.682  -4.172 -10.843
  559   1HB   PRO  68          1HB       PRO  68  -0.750  -2.780 -13.221
  560   2HB   PRO  68          2HB       PRO  68  -1.903  -3.979 -12.633
  561   1HG   PRO  68          1HG       PRO  68  -2.125  -0.972 -12.555
  562   2HG   PRO  68          2HG       PRO  68  -3.419  -2.166 -12.806
  563   1HD   PRO  68          1HD       PRO  68  -2.950  -0.877 -10.415
  564   2HD   PRO  68          2HD       PRO  68  -3.679  -2.510 -10.522
  565    QB   PRO  68           QB       PRO  68  -1.327  -3.380 -12.927
  566    QG   PRO  68           QG       PRO  68  -2.772  -1.569 -12.680
  567    QD   PRO  68           QD       PRO  68  -3.315  -1.694 -10.468
  568    H    ALA  69           H        ALA  69   1.255  -3.995 -12.302
  569    HA   ALA  69           HA       ALA  69   3.264  -2.507 -10.801
  570   1HB   ALA  69          1HB       ALA  69   3.521  -4.126 -13.378
  571   2HB   ALA  69          2HB       ALA  69   4.891  -3.532 -12.446
  572   3HB   ALA  69          3HB       ALA  69   3.824  -4.758 -11.744
  573    QB   ALA  69           QB       ALA  69   4.079  -4.139 -12.522
  574    H    ASN  70           H        ASN  70   4.421  -0.697 -11.502
  575    HA   ASN  70           HA       ASN  70   4.892   1.220 -12.552
  576   1HB   ASN  70          1HB       ASN  70   3.838  -0.066 -15.112
  577   2HB   ASN  70          2HB       ASN  70   4.596   1.522 -14.990
  578   1HD2  ASN  70          2HD2      ASN  70   7.025  -1.638 -15.184
  579   2HD2  ASN  70          1HD2      ASN  70   5.356  -1.704 -15.719
  580    QB   ASN  70           QB       ASN  70   4.217   0.728 -15.051
  581    QD2  ASN  70           QD2      ASN  70   6.191  -1.671 -15.452
  582    H    THR  71           H        THR  71   2.878   1.185 -10.915
  583    HA   THR  71           HA       THR  71   0.880   2.927 -12.227
  584    HB   THR  71           HB       THR  71  -0.029   0.773 -10.333
  585    HG1  THR  71          1HG       THR  71   0.741  -0.329 -11.991
  586   1HG2  THR  71          1HG2      THR  71  -1.449   2.451 -12.453
  587   2HG2  THR  71          2HG2      THR  71  -2.213   1.220 -11.428
  588   3HG2  THR  71          3HG2      THR  71  -1.545   2.683 -10.692
  589    QG2  THR  71           QG2      THR  71  -1.736   2.118 -11.524
  590    H    CYS  72           H        CYS  72   0.598   4.662 -11.150
  591    HA   CYS  72           HA       CYS  72   1.269   4.975  -8.291
  592   1HB   CYS  72          1HB       CYS  72   1.888   6.919  -9.387
  593   2HB   CYS  72          2HB       CYS  72   0.705   6.717 -10.671
  594    QB   CYS  72           QB       CYS  72   1.296   6.818 -10.029
  595    H    CYS  73           H        CYS  73  -0.305   5.087  -6.658
  596    HA   CYS  73           HA       CYS  73  -3.071   4.348  -7.391
  597   1HB   CYS  73          1HB       CYS  73  -1.441   3.144  -5.164
  598   2HB   CYS  73          2HB       CYS  73  -2.810   2.473  -5.987
  599    QB   CYS  73           QB       CYS  73  -2.126   2.808  -5.576
  600    H    ASN  74           H        ASN  74  -4.043   6.337  -6.679
  601    HA   ASN  74           HA       ASN  74  -3.188   7.628  -4.253
  602   1HB   ASN  74          1HB       ASN  74  -4.439   8.723  -6.172
  603   2HB   ASN  74          2HB       ASN  74  -5.881   7.912  -5.616
  604   1HD2  ASN  74          2HD2      ASN  74  -4.898  10.301  -2.535
  605   2HD2  ASN  74          1HD2      ASN  74  -3.825   8.969  -2.868
  606    QB   ASN  74           QB       ASN  74  -5.160   8.318  -5.894
  607    QD2  ASN  74           QD2      ASN  74  -4.361   9.635  -2.702
  608    H    ILE  75           H        ILE  75  -3.623   6.958  -2.150
  609    HA   ILE  75           HA       ILE  75  -5.616   4.950  -1.564
  610    HB   ILE  75           HB       ILE  75  -3.305   6.297  -0.247
  611   1HG1  ILE  75          1HG1      ILE  75  -2.958   4.010   0.542
  612   2HG1  ILE  75          2HG1      ILE  75  -4.513   3.508  -0.170
  613   1HG2  ILE  75          1HG2      ILE  75  -5.575   5.216   1.408
  614   2HG2  ILE  75          2HG2      ILE  75  -3.900   5.498   1.958
  615   3HG2  ILE  75          3HG2      ILE  75  -4.878   6.870   1.453
  616   1HD1  ILE  75          2HD1      ILE  75  -2.149   4.665  -1.647
  617   2HD1  ILE  75          3HD1      ILE  75  -2.537   2.925  -1.526
  618   3HD1  ILE  75          1HD1      ILE  75  -3.615   4.010  -2.421
  619    QG1  ILE  75           QG1      ILE  75  -3.735   3.759   0.186
  620    QG2  ILE  75           QG2      ILE  75  -4.785   5.861   1.606
  621    QD1  ILE  75           QD1      ILE  75  -2.767   3.866  -1.865
  622    H    ASN  76           H        ASN  76  -7.692   5.433  -1.439
  623    HA   ASN  76           HA       ASN  76  -8.663   7.609   0.282
  624   1HB   ASN  76          1HB       ASN  76 -10.404   7.923  -1.806
  625   2HB   ASN  76          2HB       ASN  76  -9.067   9.000  -1.433
  626   1HD2  ASN  76          2HD2      ASN  76  -8.884   6.763  -4.851
  627   2HD2  ASN  76          1HD2      ASN  76 -10.202   6.496  -3.707
  628    QB   ASN  76           QB       ASN  76  -9.735   8.462  -1.619
  629    QD2  ASN  76           QD2      ASN  76  -9.543   6.630  -4.279
  630    H    THR  77           H        THR  77  -9.781   6.291   1.601
  631    HA   THR  77           HA       THR  77 -11.445   4.087   0.445
  632    HB   THR  77           HB       THR  77  -9.050   3.988   2.038
  633    HG1  THR  77          1HG       THR  77  -9.434   2.584   0.357
  634   1HG2  THR  77          3HG2      THR  77 -10.408   3.881   4.036
  635   2HG2  THR  77          1HG2      THR  77 -11.315   2.501   3.354
  636   3HG2  THR  77          2HG2      THR  77  -9.592   2.358   3.681
  637    QG2  THR  77           QG2      THR  77 -10.438   2.913   3.690
  638    H    GLY  78           H        GLY  78 -11.484   6.947   2.177
  639   1HA   GLY  78          1HA       GLY  78 -13.130   7.928   3.380
  640   2HA   GLY  78          2HA       GLY  78 -14.118   6.475   3.246
  641    QA   GLY  78           QA       GLY  78 -13.624   7.202   3.313
  642    H    PHE  79           H        PHE  79 -10.915   5.779   4.658
  643    HA   PHE  79           HA       PHE  79 -11.537   7.026   7.184
  644   1HB   PHE  79          1HB       PHE  79 -10.626   4.966   8.252
  645   2HB   PHE  79          2HB       PHE  79 -12.318   4.857   7.826
  646    HD1  PHE  79          2HD       PHE  79  -8.824   3.713   7.124
  647    HD2  PHE  79          1HD       PHE  79 -12.989   3.115   6.151
  648    HE1  PHE  79          2HE       PHE  79  -8.337   1.412   6.344
  649    HE2  PHE  79          1HE       PHE  79 -12.509   0.740   5.652
  650   1HZ   PHE  79           HZ       PHE  79 -10.171  -0.106   5.719
  651    QB   PHE  79           QB       PHE  79 -11.472   4.912   8.039
  652    QG   PHE  79           QD       PHE  79 -10.907   3.414   6.637
  653    QZ   PHE  79           QE       PHE  79 -10.423   1.076   5.998
  654    QZ   PHE  79           QR       PHE  79 -10.566   1.775   6.198
  655    H    TYR  80           H        TYR  80  -9.742   7.251   8.456
  656    HA   TYR  80           HA       TYR  80  -7.445   7.843   6.816
  657   1HB   TYR  80          1HB       TYR  80  -7.957   9.349   8.632
  658   2HB   TYR  80          2HB       TYR  80  -8.099   7.970   9.733
  659    HD1  TYR  80          1HD       TYR  80  -5.043   8.363   7.613
  660    HD2  TYR  80          2HD       TYR  80  -6.876   9.036  11.458
  661    HE1  TYR  80          1HE       TYR  80  -2.826   8.331   8.684
  662    HE2  TYR  80          2HE       TYR  80  -4.643   9.082  12.512
  663    HH   TYR  80           HH       TYR  80  -1.639   8.942  10.764
  664    QB   TYR  80           QB       TYR  80  -8.028   8.660   9.183
  665    QG   TYR  80           QD       TYR  80  -5.959   8.700   9.536
  666    QZ   TYR  80           QE       TYR  80  -3.734   8.706  10.598
  667    QR   TYR  80           QR       TYR  80  -4.847   8.703  10.067
  668    H    ILE  81           H        ILE  81  -5.650   6.495   6.679
  669    HA   ILE  81           HA       ILE  81  -6.023   3.753   7.617
  670    HB   ILE  81           HB       ILE  81  -4.196   3.408   5.813
  671   1HG1  ILE  81          1HG1      ILE  81  -4.151   6.031   5.460
  672   2HG1  ILE  81          2HG1      ILE  81  -4.069   4.931   4.124
  673   1HG2  ILE  81          2HG2      ILE  81  -7.170   3.793   5.350
  674   2HG2  ILE  81          3HG2      ILE  81  -6.065   3.032   4.190
  675   3HG2  ILE  81          1HG2      ILE  81  -6.299   2.315   5.787
  676   1HD1  ILE  81          3HD1      ILE  81  -6.657   6.227   5.026
  677   2HD1  ILE  81          1HD1      ILE  81  -5.639   6.749   3.688
  678   3HD1  ILE  81          2HD1      ILE  81  -6.455   5.177   3.629
  679    QG1  ILE  81           QG1      ILE  81  -4.110   5.481   4.792
  680    QG2  ILE  81           QG2      ILE  81  -6.511   3.047   5.109
  681    QD1  ILE  81           QD1      ILE  81  -6.250   6.051   4.114
  682    H    ARG  82           H        ARG  82  -4.489   2.857   9.009
  683    HA   ARG  82           HA       ARG  82  -1.947   4.390   9.475
  684   1HB   ARG  82          1HB       ARG  82  -3.756   3.057  11.534
  685   2HB   ARG  82          2HB       ARG  82  -2.161   3.782  11.835
  686   1HG   ARG  82          1HG       ARG  82  -3.225   5.650  12.167
  687   2HG   ARG  82          2HG       ARG  82  -3.289   5.758  10.394
  688   1HD   ARG  82          1HD       ARG  82  -5.470   6.302  11.270
  689   2HD   ARG  82          2HD       ARG  82  -5.534   4.768  10.401
  690    HE   ARG  82           HE       ARG  82  -5.080   4.291  13.209
  691   1HH1  ARG  82          2HH2      ARG  82  -7.571   5.089  10.752
  692   2HH1  ARG  82          1HH2      ARG  82  -8.883   4.850  11.906
  693   1HH2  ARG  82          2HH1      ARG  82  -6.970   3.585  14.503
  694   2HH2  ARG  82          1HH1      ARG  82  -8.560   4.024  13.902
  695    QB   ARG  82           QB       ARG  82  -2.959   3.419  11.685
  696    QG   ARG  82           QG       ARG  82  -3.257   5.704  11.280
  697    QD   ARG  82           QD       ARG  82  -5.502   5.535  10.835
  698    QH1  ARG  82           QH2      ARG  82  -8.227   4.970  11.329
  699    QH2  ARG  82           QH1      ARG  82  -7.765   3.805  14.202
  700    H    SER  83           H        SER  83  -3.117   1.601   8.449
  701    HA   SER  83           HA       SER  83  -0.288   0.826   8.276
  702   1HB   SER  83          1HB       SER  83  -0.604  -1.534   9.275
  703   2HB   SER  83          2HB       SER  83  -0.518  -0.166  10.383
  704    HG   SER  83           HG       SER  83  -2.801  -0.136  10.487
  705    QB   SER  83           QB       SER  83  -0.561  -0.850   9.829
  706    H    TYR  84           H        TYR  84   0.287  -1.256   7.128
  707    HA   TYR  84           HA       TYR  84  -1.768  -2.565   5.683
  708   1HB   TYR  84          1HB       TYR  84  -1.100  -2.217   3.445
  709   2HB   TYR  84          2HB       TYR  84  -1.273  -0.613   4.135
  710    HD1  TYR  84          2HD       TYR  84   1.114  -3.113   2.767
  711    HD2  TYR  84          1HD       TYR  84   0.601   0.890   4.217
  712    HE1  TYR  84          2HE       TYR  84   3.420  -2.571   2.072
  713    HE2  TYR  84          1HE       TYR  84   2.968   1.399   3.636
  714    HH   TYR  84           HH       TYR  84   4.865   0.661   2.688
  715    QB   TYR  84           QB       TYR  84  -1.187  -1.415   3.790
  716    QG   TYR  84           QD       TYR  84   0.857  -1.111   3.492
  717    QZ   TYR  84           QE       TYR  84   3.194  -0.586   2.854
  718    QR   TYR  84           QR       TYR  84   2.026  -0.849   3.173
  719    H    ARG  85           H        ARG  85  -0.927  -4.427   4.460
  720    HA   ARG  85           HA       ARG  85   1.854  -5.359   5.019
  721   1HB   ARG  85          1HB       ARG  85   0.099  -6.450   6.536
  722   2HB   ARG  85          2HB       ARG  85  -0.787  -6.887   5.070
  723   1HG   ARG  85          1HG       ARG  85   1.489  -8.145   4.463
  724   2HG   ARG  85          2HG       ARG  85   1.683  -8.081   6.234
  725   1HD   ARG  85          1HD       ARG  85  -0.807  -8.832   6.277
  726   2HD   ARG  85          2HD       ARG  85  -0.458  -9.318   4.598
  727    HE   ARG  85           HE       ARG  85   1.084 -10.255   7.018
  728   1HH1  ARG  85          2HH2      ARG  85  -1.102 -11.371   4.423
  729   2HH1  ARG  85          1HH2      ARG  85  -0.327 -12.894   4.290
  730   1HH2  ARG  85          2HH1      ARG  85   1.791 -12.398   7.057
  731   2HH2  ARG  85          1HH1      ARG  85   1.440 -13.477   5.734
  732    QB   ARG  85           QB       ARG  85  -0.344  -6.669   5.803
  733    QG   ARG  85           QG       ARG  85   1.586  -8.113   5.349
  734    QD   ARG  85           QD       ARG  85  -0.633  -9.075   5.438
  735    QH1  ARG  85           QH2      ARG  85  -0.714 -12.133   4.356
  736    QH2  ARG  85           QH1      ARG  85   1.616 -12.937   6.396
  737    H    ARG  86           H        ARG  86   2.748  -5.800   2.893
  738    HA   ARG  86           HA       ARG  86   0.948  -5.962   0.592
  739   1HB   ARG  86          1HB       ARG  86   3.184  -5.068   0.239
  740   2HB   ARG  86          2HB       ARG  86   3.897  -6.596   0.794
  741   1HG   ARG  86          1HG       ARG  86   2.840  -7.811  -1.071
  742   2HG   ARG  86          2HG       ARG  86   2.118  -6.302  -1.638
  743   1HD   ARG  86          1HD       ARG  86   4.370  -5.393  -2.072
  744   2HD   ARG  86          2HD       ARG  86   5.101  -6.902  -1.479
  745    HE   ARG  86           HE       ARG  86   3.290  -7.776  -3.337
  746   1HH1  ARG  86          2HH2      ARG  86   6.014  -5.481  -3.777
  747   2HH1  ARG  86          1HH2      ARG  86   5.643  -5.341  -5.480
  748   1HH2  ARG  86          2HH1      ARG  86   3.515  -8.151  -5.444
  749   2HH2  ARG  86          1HH1      ARG  86   4.626  -7.223  -6.457
  750    QB   ARG  86           QB       ARG  86   3.540  -5.832   0.516
  751    QG   ARG  86           QG       ARG  86   2.479  -7.056  -1.354
  752    QD   ARG  86           QD       ARG  86   4.736  -6.148  -1.775
  753    QH1  ARG  86           QH2      ARG  86   5.828  -5.411  -4.628
  754    QH2  ARG  86           QH1      ARG  86   4.070  -7.687  -5.951
  755    H    VAL  87           H        VAL  87   0.087  -7.826  -0.232
  756    HA   VAL  87           HA       VAL  87   0.507 -10.333   1.321
  757    HB   VAL  87           HB       VAL  87  -1.657 -11.010   0.256
  758   1HG1  VAL  87          3HG1      VAL  87  -1.439 -10.242   2.594
  759   2HG1  VAL  87          1HG1      VAL  87  -1.724  -8.570   2.090
  760   3HG1  VAL  87          2HG1      VAL  87  -3.002  -9.789   1.893
  761   1HG2  VAL  87          2HG2      VAL  87  -1.597  -9.084  -1.507
  762   2HG2  VAL  87          3HG2      VAL  87  -3.133  -9.442  -0.720
  763   3HG2  VAL  87          1HG2      VAL  87  -2.185  -8.061  -0.188
  764    QG1  VAL  87           QG1      VAL  87  -2.055  -9.534   2.192
  765    QG2  VAL  87           QG2      VAL  87  -2.305  -8.862  -0.805
  766    QQG  VAL  87           QQG      VAL  87  -2.180  -9.198   0.694
  767    H    GLU  88           H        GLU  88   0.732  -8.931  -2.005
  768    HA   GLU  88           HA       GLU  88   2.337 -11.170  -2.845
  769   1HB   GLU  88          1HB       GLU  88   0.725 -11.454  -4.879
  770   2HB   GLU  88          2HB       GLU  88   0.410 -12.366  -3.393
  771   1HG   GLU  88          1HG       GLU  88  -1.353 -10.875  -2.735
  772   2HG   GLU  88          2HG       GLU  88  -0.922  -9.716  -4.029
  773    QB   GLU  88           QB       GLU  88   0.568 -11.910  -4.136
  774    QG   GLU  88           QG       GLU  88  -1.138 -10.295  -3.382
   
  No H/Q in entry =         774
  Start of MODEL    9
    1   1HA   GLY   1          1HA       GLY   1  10.834  -9.159 -12.545
    2   2HA   GLY   1          2HA       GLY   1  12.234 -10.230 -12.413
    3    QA   GLY   1           QA       GLY   1  11.534  -9.694 -12.479
    4    H    ASP   2           H        ASP   2  11.382  -6.909 -11.772
    5    HA   ASP   2           HA       ASP   2  12.751  -6.522  -9.301
    6   1HB   ASP   2          1HB       ASP   2  14.718  -5.209 -10.286
    7   2HB   ASP   2          2HB       ASP   2  14.828  -6.965 -10.341
    8    QB   ASP   2           QB       ASP   2  14.773  -6.087 -10.314
    9    H    GLY   3           H        GLY   3  11.576  -4.893  -8.592
   10   1HA   GLY   3          1HA       GLY   3  11.942  -2.268  -9.641
   11   2HA   GLY   3          2HA       GLY   3  10.259  -2.801  -9.886
   12    QA   GLY   3           QA       GLY   3  11.100  -2.534  -9.763
   13    H    TYR   4           H        TYR   4   9.720  -1.138  -8.233
   14    HA   TYR   4           HA       TYR   4  10.229  -2.081  -5.423
   15   1HB   TYR   4          1HB       TYR   4   9.901   0.349  -4.810
   16   2HB   TYR   4          2HB       TYR   4  11.366  -0.081  -5.658
   17    HD1  TYR   4          1HD       TYR   4   8.034   1.555  -6.052
   18    HD2  TYR   4          2HD       TYR   4  11.844   0.747  -7.906
   19    HE1  TYR   4          1HE       TYR   4   7.431   3.032  -7.940
   20    HE2  TYR   4          2HE       TYR   4  11.214   2.195  -9.798
   21    HH   TYR   4           HH       TYR   4   8.132   3.982  -9.968
   22    QB   TYR   4           QB       TYR   4  10.633   0.134  -5.234
   23    QG   TYR   4           QD       TYR   4   9.939   1.151  -6.979
   24    QZ   TYR   4           QE       TYR   4   9.323   2.614  -8.869
   25    QR   TYR   4           QR       TYR   4   9.631   1.882  -7.924
   26    H    LEU   5           H        LEU   5   8.579  -1.235  -3.958
   27    HA   LEU   5           HA       LEU   5   5.963  -0.530  -4.890
   28   1HB   LEU   5          1HB       LEU   5   6.035  -3.020  -5.086
   29   2HB   LEU   5          2HB       LEU   5   6.138  -3.158  -3.340
   30    HG   LEU   5           HG       LEU   5   3.958  -1.432  -4.590
   31   1HD1  LEU   5          2HD1      LEU   5   4.050  -3.564  -5.914
   32   2HD1  LEU   5          3HD1      LEU   5   3.852  -4.456  -4.406
   33   3HD1  LEU   5          1HD1      LEU   5   2.561  -3.350  -5.004
   34   1HD2  LEU   5          3HD2      LEU   5   4.164  -3.053  -2.056
   35   2HD2  LEU   5          1HD2      LEU   5   3.856  -1.323  -2.258
   36   3HD2  LEU   5          2HD2      LEU   5   2.615  -2.484  -2.710
   37    QB   LEU   5           QB       LEU   5   6.086  -3.089  -4.213
   38    QD1  LEU   5           QD1      LEU   5   3.487  -3.790  -5.108
   39    QD2  LEU   5           QD2      LEU   5   3.545  -2.286  -2.341
   40    QQD  LEU   5           QQD      LEU   5   3.516  -3.038  -3.725
   41    H    ILE   6           H        ILE   6   6.493   1.249  -3.785
   42    HA   ILE   6           HA       ILE   6   6.802   1.152  -0.797
   43    HB   ILE   6           HB       ILE   6   7.820   3.398  -1.070
   44   1HG1  ILE   6          1HG1      ILE   6   7.388   2.918  -4.056
   45   2HG1  ILE   6          2HG1      ILE   6   6.879   4.277  -3.054
   46   1HG2  ILE   6          2HG2      ILE   6   9.142   1.283  -0.994
   47   2HG2  ILE   6          3HG2      ILE   6   9.321   1.372  -2.757
   48   3HG2  ILE   6          1HG2      ILE   6   9.956   2.674  -1.728
   49   1HD1  ILE   6          2HD1      ILE   6   9.342   4.831  -2.777
   50   2HD1  ILE   6          3HD1      ILE   6   9.676   3.523  -3.941
   51   3HD1  ILE   6          1HD1      ILE   6   8.735   4.926  -4.442
   52    QG1  ILE   6           QG1      ILE   6   7.134   3.597  -3.555
   53    QG2  ILE   6           QG2      ILE   6   9.473   1.776  -1.827
   54    QD1  ILE   6           QD1      ILE   6   9.251   4.427  -3.720
   55    H    MET   7           H        MET   7   5.771   3.349   0.153
   56    HA   MET   7           HA       MET   7   3.949   4.464  -1.748
   57   1HB   MET   7          1HB       MET   7   2.252   4.730  -0.172
   58   2HB   MET   7          2HB       MET   7   2.602   3.000  -0.318
   59   1HG   MET   7          1HG       MET   7   3.766   3.075   1.853
   60   2HG   MET   7          2HG       MET   7   3.366   4.787   1.976
   61   1HE   MET   7          3HE       MET   7   0.627   5.571   1.704
   62   2HE   MET   7          1HE       MET   7   0.163   4.295   0.551
   63   3HE   MET   7          2HE       MET   7  -0.680   4.438   2.103
   64    QB   MET   7           QB       MET   7   2.427   3.865  -0.245
   65    QG   MET   7           QG       MET   7   3.566   3.931   1.914
   66    QE   MET   7           QE       MET   7   0.037   4.768   1.453
   67    H    CYS   8           H        CYS   8   3.158   6.554  -0.967
   68    HA   CYS   8           HA       CYS   8   5.429   8.250  -0.199
   69   1HB   CYS   8          1HB       CYS   8   3.997   8.167  -2.881
   70   2HB   CYS   8          2HB       CYS   8   5.281   9.283  -2.471
   71    QB   CYS   8           QB       CYS   8   4.639   8.725  -2.676
   72    H    LYS   9           H        LYS   9   4.901  10.429  -0.277
   73    HA   LYS   9           HA       LYS   9   2.075  11.005   0.456
   74   1HB   LYS   9          1HB       LYS   9   2.913  13.255   0.922
   75   2HB   LYS   9          2HB       LYS   9   3.708  11.937   1.805
   76   1HG   LYS   9          1HG       LYS   9   5.664  12.071   0.687
   77   2HG   LYS   9          2HG       LYS   9   5.007  12.947  -0.697
   78   1HD   LYS   9          1HD       LYS   9   5.472  13.955   2.163
   79   2HD   LYS   9          2HD       LYS   9   6.458  14.335   0.760
   80   1HE   LYS   9          1HE       LYS   9   3.809  15.490   1.598
   81   2HE   LYS   9          2HE       LYS   9   5.231  16.288   0.923
   82   1HZ   LYS   9          3HZ       LYS   9   4.478  15.043  -1.229
   83   2HZ   LYS   9          1HZ       LYS   9   3.028  14.936  -0.421
   84   3HZ   LYS   9          2HZ       LYS   9   3.624  16.347  -0.796
   85    QB   LYS   9           QB       LYS   9   3.310  12.596   1.363
   86    QG   LYS   9           QG       LYS   9   5.335  12.509  -0.005
   87    QD   LYS   9           QD       LYS   9   5.965  14.145   1.462
   88    QE   LYS   9           QE       LYS   9   4.520  15.889   1.260
   89    QZ   LYS   9           QZ       LYS   9   3.710  15.442  -0.815
   90    H    ASN  10           H        ASN  10   3.865  11.390  -2.338
   91    HA   ASN  10           HA       ASN  10   1.382  12.431  -3.629
   92   1HB   ASN  10          1HB       ASN  10   2.533  13.799  -5.242
   93   2HB   ASN  10          2HB       ASN  10   2.873  14.356  -3.615
   94   1HD2  ASN  10          2HD2      ASN  10   6.232  14.578  -4.768
   95   2HD2  ASN  10          1HD2      ASN  10   4.748  15.492  -4.537
   96    QB   ASN  10           QB       ASN  10   2.703  14.078  -4.428
   97    QD2  ASN  10           QD2      ASN  10   5.490  15.035  -4.653
   98    H    CYS  11           H        CYS  11   1.681  12.099  -6.101
   99    HA   CYS  11           HA       CYS  11   1.712   9.221  -6.401
  100   1HB   CYS  11          1HB       CYS  11   0.112  10.812  -7.410
  101   2HB   CYS  11          2HB       CYS  11   1.400  11.569  -8.336
  102    QB   CYS  11           QB       CYS  11   0.756  11.190  -7.873
  103    H    ASP  12           H        ASP  12   4.316  11.189  -6.265
  104    HA   ASP  12           HA       ASP  12   5.665  10.141  -8.726
  105   1HB   ASP  12          1HB       ASP  12   4.796  12.432  -8.864
  106   2HB   ASP  12          2HB       ASP  12   5.832  12.871  -7.483
  107    QB   ASP  12           QB       ASP  12   5.314  12.652  -8.174
  108    HA   PRO  13           HA       PRO  13   8.209   9.034  -5.124
  109   1HB   PRO  13          1HB       PRO  13   9.663   6.982  -6.322
  110   2HB   PRO  13          2HB       PRO  13   8.098   6.792  -5.483
  111   1HG   PRO  13          1HG       PRO  13   8.650   6.917  -8.424
  112   2HG   PRO  13          2HG       PRO  13   7.409   5.986  -7.566
  113   1HD   PRO  13          1HD       PRO  13   6.994   8.386  -8.929
  114   2HD   PRO  13          2HD       PRO  13   5.945   7.865  -7.581
  115    QB   PRO  13           QB       PRO  13   8.881   6.887  -5.903
  116    QG   PRO  13           QG       PRO  13   8.029   6.452  -7.995
  117    QD   PRO  13           QD       PRO  13   6.469   8.125  -8.255
  118    H    ASN  14           H        ASN  14   9.173  10.221  -8.191
  119    HA   ASN  14           HA       ASN  14  11.999  10.550  -7.567
  120   1HB   ASN  14          1HB       ASN  14  11.323  10.576  -9.863
  121   2HB   ASN  14          2HB       ASN  14  10.135  11.826  -9.559
  122   1HD2  ASN  14          2HD2      ASN  14  12.568  13.980 -10.959
  123   2HD2  ASN  14          1HD2      ASN  14  10.987  13.191 -11.104
  124    QB   ASN  14           QB       ASN  14  10.729  11.201  -9.711
  125    QD2  ASN  14           QD2      ASN  14  11.777  13.585 -11.032
  126    H    THR  15           H        THR  15   9.074  12.588  -7.383
  127    HA   THR  15           HA       THR  15  10.636  14.608  -5.809
  128    HB   THR  15           HB       THR  15   9.142  16.277  -6.730
  129    HG1  THR  15          1HG       THR  15   8.056  14.058  -8.133
  130   1HG2  THR  15          3HG2      THR  15  11.232  15.521  -7.968
  131   2HG2  THR  15          1HG2      THR  15  10.181  14.504  -8.975
  132   3HG2  THR  15          2HG2      THR  15   9.997  16.256  -8.997
  133    QG2  THR  15           QG2      THR  15  10.470  15.427  -8.647
  134    H    GLY  16           H        GLY  16   8.971  12.139  -4.861
  135   1HA   GLY  16          1HA       GLY  16   7.710  13.671  -2.648
  136   2HA   GLY  16          2HA       GLY  16   6.997  12.207  -3.336
  137    QA   GLY  16           QA       GLY  16   7.353  12.939  -2.992
  138    H    SER  17           H        SER  17   8.358  13.080  -0.622
  139    HA   SER  17           HA       SER  17  10.317  11.099  -0.103
  140   1HB   SER  17          1HB       SER  17   8.594  11.701   2.171
  141   2HB   SER  17          2HB       SER  17  10.272  12.159   1.880
  142    HG   SER  17           HG       SER  17   9.111  14.034   2.019
  143    QB   SER  17           QB       SER  17   9.433  11.930   2.026
  144    H    CYS  18           H        CYS  18  10.021   8.862   0.163
  145    HA   CYS  18           HA       CYS  18   7.281   7.820   0.357
  146   1HB   CYS  18          1HB       CYS  18   9.692   7.049  -1.347
  147   2HB   CYS  18          2HB       CYS  18   8.249   6.073  -1.235
  148    QB   CYS  18           QB       CYS  18   8.971   6.561  -1.291
  149    H    ASP  19           H        ASP  19   7.211   5.619   1.429
  150    HA   ASP  19           HA       ASP  19   9.611   5.152   3.093
  151   1HB   ASP  19          1HB       ASP  19   8.322   3.512   4.231
  152   2HB   ASP  19          2HB       ASP  19   7.713   5.170   4.352
  153    QB   ASP  19           QB       ASP  19   8.017   4.341   4.292
  154    H    TRP  20           H        TRP  20  11.058   4.427   1.818
  155    HA   TRP  20           HA       TRP  20  10.862   1.982   0.155
  156   1HB   TRP  20          1HB       TRP  20  13.193   3.801   0.883
  157   2HB   TRP  20          2HB       TRP  20  13.270   2.394  -0.174
  158    HD1  TRP  20           HD       TRP  20  12.072   6.005  -0.138
  159    HE1  TRP  20          1HE       TRP  20  11.918   6.848  -2.558
  160    HE3  TRP  20          3HE       TRP  20  12.743   1.566  -2.578
  161    HZ2  TRP  20          2HZ       TRP  20  11.793   5.704  -5.188
  162    HZ3  TRP  20          3HZ       TRP  20  12.725   1.504  -5.053
  163    HH2  TRP  20           HH       TRP  20  12.132   3.505  -6.360
  164    QB   TRP  20           QB       TRP  20  13.232   3.097   0.354
  165    H    LYS  21           H        LYS  21   9.907   1.405   2.391
  166    HA   LYS  21           HA       LYS  21  12.033  -0.152   3.792
  167   1HB   LYS  21          1HB       LYS  21  10.956   1.802   5.104
  168   2HB   LYS  21          2HB       LYS  21   9.461   0.871   5.082
  169   1HG   LYS  21          1HG       LYS  21  10.693   0.691   7.165
  170   2HG   LYS  21          2HG       LYS  21  10.525  -0.901   6.432
  171   1HD   LYS  21          1HD       LYS  21  12.823  -0.960   5.734
  172   2HD   LYS  21          2HD       LYS  21  13.028   0.779   5.909
  173   1HE   LYS  21          1HE       LYS  21  12.643  -1.197   8.214
  174   2HE   LYS  21          2HE       LYS  21  14.191  -0.528   7.667
  175   1HZ   LYS  21          2HZ       LYS  21  13.263   1.709   8.196
  176   2HZ   LYS  21          3HZ       LYS  21  11.969   0.957   8.878
  177   3HZ   LYS  21          1HZ       LYS  21  13.438   0.709   9.514
  178    QB   LYS  21           QB       LYS  21  10.208   1.337   5.093
  179    QG   LYS  21           QG       LYS  21  10.609  -0.105   6.799
  180    QD   LYS  21           QD       LYS  21  12.925  -0.090   5.822
  181    QE   LYS  21           QE       LYS  21  13.417  -0.862   7.940
  182    QZ   LYS  21           QZ       LYS  21  12.890   1.125   8.863
  183    H    GLN  22           H        GLN  22  11.180  -2.246   4.680
  184    HA   GLN  22           HA       GLN  22   9.650  -3.589   2.676
  185   1HB   GLN  22          1HB       GLN  22  11.248  -4.780   4.123
  186   2HB   GLN  22          2HB       GLN  22  10.199  -4.408   5.527
  187   1HG   GLN  22          1HG       GLN  22   8.449  -5.784   4.823
  188   2HG   GLN  22          2HG       GLN  22   9.111  -5.939   3.184
  189   1HE2  GLN  22          2HE2      GLN  22   9.722  -9.107   5.077
  190   2HE2  GLN  22          1HE2      GLN  22   8.263  -8.177   4.745
  191    QB   GLN  22           QB       GLN  22  10.724  -4.594   4.825
  192    QG   GLN  22           QG       GLN  22   8.780  -5.862   4.004
  193    QE2  GLN  22           QE2      GLN  22   8.993  -8.642   4.911
  194    H    ASN  23           H        ASN  23   7.651  -4.276   2.727
  195    HA   ASN  23           HA       ASN  23   5.698  -3.595   4.844
  196   1HB   ASN  23          1HB       ASN  23   4.150  -2.535   3.332
  197   2HB   ASN  23          2HB       ASN  23   5.657  -1.624   3.390
  198   1HD2  ASN  23          2HD2      ASN  23   6.342  -1.968  -0.078
  199   2HD2  ASN  23          1HD2      ASN  23   6.883  -1.386   1.478
  200    QB   ASN  23           QB       ASN  23   4.903  -2.080   3.361
  201    QD2  ASN  23           QD2      ASN  23   6.612  -1.677   0.700
  202    H    TRP  24           H        TRP  24   6.998  -6.126   3.131
  203    HA   TRP  24           HA       TRP  24   4.469  -7.286   2.236
  204   1HB   TRP  24          1HB       TRP  24   6.231  -7.485   0.655
  205   2HB   TRP  24          2HB       TRP  24   7.418  -7.818   1.916
  206    HD1  TRP  24           HD       TRP  24   7.313 -10.012   3.138
  207    HE1  TRP  24          1HE       TRP  24   6.485 -12.457   2.466
  208    HE3  TRP  24          3HE       TRP  24   4.636  -8.801  -0.951
  209    HZ2  TRP  24          2HZ       TRP  24   4.830 -13.588   0.349
  210    HZ3  TRP  24          3HZ       TRP  24   3.194 -10.457  -2.094
  211    HH2  TRP  24           HH       TRP  24   3.339 -12.836  -1.546
  212    QB   TRP  24           QB       TRP  24   6.824  -7.651   1.285
  213    H    ASN  25           H        ASN  25   3.411  -8.410   3.662
  214    HA   ASN  25           HA       ASN  25   2.843  -9.583   5.520
  215   1HB   ASN  25          1HB       ASN  25   5.445 -10.928   4.730
  216   2HB   ASN  25          2HB       ASN  25   4.195 -11.618   5.765
  217   1HD2  ASN  25          2HD2      ASN  25   2.870 -13.085   2.808
  218   2HD2  ASN  25          1HD2      ASN  25   3.720 -13.390   4.322
  219    QB   ASN  25           QB       ASN  25   4.820 -11.273   5.247
  220    QD2  ASN  25           QD2      ASN  25   3.295 -13.238   3.565
  221    H    THR  26           H        THR  26   4.035  -7.157   6.292
  222    HA   THR  26           HA       THR  26   4.978  -7.864   8.990
  223    HB   THR  26           HB       THR  26   6.977  -7.289   7.859
  224    HG1  THR  26          1HG       THR  26   7.034  -6.483   9.752
  225   1HG2  THR  26          3HG2      THR  26   5.524  -4.806   6.845
  226   2HG2  THR  26          1HG2      THR  26   7.288  -4.984   6.828
  227   3HG2  THR  26          2HG2      THR  26   6.273  -6.082   5.878
  228    QG2  THR  26           QG2      THR  26   6.362  -5.291   6.517
  229    H    CYS  27           H        CYS  27   4.301  -6.314  10.500
  230    HA   CYS  27           HA       CYS  27   1.782  -5.081   9.789
  231   1HB   CYS  27          1HB       CYS  27   2.103  -6.552  11.831
  232   2HB   CYS  27          2HB       CYS  27   3.117  -5.291  12.498
  233    QB   CYS  27           QB       CYS  27   2.610  -5.922  12.164
  234    H    VAL  28           H        VAL  28   2.221  -2.969   8.783
  235    HA   VAL  28           HA       VAL  28   4.273  -1.232  10.119
  236    HB   VAL  28           HB       VAL  28   3.797  -1.890   7.200
  237   1HG1  VAL  28          3HG1      VAL  28   5.501   0.390   8.304
  238   2HG1  VAL  28          1HG1      VAL  28   5.506  -0.205   6.630
  239   3HG1  VAL  28          2HG1      VAL  28   4.057   0.548   7.283
  240   1HG2  VAL  28          1HG2      VAL  28   5.349  -3.338   8.561
  241   2HG2  VAL  28          2HG2      VAL  28   6.191  -2.448   7.279
  242   3HG2  VAL  28          3HG2      VAL  28   6.298  -1.899   8.962
  243    QG1  VAL  28           QG1      VAL  28   5.021   0.244   7.406
  244    QG2  VAL  28           QG2      VAL  28   5.946  -2.561   8.267
  245    QQG  VAL  28           QQG      VAL  28   5.484  -1.159   7.836
  246    H    GLY  29           H        GLY  29   3.576   0.695  10.732
  247   1HA   GLY  29          1HA       GLY  29   0.899   1.577  10.102
  248   2HA   GLY  29          2HA       GLY  29   1.894   2.102  11.455
  249    QA   GLY  29           QA       GLY  29   1.396   1.840  10.778
  250    H    ILE  30           H        ILE  30   0.527   3.650   9.282
  251    HA   ILE  30           HA       ILE  30   2.705   4.917   7.682
  252    HB   ILE  30           HB       ILE  30  -0.175   4.077   7.220
  253   1HG1  ILE  30          1HG1      ILE  30   0.532   2.876   5.399
  254   2HG1  ILE  30          2HG1      ILE  30   1.987   3.853   5.163
  255   1HG2  ILE  30          1HG2      ILE  30   1.239   6.140   5.514
  256   2HG2  ILE  30          2HG2      ILE  30  -0.225   5.251   5.056
  257   3HG2  ILE  30          3HG2      ILE  30  -0.275   6.349   6.430
  258   1HD1  ILE  30          1HD1      ILE  30   1.621   1.809   7.348
  259   2HD1  ILE  30          2HD1      ILE  30   2.560   1.598   5.870
  260   3HD1  ILE  30          3HD1      ILE  30   3.098   2.779   7.032
  261    QG1  ILE  30           QG1      ILE  30   1.259   3.364   5.281
  262    QG2  ILE  30           QG2      ILE  30   0.247   5.913   5.667
  263    QD1  ILE  30           QD1      ILE  30   2.426   2.062   6.750
  264    H    GLY  31           H        GLY  31   2.615   7.216   7.385
  265   1HA   GLY  31          1HA       GLY  31   0.334   8.757   8.028
  266   2HA   GLY  31          2HA       GLY  31   1.517   8.883   9.353
  267    QA   GLY  31           QA       GLY  31   0.926   8.820   8.691
  268    H    ALA  32           H        ALA  32   1.331  11.113   8.565
  269    HA   ALA  32           HA       ALA  32   2.125  12.915   7.699
  270   1HB   ALA  32          1HB       ALA  32   4.201  12.114   8.849
  271   2HB   ALA  32          2HB       ALA  32   4.750  11.409   7.311
  272   3HB   ALA  32          3HB       ALA  32   4.564  13.173   7.489
  273    QB   ALA  32           QB       ALA  32   4.505  12.232   7.883
  274    H    ASN  33           H        ASN  33   0.576  12.525   6.227
  275    HA   ASN  33           HA       ASN  33  -0.283  13.160   4.304
  276   1HB   ASN  33          1HB       ASN  33   2.457  13.809   3.169
  277   2HB   ASN  33          2HB       ASN  33   0.901  14.454   2.672
  278   1HD2  ASN  33          2HD2      ASN  33   0.748  16.636   5.650
  279   2HD2  ASN  33          1HD2      ASN  33  -0.300  15.484   4.843
  280    QB   ASN  33           QB       ASN  33   1.679  14.131   2.921
  281    QD2  ASN  33           QD2      ASN  33   0.224  16.060   5.246
  282    H    VAL  34           H        VAL  34   1.662  10.582   4.733
  283    HA   VAL  34           HA       VAL  34   2.163   9.726   1.978
  284    HB   VAL  34           HB       VAL  34   2.341   8.191   4.549
  285   1HG1  VAL  34          3HG1      VAL  34   2.805   7.393   1.694
  286   2HG1  VAL  34          1HG1      VAL  34   3.908   6.813   2.937
  287   3HG1  VAL  34          2HG1      VAL  34   2.173   6.471   3.074
  288   1HG2  VAL  34          1HG2      VAL  34   3.964  10.106   4.262
  289   2HG2  VAL  34          2HG2      VAL  34   4.781   8.554   4.188
  290   3HG2  VAL  34          3HG2      VAL  34   4.441   9.448   2.693
  291    QG1  VAL  34           QG1      VAL  34   2.962   6.892   2.568
  292    QG2  VAL  34           QG2      VAL  34   4.395   9.369   3.714
  293    QQG  VAL  34           QQG      VAL  34   3.679   8.131   3.141
  294    H    HIS  35           H        HIS  35   0.495   9.343   0.600
  295    HA   HIS  35           HA       HIS  35  -1.427   7.240   1.279
  296   1HB   HIS  35          1HB       HIS  35  -3.382   8.396   1.027
  297   2HB   HIS  35          2HB       HIS  35  -2.482   9.437   2.123
  298    HD1  HIS  35          1HD       HIS  35  -4.709   9.441  -0.684
  299    HD2  HIS  35          2HD       HIS  35  -1.322  11.664   0.437
  300    HE1  HIS  35          1HE       HIS  35  -4.907  11.753  -1.824
  301    QB   HIS  35           QB       HIS  35  -2.932   8.917   1.575
  302    H    TRP  36           H        TRP  36   0.800   7.665  -0.622
  303    HA   TRP  36           HA       TRP  36  -0.826   6.786  -3.032
  304   1HB   TRP  36          1HB       TRP  36   1.639   8.496  -2.884
  305   2HB   TRP  36          2HB       TRP  36   0.986   7.822  -4.365
  306    HD1  TRP  36           HD       TRP  36  -0.129  10.270  -1.574
  307    HE1  TRP  36          1HE       TRP  36  -2.005  11.707  -2.434
  308    HE3  TRP  36          3HE       TRP  36  -0.718   8.035  -6.073
  309    HZ2  TRP  36          2HZ       TRP  36  -3.520  11.992  -4.953
  310    HZ3  TRP  36          3HZ       TRP  36  -2.363   8.916  -7.738
  311    HH2  TRP  36           HH       TRP  36  -3.649  10.974  -7.234
  312    QB   TRP  36           QB       TRP  36   1.313   8.159  -3.624
  313    H    MET  37           H        MET  37  -0.363   4.746  -3.405
  314    HA   MET  37           HA       MET  37   2.269   3.609  -2.578
  315   1HB   MET  37          1HB       MET  37   0.319   2.312  -1.940
  316   2HB   MET  37          2HB       MET  37  -0.195   2.219  -3.619
  317   1HG   MET  37          1HG       MET  37   2.003   1.016  -4.120
  318   2HG   MET  37          2HG       MET  37   2.306   1.028  -2.378
  319   1HE   MET  37          3HE       MET  37   0.188  -0.341  -5.319
  320   2HE   MET  37          1HE       MET  37  -1.015  -1.373  -4.517
  321   3HE   MET  37          2HE       MET  37  -1.135   0.382  -4.366
  322    QB   MET  37           QB       MET  37   0.062   2.265  -2.779
  323    QG   MET  37           QG       MET  37   2.155   1.022  -3.249
  324    QE   MET  37           QE       MET  37  -0.654  -0.444  -4.734
  325    H    VAL  38           H        VAL  38   3.757   3.003  -4.221
  326    HA   VAL  38           HA       VAL  38   2.870   3.419  -7.024
  327    HB   VAL  38           HB       VAL  38   5.531   4.536  -6.104
  328   1HG1  VAL  38          3HG1      VAL  38   5.068   4.108  -8.541
  329   2HG1  VAL  38          1HG1      VAL  38   3.659   5.175  -8.437
  330   3HG1  VAL  38          2HG1      VAL  38   5.254   5.841  -8.198
  331   1HG2  VAL  38          2HG2      VAL  38   2.905   6.092  -6.232
  332   2HG2  VAL  38          3HG2      VAL  38   3.886   5.815  -4.774
  333   3HG2  VAL  38          1HG2      VAL  38   4.517   6.805  -6.083
  334    QG1  VAL  38           QG1      VAL  38   4.660   5.041  -8.392
  335    QG2  VAL  38           QG2      VAL  38   3.769   6.237  -5.696
  336    QQG  VAL  38           QQG      VAL  38   4.215   5.639  -7.044
  337    H    THR  39           H        THR  39   3.357   1.632  -8.126
  338    HA   THR  39           HA       THR  39   5.496  -0.131  -7.021
  339    HB   THR  39           HB       THR  39   3.727  -1.442  -6.696
  340    HG1  THR  39          1HG       THR  39   3.857  -3.034  -8.349
  341   1HG2  THR  39          3HG2      THR  39   2.404  -0.691  -9.291
  342   2HG2  THR  39          1HG2      THR  39   1.892  -1.983  -8.174
  343   3HG2  THR  39          2HG2      THR  39   1.850  -0.307  -7.646
  344    QG2  THR  39           QG2      THR  39   2.049  -0.993  -8.371
  345    H    GLY  40           H        GLY  40   7.209  -0.081  -8.117
  346   1HA   GLY  40          1HA       GLY  40   7.417   0.769 -10.916
  347   2HA   GLY  40          2HA       GLY  40   8.668   0.173  -9.758
  348    QA   GLY  40           QA       GLY  40   8.043   0.471 -10.337
  349    H    GLY  41           H        GLY  41   6.359  -1.746  -9.701
  350   1HA   GLY  41          1HA       GLY  41   5.868  -3.922 -10.480
  351   2HA   GLY  41          2HA       GLY  41   7.053  -3.734 -11.806
  352    QA   GLY  41           QA       GLY  41   6.461  -3.828 -11.143
  353    H    SER  42           H        SER  42   7.386  -3.147  -8.357
  354    HA   SER  42           HA       SER  42   8.986  -4.143  -6.870
  355   1HB   SER  42          1HB       SER  42   6.427  -4.391  -6.643
  356   2HB   SER  42          2HB       SER  42   6.698  -6.097  -6.919
  357    HG   SER  42           HG       SER  42   7.352  -6.198  -4.894
  358    QB   SER  42           QB       SER  42   6.563  -5.244  -6.781
  359    H    THR  43           H        THR  43   7.611  -6.835  -8.763
  360    HA   THR  43           HA       THR  43  10.129  -8.143  -9.154
  361    HB   THR  43           HB       THR  43   9.793  -8.579  -6.773
  362    HG1  THR  43          1HG       THR  43   9.342 -10.958  -8.246
  363   1HG2  THR  43          1HG2      THR  43   7.290  -8.601  -6.637
  364   2HG2  THR  43          2HG2      THR  43   7.322 -10.239  -7.342
  365   3HG2  THR  43          3HG2      THR  43   8.109  -9.925  -5.802
  366    QG2  THR  43           QG2      THR  43   7.574  -9.588  -6.594
  367    H    ASP  44           H        ASP  44   6.623  -8.717  -8.678
  368    HA   ASP  44           HA       ASP  44   6.608 -10.309 -11.076
  369   1HB   ASP  44          1HB       ASP  44   5.184 -10.457  -8.701
  370   2HB   ASP  44          2HB       ASP  44   3.979  -9.920  -9.886
  371    QB   ASP  44           QB       ASP  44   4.582 -10.189  -9.293
  372    H    GLY  45           H        GLY  45   5.526  -9.886 -12.916
  373   1HA   GLY  45          1HA       GLY  45   5.299  -7.095 -13.707
  374   2HA   GLY  45          2HA       GLY  45   5.046  -8.526 -14.726
  375    QA   GLY  45           QA       GLY  45   5.172  -7.810 -14.216
  376    H    LYS  46           H        LYS  46   3.070  -9.503 -12.633
  377    HA   LYS  46           HA       LYS  46   0.666  -8.347 -13.844
  378   1HB   LYS  46          1HB       LYS  46  -0.574  -9.899 -12.385
  379   2HB   LYS  46          2HB       LYS  46   0.525 -10.660 -13.537
  380   1HG   LYS  46          1HG       LYS  46   2.218 -10.895 -11.766
  381   2HG   LYS  46          2HG       LYS  46   1.142 -10.029 -10.644
  382   1HD   LYS  46          1HD       LYS  46  -0.516 -11.958 -10.974
  383   2HD   LYS  46          2HD       LYS  46   0.721 -12.771 -11.959
  384   1HE   LYS  46          1HE       LYS  46   2.302 -12.709 -10.035
  385   2HE   LYS  46          2HE       LYS  46   1.119 -11.854  -9.059
  386   1HZ   LYS  46          2HZ       LYS  46  -0.324 -13.802  -9.226
  387   2HZ   LYS  46          3HZ       LYS  46   0.836 -14.619 -10.062
  388   3HZ   LYS  46          1HZ       LYS  46   1.142 -14.127  -8.542
  389    QB   LYS  46           QB       LYS  46  -0.024 -10.280 -12.961
  390    QG   LYS  46           QG       LYS  46   1.680 -10.462 -11.205
  391    QD   LYS  46           QD       LYS  46   0.103 -12.365 -11.467
  392    QE   LYS  46           QE       LYS  46   1.711 -12.281  -9.547
  393    QZ   LYS  46           QZ       LYS  46   0.552 -14.183  -9.277
  394    H    GLN  47           H        GLN  47  -1.191  -7.833 -12.058
  395    HA   GLN  47           HA       GLN  47  -0.343  -5.516 -10.615
  396   1HB   GLN  47          1HB       GLN  47  -2.587  -5.480  -9.716
  397   2HB   GLN  47          2HB       GLN  47  -2.701  -5.988 -11.402
  398   1HG   GLN  47          1HG       GLN  47  -3.067  -8.300 -10.689
  399   2HG   GLN  47          2HG       GLN  47  -2.764  -7.877  -8.998
  400   1HE2  GLN  47          2HE2      GLN  47  -6.266  -7.545  -8.635
  401   2HE2  GLN  47          1HE2      GLN  47  -4.865  -8.471  -8.177
  402    QB   GLN  47           QB       GLN  47  -2.644  -5.734 -10.559
  403    QG   GLN  47           QG       GLN  47  -2.916  -8.089  -9.844
  404    QE2  GLN  47           QE2      GLN  47  -5.566  -8.008  -8.406
  405    H    GLY  48           H        GLY  48  -0.424  -5.204  -8.191
  406   1HA   GLY  48          1HA       GLY  48  -0.247  -7.792  -6.693
  407   2HA   GLY  48          2HA       GLY  48   1.076  -6.645  -6.503
  408    QA   GLY  48           QA       GLY  48   0.415  -7.219  -6.598
  409    H    CYS  49           H        CYS  49  -0.680  -7.429  -4.239
  410    HA   CYS  49           HA       CYS  49  -2.262  -4.995  -3.826
  411   1HB   CYS  49          1HB       CYS  49  -3.329  -7.832  -3.332
  412   2HB   CYS  49          2HB       CYS  49  -4.180  -6.318  -3.301
  413    QB   CYS  49           QB       CYS  49  -3.755  -7.075  -3.317
  414    H    ALA  50           H        ALA  50  -3.186  -4.961  -1.671
  415    HA   ALA  50           HA       ALA  50  -1.574  -6.391   0.399
  416   1HB   ALA  50          2HB       ALA  50  -0.465  -4.149   0.001
  417   2HB   ALA  50          3HB       ALA  50  -2.038  -3.375   0.291
  418   3HB   ALA  50          1HB       ALA  50  -1.226  -4.229   1.594
  419    QB   ALA  50           QB       ALA  50  -1.243  -3.918   0.628
  420    H    THR  51           H        THR  51  -2.493  -6.199   2.495
  421    HA   THR  51           HA       THR  51  -5.416  -5.576   2.585
  422    HB   THR  51           HB       THR  51  -3.528  -6.688   4.712
  423    HG1  THR  51          1HG       THR  51  -4.130  -8.122   2.956
  424   1HG2  THR  51          3HG2      THR  51  -5.454  -5.345   5.618
  425   2HG2  THR  51          1HG2      THR  51  -6.568  -6.394   4.707
  426   3HG2  THR  51          2HG2      THR  51  -5.575  -7.052   6.024
  427    QG2  THR  51           QG2      THR  51  -5.866  -6.263   5.450
  428    H    ILE  52           H        ILE  52  -5.911  -3.542   3.327
  429    HA   ILE  52           HA       ILE  52  -3.781  -1.859   4.549
  430    HB   ILE  52           HB       ILE  52  -6.249  -1.215   2.867
  431   1HG1  ILE  52          1HG1      ILE  52  -3.262  -0.717   2.570
  432   2HG1  ILE  52          2HG1      ILE  52  -4.315  -1.672   1.528
  433   1HG2  ILE  52          2HG2      ILE  52  -6.213   0.351   4.799
  434   2HG2  ILE  52          3HG2      ILE  52  -4.537   0.767   4.372
  435   3HG2  ILE  52          1HG2      ILE  52  -5.900   1.150   3.286
  436   1HD1  ILE  52          2HD1      ILE  52  -5.523   0.560   1.003
  437   2HD1  ILE  52          3HD1      ILE  52  -4.171   1.359   1.838
  438   3HD1  ILE  52          1HD1      ILE  52  -3.865   0.402   0.394
  439    QG1  ILE  52           QG1      ILE  52  -3.788  -1.194   2.049
  440    QG2  ILE  52           QG2      ILE  52  -5.550   0.756   4.152
  441    QD1  ILE  52           QD1      ILE  52  -4.520   0.774   1.078
  442    H    TRP  53           H        TRP  53  -4.513  -0.704   6.505
  443    HA   TRP  53           HA       TRP  53  -7.098  -1.625   7.608
  444   1HB   TRP  53          1HB       TRP  53  -4.478  -1.436   9.116
  445   2HB   TRP  53          2HB       TRP  53  -6.030  -1.480   9.903
  446    HD1  TRP  53           HD       TRP  53  -7.147  -3.759  10.371
  447    HE1  TRP  53          1HE       TRP  53  -6.448  -6.161  10.106
  448    HE3  TRP  53          3HE       TRP  53  -3.221  -3.017   7.213
  449    HZ2  TRP  53          2HZ       TRP  53  -4.356  -7.649   8.643
  450    HZ3  TRP  53          3HZ       TRP  53  -1.988  -4.922   6.314
  451    HH2  TRP  53           HH       TRP  53  -2.499  -7.259   7.066
  452    QB   TRP  53           QB       TRP  53  -5.254  -1.458   9.509
  453    H    GLU  54           H        GLU  54  -8.075  -0.327   9.136
  454    HA   GLU  54           HA       GLU  54  -7.581   2.574   8.947
  455   1HB   GLU  54          1HB       GLU  54  -9.862   1.499   8.775
  456   2HB   GLU  54          2HB       GLU  54  -9.686   0.918  10.435
  457   1HG   GLU  54          1HG       GLU  54  -9.685   3.199  11.286
  458   2HG   GLU  54          2HG       GLU  54  -9.633   3.849   9.640
  459    QB   GLU  54           QB       GLU  54  -9.774   1.209   9.605
  460    QG   GLU  54           QG       GLU  54  -9.659   3.524  10.463
  461    H    GLY  55           H        GLY  55  -7.214  -0.195  11.178
  462   1HA   GLY  55          1HA       GLY  55  -6.788   1.513  13.466
  463   2HA   GLY  55          2HA       GLY  55  -6.762  -0.201  13.496
  464    QA   GLY  55           QA       GLY  55  -6.775   0.656  13.481
  465    H    SER  56           H        SER  56  -5.017   1.731  14.683
  466    HA   SER  56           HA       SER  56  -2.854   2.433  13.053
  467   1HB   SER  56          1HB       SER  56  -2.950   2.496  16.097
  468   2HB   SER  56          2HB       SER  56  -2.157   3.663  15.041
  469    HG   SER  56           HG       SER  56  -4.114   4.573  14.665
  470    QB   SER  56           QB       SER  56  -2.554   3.080  15.569
  471    H    GLY  57           H        GLY  57  -1.852   0.468  12.298
  472   1HA   GLY  57          1HA       GLY  57   0.537  -0.162  13.100
  473   2HA   GLY  57          2HA       GLY  57  -0.429  -1.208  14.174
  474    QA   GLY  57           QA       GLY  57   0.054  -0.685  13.637
  475    H    CYS  58           H        CYS  58  -2.442  -1.913  12.813
  476    HA   CYS  58           HA       CYS  58  -2.880  -2.624  10.363
  477   1HB   CYS  58          1HB       CYS  58  -2.059  -4.742   9.789
  478   2HB   CYS  58          2HB       CYS  58  -0.665  -3.716  10.021
  479    QB   CYS  58           QB       CYS  58  -1.362  -4.229   9.905
  480    H    VAL  59           H        VAL  59  -4.420  -2.053  12.494
  481    HA   VAL  59           HA       VAL  59  -5.654  -4.596  13.399
  482    HB   VAL  59           HB       VAL  59  -5.953  -3.367  15.565
  483   1HG1  VAL  59          3HG1      VAL  59  -3.137  -4.204  14.791
  484   2HG1  VAL  59          1HG1      VAL  59  -3.729  -4.007  16.456
  485   3HG1  VAL  59          2HG1      VAL  59  -4.448  -5.235  15.414
  486   1HG2  VAL  59          1HG2      VAL  59  -3.685  -1.589  14.590
  487   2HG2  VAL  59          2HG2      VAL  59  -5.353  -1.098  14.991
  488   3HG2  VAL  59          3HG2      VAL  59  -4.283  -1.711  16.247
  489    QG1  VAL  59           QG1      VAL  59  -3.771  -4.482  15.554
  490    QG2  VAL  59           QG2      VAL  59  -4.440  -1.466  15.276
  491    QQG  VAL  59           QQG      VAL  59  -4.106  -2.974  15.415
  492    H    GLY  60           H        GLY  60  -7.868  -3.834  14.461
  493   1HA   GLY  60          1HA       GLY  60  -9.929  -2.745  14.066
  494   2HA   GLY  60          2HA       GLY  60  -9.016  -1.474  13.270
  495    QA   GLY  60           QA       GLY  60  -9.472  -2.110  13.668
  496    H    ARG  61           H        ARG  61 -10.293  -1.236  11.524
  497    HA   ARG  61           HA       ARG  61 -11.523  -3.454   9.993
  498   1HB   ARG  61          1HB       ARG  61 -12.730  -1.285  10.339
  499   2HB   ARG  61          2HB       ARG  61 -11.383  -0.439   9.562
  500   1HG   ARG  61          1HG       ARG  61 -11.852  -1.575   7.415
  501   2HG   ARG  61          2HG       ARG  61 -13.192  -2.468   8.188
  502   1HD   ARG  61          1HD       ARG  61 -14.267  -0.315   8.718
  503   2HD   ARG  61          2HD       ARG  61 -12.920   0.567   7.961
  504    HE   ARG  61           HE       ARG  61 -13.813  -1.127   5.946
  505   1HH1  ARG  61          2HH2      ARG  61 -15.176   1.512   7.905
  506   2HH1  ARG  61          1HH2      ARG  61 -16.707   1.528   7.092
  507   1HH2  ARG  61          2HH1      ARG  61 -15.480  -0.488   4.398
  508   2HH2  ARG  61          1HH1      ARG  61 -16.838   0.454   4.996
  509    QB   ARG  61           QB       ARG  61 -12.057  -0.862   9.951
  510    QG   ARG  61           QG       ARG  61 -12.522  -2.021   7.802
  511    QD   ARG  61           QD       ARG  61 -13.594   0.126   8.339
  512    QH1  ARG  61           QH2      ARG  61 -15.942   1.520   7.499
  513    QH2  ARG  61           QH1      ARG  61 -16.159  -0.017   4.697
  514    H    SER  62           H        SER  62 -11.080  -3.965   7.878
  515    HA   SER  62           HA       SER  62  -8.871  -2.620   6.724
  516   1HB   SER  62          1HB       SER  62  -7.815  -4.996   6.129
  517   2HB   SER  62          2HB       SER  62  -7.469  -4.224   7.645
  518    HG   SER  62           HG       SER  62  -8.111  -6.455   7.877
  519    QB   SER  62           QB       SER  62  -7.642  -4.610   6.887
  520    H    THR  63           H        THR  63  -8.470  -3.200   4.477
  521    HA   THR  63           HA       THR  63 -10.574  -4.743   3.133
  522    HB   THR  63           HB       THR  63 -11.254  -2.243   3.203
  523    HG1  THR  63          1HG       THR  63 -12.139  -3.676   1.761
  524   1HG2  THR  63          3HG2      THR  63  -8.913  -1.366   2.673
  525   2HG2  THR  63          1HG2      THR  63  -9.158  -1.952   1.015
  526   3HG2  THR  63          2HG2      THR  63 -10.235  -0.716   1.685
  527    QG2  THR  63           QG2      THR  63  -9.435  -1.345   1.791
  528    H    THR  64           H        THR  64  -9.789  -5.441   0.974
  529    HA   THR  64           HA       THR  64  -6.846  -5.531   0.875
  530    HB   THR  64           HB       THR  64  -8.785  -6.793  -1.068
  531    HG1  THR  64          1HG       THR  64  -7.718  -7.894   1.323
  532   1HG2  THR  64          1HG2      THR  64  -5.937  -7.488  -0.193
  533   2HG2  THR  64          2HG2      THR  64  -6.917  -8.370  -1.377
  534   3HG2  THR  64          3HG2      THR  64  -6.391  -6.720  -1.730
  535    QG2  THR  64           QG2      THR  64  -6.415  -7.526  -1.100
  536    H    MET  65           H        MET  65  -5.775  -3.992  -0.253
  537    HA   MET  65           HA       MET  65  -7.204  -2.354  -2.315
  538   1HB   MET  65          1HB       MET  65  -6.269  -1.078  -0.419
  539   2HB   MET  65          2HB       MET  65  -4.670  -1.777  -0.727
  540   1HG   MET  65          1HG       MET  65  -4.902   0.516  -1.662
  541   2HG   MET  65          2HG       MET  65  -4.511  -0.684  -2.884
  542   1HE   MET  65          3HE       MET  65  -7.321   1.484  -1.269
  543   2HE   MET  65          1HE       MET  65  -8.672   1.248  -2.399
  544   3HE   MET  65          2HE       MET  65  -8.155  -0.091  -1.358
  545    QB   MET  65           QB       MET  65  -5.469  -1.428  -0.573
  546    QG   MET  65           QG       MET  65  -4.706  -0.084  -2.273
  547    QE   MET  65           QE       MET  65  -8.049   0.881  -1.675
  548    H    CYS  66           H        CYS  66  -6.690  -2.946  -4.369
  549    HA   CYS  66           HA       CYS  66  -4.127  -4.402  -4.871
  550   1HB   CYS  66          1HB       CYS  66  -6.850  -4.486  -6.220
  551   2HB   CYS  66          2HB       CYS  66  -5.398  -5.015  -7.057
  552    QB   CYS  66           QB       CYS  66  -6.124  -4.750  -6.639
  553    H    CYS  67           H        CYS  67  -2.900  -3.680  -6.723
  554    HA   CYS  67           HA       CYS  67  -3.998  -1.513  -8.379
  555   1HB   CYS  67          1HB       CYS  67  -2.730  -0.625  -6.333
  556   2HB   CYS  67          2HB       CYS  67  -1.275  -1.269  -7.098
  557    QB   CYS  67           QB       CYS  67  -2.002  -0.947  -6.715
  558    HA   PRO  68           HA       PRO  68  -1.603  -3.947 -11.428
  559   1HB   PRO  68          1HB       PRO  68  -1.244  -1.267 -12.733
  560   2HB   PRO  68          2HB       PRO  68  -1.711  -2.823 -13.469
  561   1HG   PRO  68          1HG       PRO  68  -3.609  -0.941 -12.993
  562   2HG   PRO  68          2HG       PRO  68  -3.927  -2.656 -12.599
  563   1HD   PRO  68          1HD       PRO  68  -2.988  -0.471 -10.729
  564   2HD   PRO  68          2HD       PRO  68  -4.357  -1.596 -10.520
  565    QB   PRO  68           QB       PRO  68  -1.478  -2.045 -13.101
  566    QG   PRO  68           QG       PRO  68  -3.768  -1.799 -12.796
  567    QD   PRO  68           QD       PRO  68  -3.672  -1.034 -10.624
  568    H    ALA  69           H        ALA  69   0.617  -3.715 -12.472
  569    HA   ALA  69           HA       ALA  69   2.595  -2.611 -10.527
  570   1HB   ALA  69          3HB       ALA  69   2.992  -4.409 -12.950
  571   2HB   ALA  69          1HB       ALA  69   4.250  -3.812 -11.895
  572   3HB   ALA  69          2HB       ALA  69   3.029  -4.905 -11.236
  573    QB   ALA  69           QB       ALA  69   3.424  -4.375 -12.027
  574    H    ASN  70           H        ASN  70   4.351  -1.276 -11.467
  575    HA   ASN  70           HA       ASN  70   5.224   0.388 -12.743
  576   1HB   ASN  70          1HB       ASN  70   3.843  -1.187 -14.953
  577   2HB   ASN  70          2HB       ASN  70   4.629   0.355 -15.271
  578   1HD2  ASN  70          2HD2      ASN  70   7.259  -2.460 -13.895
  579   2HD2  ASN  70          1HD2      ASN  70   5.647  -2.411 -13.169
  580    QB   ASN  70           QB       ASN  70   4.236  -0.416 -15.112
  581    QD2  ASN  70           QD2      ASN  70   6.453  -2.435 -13.532
  582    H    THR  71           H        THR  71   3.178   1.094 -11.119
  583    HA   THR  71           HA       THR  71   2.115   3.359 -12.547
  584    HB   THR  71           HB       THR  71   0.560   1.427 -13.066
  585    HG1  THR  71          1HG       THR  71  -1.320   2.772 -12.546
  586   1HG2  THR  71          1HG2      THR  71   0.632   0.489 -10.716
  587   2HG2  THR  71          2HG2      THR  71  -0.411   1.843 -10.227
  588   3HG2  THR  71          3HG2      THR  71  -0.991   0.663 -11.412
  589    QG2  THR  71           QG2      THR  71  -0.257   0.998 -10.785
  590    H    CYS  72           H        CYS  72   0.561   4.495 -11.098
  591    HA   CYS  72           HA       CYS  72   1.559   4.808  -8.297
  592   1HB   CYS  72          1HB       CYS  72   2.174   6.809  -9.449
  593   2HB   CYS  72          2HB       CYS  72   0.754   6.724 -10.507
  594    QB   CYS  72           QB       CYS  72   1.464   6.766  -9.978
  595    H    CYS  73           H        CYS  73  -0.031   4.930  -6.724
  596    HA   CYS  73           HA       CYS  73  -2.791   4.188  -7.518
  597   1HB   CYS  73          1HB       CYS  73  -1.032   2.986  -5.378
  598   2HB   CYS  73          2HB       CYS  73  -2.568   2.382  -5.936
  599    QB   CYS  73           QB       CYS  73  -1.800   2.684  -5.657
  600    H    ASN  74           H        ASN  74  -3.786   6.099  -6.760
  601    HA   ASN  74           HA       ASN  74  -3.179   7.478  -4.309
  602   1HB   ASN  74          1HB       ASN  74  -4.630   8.451  -6.100
  603   2HB   ASN  74          2HB       ASN  74  -5.726   7.079  -5.964
  604   1HD2  ASN  74          2HD2      ASN  74  -5.949   9.643  -2.787
  605   2HD2  ASN  74          1HD2      ASN  74  -4.342   9.102  -3.281
  606    QB   ASN  74           QB       ASN  74  -5.178   7.765  -6.032
  607    QD2  ASN  74           QD2      ASN  74  -5.145   9.373  -3.034
  608    H    ILE  75           H        ILE  75  -3.052   6.290  -2.378
  609    HA   ILE  75           HA       ILE  75  -5.180   4.433  -1.630
  610    HB   ILE  75           HB       ILE  75  -2.664   5.546  -0.422
  611   1HG1  ILE  75          1HG1      ILE  75  -2.368   3.181   0.183
  612   2HG1  ILE  75          2HG1      ILE  75  -3.950   2.796  -0.554
  613   1HG2  ILE  75          2HG2      ILE  75  -4.946   4.374   1.188
  614   2HG2  ILE  75          3HG2      ILE  75  -3.278   4.580   1.776
  615   3HG2  ILE  75          1HG2      ILE  75  -4.233   6.001   1.364
  616   1HD1  ILE  75          2HD1      ILE  75  -1.595   4.023  -1.974
  617   2HD1  ILE  75          3HD1      ILE  75  -1.973   2.280  -1.975
  618   3HD1  ILE  75          1HD1      ILE  75  -3.084   3.425  -2.750
  619    QG1  ILE  75           QG1      ILE  75  -3.159   2.989  -0.185
  620    QG2  ILE  75           QG2      ILE  75  -4.152   4.985   1.442
  621    QD1  ILE  75           QD1      ILE  75  -2.217   3.243  -2.233
  622    H    ASN  76           H        ASN  76  -7.128   5.186  -1.111
  623    HA   ASN  76           HA       ASN  76  -7.458   7.244   0.849
  624   1HB   ASN  76          1HB       ASN  76  -7.176   8.813  -1.002
  625   2HB   ASN  76          2HB       ASN  76  -8.358   7.928  -1.982
  626   1HD2  ASN  76          2HD2      ASN  76 -10.391  10.644  -0.728
  627   2HD2  ASN  76          1HD2      ASN  76  -9.259  10.230  -2.005
  628    QB   ASN  76           QB       ASN  76  -7.767   8.370  -1.492
  629    QD2  ASN  76           QD2      ASN  76  -9.825  10.437  -1.366
  630    H    THR  77           H        THR  77  -8.324   5.213   1.704
  631    HA   THR  77           HA       THR  77 -10.673   4.002   0.474
  632    HB   THR  77           HB       THR  77 -10.615   2.974   2.921
  633    HG1  THR  77          1HG       THR  77  -9.214   4.514   3.833
  634   1HG2  THR  77          2HG2      THR  77  -8.261   2.580   1.010
  635   2HG2  THR  77          3HG2      THR  77  -8.752   1.474   2.308
  636   3HG2  THR  77          1HG2      THR  77  -9.826   1.739   0.920
  637    QG2  THR  77           QG2      THR  77  -8.946   1.931   1.413
  638    H    GLY  78           H        GLY  78 -12.752   4.010   1.796
  639   1HA   GLY  78          1HA       GLY  78 -13.698   6.647   2.203
  640   2HA   GLY  78          2HA       GLY  78 -14.492   5.188   2.785
  641    QA   GLY  78           QA       GLY  78 -14.095   5.917   2.494
  642    H    PHE  79           H        PHE  79 -12.273   4.269   4.427
  643    HA   PHE  79           HA       PHE  79 -12.381   6.117   6.754
  644   1HB   PHE  79          1HB       PHE  79 -11.026   4.290   7.810
  645   2HB   PHE  79          2HB       PHE  79 -12.638   3.814   7.364
  646    HD1  PHE  79          2HD       PHE  79 -12.985   2.216   5.442
  647    HD2  PHE  79          1HD       PHE  79  -9.032   3.367   6.725
  648    HE1  PHE  79          2HE       PHE  79 -12.038   0.164   4.404
  649    HE2  PHE  79          1HE       PHE  79  -8.102   1.339   5.707
  650   1HZ   PHE  79           HZ       PHE  79  -9.603  -0.315   4.600
  651    QB   PHE  79           QB       PHE  79 -11.832   4.052   7.587
  652    QG   PHE  79           QD       PHE  79 -11.009   2.791   6.083
  653    QZ   PHE  79           QE       PHE  79 -10.070   0.752   5.055
  654    QZ   PHE  79           QR       PHE  79 -10.352   1.354   5.376
  655    H    TYR  80           H        TYR  80 -10.522   6.649   7.894
  656    HA   TYR  80           HA       TYR  80  -8.543   7.641   6.063
  657   1HB   TYR  80          1HB       TYR  80  -9.123   9.037   7.962
  658   2HB   TYR  80          2HB       TYR  80  -8.721   7.735   9.083
  659    HD1  TYR  80          2HD       TYR  80  -6.920   9.305   6.140
  660    HD2  TYR  80          1HD       TYR  80  -6.736   8.061  10.262
  661    HE1  TYR  80          2HE       TYR  80  -4.512   9.758   6.165
  662    HE2  TYR  80          1HE       TYR  80  -4.286   8.477  10.259
  663    HH   TYR  80           HH       TYR  80  -2.450   9.023   8.991
  664    QB   TYR  80           QB       TYR  80  -8.922   8.386   8.523
  665    QG   TYR  80           QD       TYR  80  -6.828   8.683   8.201
  666    QZ   TYR  80           QE       TYR  80  -4.399   9.117   8.212
  667    QR   TYR  80           QR       TYR  80  -5.614   8.900   8.207
  668    H    ILE  81           H        ILE  81  -6.527   6.747   5.807
  669    HA   ILE  81           HA       ILE  81  -6.260   3.930   6.484
  670    HB   ILE  81           HB       ILE  81  -3.883   4.676   5.304
  671   1HG1  ILE  81          1HG1      ILE  81  -4.801   7.027   4.931
  672   2HG1  ILE  81          2HG1      ILE  81  -4.096   6.179   3.585
  673   1HG2  ILE  81          1HG2      ILE  81  -5.245   2.787   4.864
  674   2HG2  ILE  81          2HG2      ILE  81  -6.409   3.742   3.939
  675   3HG2  ILE  81          3HG2      ILE  81  -4.734   3.546   3.352
  676   1HD1  ILE  81          3HD1      ILE  81  -7.137   6.332   3.996
  677   2HD1  ILE  81          1HD1      ILE  81  -6.176   7.386   2.956
  678   3HD1  ILE  81          2HD1      ILE  81  -6.282   5.650   2.626
  679    QG1  ILE  81           QG1      ILE  81  -4.448   6.603   4.258
  680    QG2  ILE  81           QG2      ILE  81  -5.463   3.358   4.052
  681    QD1  ILE  81           QD1      ILE  81  -6.532   6.456   3.193
  682    H    ARG  82           H        ARG  82  -4.817   3.014   7.922
  683    HA   ARG  82           HA       ARG  82  -2.716   4.832   9.028
  684   1HB   ARG  82          1HB       ARG  82  -4.383   2.927  10.708
  685   2HB   ARG  82          2HB       ARG  82  -2.904   3.772  11.195
  686   1HG   ARG  82          1HG       ARG  82  -4.027   5.957  10.509
  687   2HG   ARG  82          2HG       ARG  82  -5.556   5.059  10.424
  688   1HD   ARG  82          1HD       ARG  82  -5.306   4.446  12.822
  689   2HD   ARG  82          2HD       ARG  82  -3.675   5.151  12.820
  690    HE   ARG  82           HE       ARG  82  -4.457   7.288  12.890
  691   1HH1  ARG  82          2HH2      ARG  82  -7.190   5.128  12.147
  692   2HH1  ARG  82          1HH2      ARG  82  -8.354   6.436  12.264
  693   1HH2  ARG  82          2HH1      ARG  82  -6.071   8.936  13.081
  694   2HH2  ARG  82          1HH1      ARG  82  -7.714   8.430  13.395
  695    QB   ARG  82           QB       ARG  82  -3.643   3.350  10.951
  696    QG   ARG  82           QG       ARG  82  -4.792   5.508  10.467
  697    QD   ARG  82           QD       ARG  82  -4.490   4.798  12.821
  698    QH1  ARG  82           QH2      ARG  82  -7.772   5.782  12.205
  699    QH2  ARG  82           QH1      ARG  82  -6.893   8.683  13.238
  700    H    SER  83           H        SER  83  -3.482   1.566   7.846
  701    HA   SER  83           HA       SER  83  -0.537   1.122   7.995
  702   1HB   SER  83          1HB       SER  83  -2.332  -1.027   8.993
  703   2HB   SER  83          2HB       SER  83  -0.648  -0.772   9.351
  704    HG   SER  83           HG       SER  83  -2.901   0.429  10.591
  705    QB   SER  83           QB       SER  83  -1.490  -0.899   9.172
  706    H    TYR  84           H        TYR  84   0.150  -0.955   6.875
  707    HA   TYR  84           HA       TYR  84  -1.833  -2.328   5.413
  708   1HB   TYR  84          1HB       TYR  84  -1.349  -1.898   3.209
  709   2HB   TYR  84          2HB       TYR  84  -1.425  -0.278   3.888
  710    HD1  TYR  84          1HD       TYR  84   0.959   0.620   4.727
  711    HD2  TYR  84          2HD       TYR  84   0.374  -2.353   1.682
  712    HE1  TYR  84          1HE       TYR  84   3.161   1.229   3.695
  713    HE2  TYR  84          2HE       TYR  84   2.498  -1.683   0.612
  714    HH   TYR  84           HH       TYR  84   4.515  -0.378   0.886
  715    QB   TYR  84           QB       TYR  84  -1.387  -1.088   3.548
  716    QG   TYR  84           QD       TYR  84   0.667  -0.866   3.204
  717    QZ   TYR  84           QE       TYR  84   2.830  -0.227   2.153
  718    QR   TYR  84           QR       TYR  84   1.748  -0.547   2.679
  719    H    ARG  85           H        ARG  85  -1.113  -4.246   4.474
  720    HA   ARG  85           HA       ARG  85   1.745  -5.025   4.747
  721   1HB   ARG  85          1HB       ARG  85   0.189  -5.533   6.626
  722   2HB   ARG  85          2HB       ARG  85  -0.776  -6.562   5.535
  723   1HG   ARG  85          1HG       ARG  85   0.926  -8.181   5.345
  724   2HG   ARG  85          2HG       ARG  85   2.131  -7.074   6.054
  725   1HD   ARG  85          1HD       ARG  85   0.607  -6.882   8.097
  726   2HD   ARG  85          2HD       ARG  85  -0.388  -8.152   7.366
  727    HE   ARG  85           HE       ARG  85   1.883  -9.521   7.527
  728   1HH1  ARG  85          2HH2      ARG  85  -0.050  -8.183   9.920
  729   2HH1  ARG  85          1HH2      ARG  85   0.941  -8.440  11.288
  730   1HH2  ARG  85          2HH1      ARG  85   3.473  -9.921   9.167
  731   2HH2  ARG  85          1HH1      ARG  85   3.073  -9.557  10.830
  732    QB   ARG  85           QB       ARG  85  -0.294  -6.048   6.081
  733    QG   ARG  85           QG       ARG  85   1.529  -7.627   5.700
  734    QD   ARG  85           QD       ARG  85   0.110  -7.517   7.731
  735    QH1  ARG  85           QH2      ARG  85   0.446  -8.312  10.604
  736    QH2  ARG  85           QH1      ARG  85   3.273  -9.739   9.998
  737    H    ARG  86           H        ARG  86   2.385  -5.858   2.752
  738    HA   ARG  86           HA       ARG  86   0.632  -6.160   0.580
  739   1HB   ARG  86          1HB       ARG  86   3.349  -6.163   0.813
  740   2HB   ARG  86          2HB       ARG  86   3.056  -7.897   0.616
  741   1HG   ARG  86          1HG       ARG  86   3.343  -7.190  -1.567
  742   2HG   ARG  86          2HG       ARG  86   1.607  -7.179  -1.452
  743   1HD   ARG  86          1HD       ARG  86   2.881  -4.607  -0.576
  744   2HD   ARG  86          2HD       ARG  86   3.377  -5.103  -2.175
  745    HE   ARG  86           HE       ARG  86   0.848  -3.989  -1.386
  746   1HH1  ARG  86          2HH2      ARG  86   1.779  -6.559  -3.649
  747   2HH1  ARG  86          1HH2      ARG  86   1.639  -5.550  -5.032
  748   1HH2  ARG  86          2HH1      ARG  86  -0.364  -3.225  -3.166
  749   2HH2  ARG  86          1HH1      ARG  86  -0.171  -3.918  -4.740
  750    QB   ARG  86           QB       ARG  86   3.202  -7.030   0.714
  751    QG   ARG  86           QG       ARG  86   2.475  -7.184  -1.510
  752    QD   ARG  86           QD       ARG  86   3.129  -4.855  -1.376
  753    QH1  ARG  86           QH2      ARG  86   1.709  -6.054  -4.341
  754    QH2  ARG  86           QH1      ARG  86  -0.268  -3.572  -3.953
  755    H    VAL  87           H        VAL  87  -0.121  -8.085  -0.568
  756    HA   VAL  87           HA       VAL  87  -0.029 -10.622   0.969
  757    HB   VAL  87           HB       VAL  87  -2.279 -11.197   0.358
  758   1HG1  VAL  87          1HG1      VAL  87  -1.777 -10.094   2.556
  759   2HG1  VAL  87          2HG1      VAL  87  -2.224  -8.536   1.843
  760   3HG1  VAL  87          3HG1      VAL  87  -3.431  -9.834   1.985
  761   1HG2  VAL  87          1HG2      VAL  87  -2.602  -8.347  -0.656
  762   2HG2  VAL  87          2HG2      VAL  87  -2.678  -9.838  -1.626
  763   3HG2  VAL  87          3HG2      VAL  87  -3.906  -9.512  -0.404
  764    QG1  VAL  87           QG1      VAL  87  -2.477  -9.488   2.128
  765    QG2  VAL  87           QG2      VAL  87  -3.062  -9.232  -0.895
  766    QQG  VAL  87           QQG      VAL  87  -2.770  -9.360   0.616
  767    H    GLU  88           H        GLU  88  -0.170  -8.985  -2.241
  768    HA   GLU  88           HA       GLU  88   1.289 -11.305  -3.255
  769   1HB   GLU  88          1HB       GLU  88   0.017 -11.103  -5.419
  770   2HB   GLU  88          2HB       GLU  88  -0.900 -11.841  -4.093
  771   1HG   GLU  88          1HG       GLU  88  -2.087  -9.687  -3.734
  772   2HG   GLU  88          2HG       GLU  88  -1.182  -9.031  -5.109
  773    QB   GLU  88           QB       GLU  88  -0.441 -11.472  -4.756
  774    QG   GLU  88           QG       GLU  88  -1.635  -9.359  -4.422
   
  No H/Q in entry =         774
  Start of MODEL   10
    1   1HA   GLY   1          1HA       GLY   1  13.592  -7.413 -13.735
    2   2HA   GLY   1          2HA       GLY   1  12.254  -6.477 -14.428
    3    QA   GLY   1           QA       GLY   1  12.923  -6.945 -14.082
    4    H    ASP   2           H        ASP   2  12.405  -6.599 -11.691
    5    HA   ASP   2           HA       ASP   2  10.137  -8.422 -10.939
    6   1HB   ASP   2          1HB       ASP   2  11.408  -6.938  -8.717
    7   2HB   ASP   2          2HB       ASP   2  10.877  -8.592  -8.846
    8    QB   ASP   2           QB       ASP   2  11.142  -7.765  -8.782
    9    H    GLY   3           H        GLY   3  11.453  -5.186 -10.185
   10   1HA   GLY   3          1HA       GLY   3  10.215  -3.102 -10.431
   11   2HA   GLY   3          2HA       GLY   3   8.696  -4.007 -10.390
   12    QA   GLY   3           QA       GLY   3   9.456  -3.555 -10.410
   13    H    TYR   4           H        TYR   4   8.118  -2.624  -8.589
   14    HA   TYR   4           HA       TYR   4   8.842  -3.685  -5.986
   15   1HB   TYR   4          1HB       TYR   4   9.356  -1.234  -5.204
   16   2HB   TYR   4          2HB       TYR   4  10.623  -2.150  -5.973
   17    HD1  TYR   4          2HD       TYR   4   8.134   0.594  -6.543
   18    HD2  TYR   4          1HD       TYR   4  11.523  -1.559  -8.091
   19    HE1  TYR   4          2HE       TYR   4   8.401   2.294  -8.331
   20    HE2  TYR   4          1HE       TYR   4  11.833   0.185  -9.839
   21    HH   TYR   4           HH       TYR   4   9.758   3.046 -10.066
   22    QB   TYR   4           QB       TYR   4   9.990  -1.692  -5.588
   23    QG   TYR   4           QD       TYR   4   9.828  -0.482  -7.317
   24    QZ   TYR   4           QE       TYR   4  10.117   1.240  -9.085
   25    QR   TYR   4           QR       TYR   4   9.973   0.379  -8.201
   26    H    LEU   5           H        LEU   5   7.592  -2.663  -4.368
   27    HA   LEU   5           HA       LEU   5   5.343  -0.962  -5.197
   28   1HB   LEU   5          1HB       LEU   5   4.543  -3.280  -5.230
   29   2HB   LEU   5          2HB       LEU   5   5.098  -3.550  -3.585
   30    HG   LEU   5           HG       LEU   5   3.205  -1.244  -3.941
   31   1HD1  LEU   5          2HD1      LEU   5   2.270  -2.856  -5.578
   32   2HD1  LEU   5          3HD1      LEU   5   2.282  -4.121  -4.331
   33   3HD1  LEU   5          1HD1      LEU   5   1.224  -2.707  -4.158
   34   1HD2  LEU   5          1HD2      LEU   5   3.388  -3.646  -2.061
   35   2HD2  LEU   5          2HD2      LEU   5   3.841  -1.971  -1.685
   36   3HD2  LEU   5          3HD2      LEU   5   2.140  -2.411  -1.944
   37    QB   LEU   5           QB       LEU   5   4.821  -3.415  -4.407
   38    QD1  LEU   5           QD1      LEU   5   1.925  -3.228  -4.689
   39    QD2  LEU   5           QD2      LEU   5   3.123  -2.676  -1.896
   40    QQD  LEU   5           QQD      LEU   5   2.524  -2.952  -3.293
   41    H    ILE   6           H        ILE   6   5.516   0.823  -4.055
   42    HA   ILE   6           HA       ILE   6   6.520   0.791  -1.260
   43    HB   ILE   6           HB       ILE   6   7.732   2.896  -1.780
   44   1HG1  ILE   6          1HG1      ILE   6   7.129   2.219  -4.700
   45   2HG1  ILE   6          2HG1      ILE   6   6.495   3.602  -3.783
   46   1HG2  ILE   6          1HG2      ILE   6   8.859   0.658  -1.731
   47   2HG2  ILE   6          2HG2      ILE   6   8.807   0.643  -3.507
   48   3HG2  ILE   6          3HG2      ILE   6   9.697   1.919  -2.645
   49   1HD1  ILE   6          3HD1      ILE   6   8.923   4.340  -3.500
   50   2HD1  ILE   6          1HD1      ILE   6   9.323   3.066  -4.674
   51   3HD1  ILE   6          2HD1      ILE   6   8.266   4.403  -5.147
   52    QG1  ILE   6           QG1      ILE   6   6.812   2.911  -4.242
   53    QG2  ILE   6           QG2      ILE   6   9.121   1.073  -2.628
   54    QD1  ILE   6           QD1      ILE   6   8.838   3.936  -4.440
   55    H    MET   7           H        MET   7   5.930   3.109  -0.298
   56    HA   MET   7           HA       MET   7   3.878   4.388  -1.886
   57   1HB   MET   7          1HB       MET   7   2.619   4.887   0.157
   58   2HB   MET   7          2HB       MET   7   2.611   3.162  -0.272
   59   1HG   MET   7          1HG       MET   7   4.090   2.618   1.508
   60   2HG   MET   7          2HG       MET   7   4.421   4.331   1.827
   61   1HE   MET   7          3HE       MET   7   1.467   1.703   1.721
   62   2HE   MET   7          1HE       MET   7   0.225   2.587   2.640
   63   3HE   MET   7          2HE       MET   7   0.732   3.186   1.055
   64    QB   MET   7           QB       MET   7   2.615   4.025  -0.057
   65    QG   MET   7           QG       MET   7   4.255   3.475   1.667
   66    QE   MET   7           QE       MET   7   0.808   2.492   1.805
   67    H    CYS   8           H        CYS   8   3.506   6.526  -1.114
   68    HA   CYS   8           HA       CYS   8   6.067   7.933  -0.590
   69   1HB   CYS   8          1HB       CYS   8   4.262   8.102  -3.014
   70   2HB   CYS   8          2HB       CYS   8   5.617   9.185  -2.718
   71    QB   CYS   8           QB       CYS   8   4.939   8.644  -2.866
   72    H    LYS   9           H        LYS   9   5.769  10.212  -0.305
   73    HA   LYS   9           HA       LYS   9   3.528  11.007   1.149
   74   1HB   LYS   9          1HB       LYS   9   5.257  12.727  -0.659
   75   2HB   LYS   9          2HB       LYS   9   4.104  13.312   0.557
   76   1HG   LYS   9          1HG       LYS   9   5.418  11.932   2.289
   77   2HG   LYS   9          2HG       LYS   9   6.648  11.715   1.023
   78   1HD   LYS   9          1HD       LYS   9   6.402  14.309   0.711
   79   2HD   LYS   9          2HD       LYS   9   5.585  14.251   2.287
   80   1HE   LYS   9          1HE       LYS   9   7.647  14.432   3.239
   81   2HE   LYS   9          2HE       LYS   9   7.908  12.769   2.713
   82   1HZ   LYS   9          3HZ       LYS   9   8.778  13.753   0.591
   83   2HZ   LYS   9          1HZ       LYS   9   8.666  15.241   1.287
   84   3HZ   LYS   9          2HZ       LYS   9   9.670  14.072   1.926
   85    QB   LYS   9           QB       LYS   9   4.680  13.020  -0.051
   86    QG   LYS   9           QG       LYS   9   6.033  11.824   1.656
   87    QD   LYS   9           QD       LYS   9   5.994  14.280   1.499
   88    QE   LYS   9           QE       LYS   9   7.778  13.601   2.976
   89    QZ   LYS   9           QZ       LYS   9   9.038  14.355   1.268
   90    H    ASN  10           H        ASN  10   4.184  11.296  -2.314
   91    HA   ASN  10           HA       ASN  10   1.389  12.015  -2.973
   92   1HB   ASN  10          1HB       ASN  10   2.158  13.798  -4.419
   93   2HB   ASN  10          2HB       ASN  10   2.687  14.099  -2.784
   94   1HD2  ASN  10          2HD2      ASN  10   5.624  14.996  -4.685
   95   2HD2  ASN  10          1HD2      ASN  10   3.995  15.606  -4.479
   96    QB   ASN  10           QB       ASN  10   2.422  13.949  -3.601
   97    QD2  ASN  10           QD2      ASN  10   4.809  15.301  -4.582
   98    H    CYS  11           H        CYS  11   1.567  12.180  -5.581
   99    HA   CYS  11           HA       CYS  11   1.987   9.459  -6.380
  100   1HB   CYS  11          1HB       CYS  11   0.297  11.089  -7.134
  101   2HB   CYS  11          2HB       CYS  11   1.522  11.935  -8.081
  102    QB   CYS  11           QB       CYS  11   0.910  11.512  -7.608
  103    H    ASP  12           H        ASP  12   4.453  11.523  -5.841
  104    HA   ASP  12           HA       ASP  12   5.894  11.048  -8.390
  105   1HB   ASP  12          1HB       ASP  12   5.702  13.345  -7.431
  106   2HB   ASP  12          2HB       ASP  12   6.832  12.861  -6.171
  107    QB   ASP  12           QB       ASP  12   6.267  13.103  -6.801
  108    HA   PRO  13           HA       PRO  13   8.008   7.898  -5.803
  109   1HB   PRO  13          1HB       PRO  13   9.450   6.699  -7.828
  110   2HB   PRO  13          2HB       PRO  13   7.805   6.244  -7.337
  111   1HG   PRO  13          1HG       PRO  13   8.666   8.010  -9.631
  112   2HG   PRO  13          2HG       PRO  13   7.363   6.789  -9.608
  113   1HD   PRO  13          1HD       PRO  13   6.933   9.476  -9.398
  114   2HD   PRO  13          2HD       PRO  13   5.883   8.305  -8.550
  115    QB   PRO  13           QB       PRO  13   8.628   6.471  -7.582
  116    QG   PRO  13           QG       PRO  13   8.014   7.400  -9.620
  117    QD   PRO  13           QD       PRO  13   6.408   8.891  -8.974
  118    H    ASN  14           H        ASN  14   9.351  10.297  -8.094
  119    HA   ASN  14           HA       ASN  14  12.117   9.554  -7.440
  120   1HB   ASN  14          1HB       ASN  14  11.535  10.354  -9.740
  121   2HB   ASN  14          2HB       ASN  14  11.100  11.922  -9.054
  122   1HD2  ASN  14          2HD2      ASN  14  15.056  10.898  -9.504
  123   2HD2  ASN  14          1HD2      ASN  14  13.772   9.820  -9.983
  124    QB   ASN  14           QB       ASN  14  11.318  11.138  -9.397
  125    QD2  ASN  14           QD2      ASN  14  14.414  10.359  -9.743
  126    H    THR  15           H        THR  15   9.871  12.261  -6.863
  127    HA   THR  15           HA       THR  15  11.735  13.236  -4.719
  128    HB   THR  15           HB       THR  15  12.017  14.493  -6.790
  129    HG1  THR  15          1HG       THR  15  12.430  15.621  -4.988
  130   1HG2  THR  15          1HG2      THR  15   9.086  15.235  -6.474
  131   2HG2  THR  15          2HG2      THR  15  10.257  16.096  -7.501
  132   3HG2  THR  15          3HG2      THR  15   9.879  14.407  -7.840
  133    QG2  THR  15           QG2      THR  15   9.741  15.246  -7.272
  134    H    GLY  16           H        GLY  16   9.000  11.651  -4.749
  135   1HA   GLY  16          1HA       GLY  16   7.370  13.311  -3.019
  136   2HA   GLY  16          2HA       GLY  16   7.272  11.560  -3.237
  137    QA   GLY  16           QA       GLY  16   7.321  12.436  -3.128
  138    H    SER  17           H        SER  17  10.004  11.005  -2.560
  139    HA   SER  17           HA       SER  17  11.179  10.253  -0.764
  140   1HB   SER  17          1HB       SER  17   9.406  11.645   1.236
  141   2HB   SER  17          2HB       SER  17  11.028  11.037   1.456
  142    HG   SER  17           HG       SER  17  11.842  12.822   0.647
  143    QB   SER  17           QB       SER  17  10.217  11.341   1.346
  144    H    CYS  18           H        CYS  18  10.660   8.070  -0.482
  145    HA   CYS  18           HA       CYS  18   7.867   7.338   0.044
  146   1HB   CYS  18          1HB       CYS  18   9.895   6.392  -2.019
  147   2HB   CYS  18          2HB       CYS  18   8.329   5.675  -1.794
  148    QB   CYS  18           QB       CYS  18   9.112   6.033  -1.906
  149    H    ASP  19           H        ASP  19   7.679   5.158   0.961
  150    HA   ASP  19           HA       ASP  19  10.206   4.328   2.285
  151   1HB   ASP  19          1HB       ASP  19   8.715   2.735   3.492
  152   2HB   ASP  19          2HB       ASP  19   8.643   4.490   3.804
  153    QB   ASP  19           QB       ASP  19   8.679   3.613   3.648
  154    H    TRP  20           H        TRP  20  11.376   3.640   0.712
  155    HA   TRP  20           HA       TRP  20  10.847   1.172  -0.841
  156   1HB   TRP  20          1HB       TRP  20  13.354   2.838  -0.513
  157   2HB   TRP  20          2HB       TRP  20  13.108   1.492  -1.615
  158    HD1  TRP  20           HD       TRP  20  12.224   5.171  -1.060
  159    HE1  TRP  20          1HE       TRP  20  11.767   6.281  -3.311
  160    HE3  TRP  20          3HE       TRP  20  12.122   0.984  -3.954
  161    HZ2  TRP  20          2HZ       TRP  20  11.365   5.433  -6.072
  162    HZ3  TRP  20          3HZ       TRP  20  11.793   1.161  -6.405
  163    HH2  TRP  20           HH       TRP  20  11.388   3.383  -7.473
  164    QB   TRP  20           QB       TRP  20  13.231   2.165  -1.064
  165    H    LYS  21           H        LYS  21  10.221   0.706   1.587
  166    HA   LYS  21           HA       LYS  21  12.544  -0.402   3.089
  167   1HB   LYS  21          1HB       LYS  21  10.628   1.530   3.856
  168   2HB   LYS  21          2HB       LYS  21  10.054   0.061   4.621
  169   1HG   LYS  21          1HG       LYS  21  12.843   1.305   4.873
  170   2HG   LYS  21          2HG       LYS  21  11.532   1.436   6.058
  171   1HD   LYS  21          1HD       LYS  21  11.504  -1.025   6.316
  172   2HD   LYS  21          2HD       LYS  21  12.935  -1.111   5.231
  173   1HE   LYS  21          1HE       LYS  21  14.206   0.287   6.833
  174   2HE   LYS  21          2HE       LYS  21  12.814   0.317   7.928
  175   1HZ   LYS  21          3HZ       LYS  21  14.141  -2.157   7.012
  176   2HZ   LYS  21          1HZ       LYS  21  14.528  -1.413   8.417
  177   3HZ   LYS  21          2HZ       LYS  21  13.014  -2.072   8.173
  178    QB   LYS  21           QB       LYS  21  10.341   0.795   4.239
  179    QG   LYS  21           QG       LYS  21  12.188   1.371   5.465
  180    QD   LYS  21           QD       LYS  21  12.219  -1.068   5.773
  181    QE   LYS  21           QE       LYS  21  13.510   0.302   7.381
  182    QZ   LYS  21           QZ       LYS  21  13.894  -1.881   7.867
  183    H    GLN  22           H        GLN  22  11.353  -2.120   4.714
  184    HA   GLN  22           HA       GLN  22  10.365  -4.271   3.096
  185   1HB   GLN  22          1HB       GLN  22  11.629  -4.257   5.333
  186   2HB   GLN  22          2HB       GLN  22  10.105  -3.838   6.094
  187   1HG   GLN  22          1HG       GLN  22   9.197  -6.071   5.363
  188   2HG   GLN  22          2HG       GLN  22  10.766  -6.374   4.570
  189   1HE2  GLN  22          2HE2      GLN  22  10.636  -6.363   8.699
  190   2HE2  GLN  22          1HE2      GLN  22   9.213  -5.934   7.777
  191    QB   GLN  22           QB       GLN  22  10.867  -4.047   5.713
  192    QG   GLN  22           QG       GLN  22   9.982  -6.222   4.967
  193    QE2  GLN  22           QE2      GLN  22   9.925  -6.148   8.238
  194    H    ASN  23           H        ASN  23   8.225  -4.943   3.048
  195    HA   ASN  23           HA       ASN  23   6.021  -2.984   3.418
  196   1HB   ASN  23          1HB       ASN  23   7.338  -3.566   0.771
  197   2HB   ASN  23          2HB       ASN  23   5.629  -3.115   0.879
  198   1HD2  ASN  23          2HD2      ASN  23   7.676   0.050   0.498
  199   2HD2  ASN  23          1HD2      ASN  23   7.399  -1.361  -0.520
  200    QB   ASN  23           QB       ASN  23   6.484  -3.340   0.825
  201    QD2  ASN  23           QD2      ASN  23   7.538  -0.655  -0.011
  202    H    TRP  24           H        TRP  24   7.093  -6.226   3.190
  203    HA   TRP  24           HA       TRP  24   4.397  -7.354   2.801
  204   1HB   TRP  24          1HB       TRP  24   5.719  -7.827   0.897
  205   2HB   TRP  24          2HB       TRP  24   7.189  -7.878   1.781
  206    HD1  TRP  24           HD       TRP  24   8.107  -9.937   2.659
  207    HE1  TRP  24          1HE       TRP  24   7.790 -12.406   1.890
  208    HE3  TRP  24          3HE       TRP  24   3.448  -9.536   0.654
  209    HZ2  TRP  24          2HZ       TRP  24   5.869 -13.857   0.234
  210    HZ3  TRP  24          3HZ       TRP  24   2.303 -11.526  -0.185
  211    HH2  TRP  24           HH       TRP  24   3.541 -13.600  -0.669
  212    QB   TRP  24           QB       TRP  24   6.454  -7.852   1.339
  213    H    ASN  25           H        ASN  25   4.333  -9.364   4.160
  214    HA   ASN  25           HA       ASN  25   4.314 -10.188   6.358
  215   1HB   ASN  25          1HB       ASN  25   6.961 -10.776   5.055
  216   2HB   ASN  25          2HB       ASN  25   6.454 -11.526   6.578
  217   1HD2  ASN  25          2HD2      ASN  25   4.293 -13.829   5.065
  218   2HD2  ASN  25          1HD2      ASN  25   5.156 -13.318   6.513
  219    QB   ASN  25           QB       ASN  25   6.707 -11.151   5.817
  220    QD2  ASN  25           QD2      ASN  25   4.724 -13.574   5.789
  221    H    THR  26           H        THR  26   4.304  -7.757   7.152
  222    HA   THR  26           HA       THR  26   5.395  -8.012   9.704
  223    HB   THR  26           HB       THR  26   6.459  -5.407   8.949
  224    HG1  THR  26          1HG       THR  26   7.652  -7.602   7.643
  225   1HG2  THR  26          1HG2      THR  26   7.021  -6.623  11.028
  226   2HG2  THR  26          2HG2      THR  26   7.874  -7.851  10.076
  227   3HG2  THR  26          3HG2      THR  26   8.464  -6.181  10.109
  228    QG2  THR  26           QG2      THR  26   7.786  -6.885  10.404
  229    H    CYS  27           H        CYS  27   4.950  -5.527  10.788
  230    HA   CYS  27           HA       CYS  27   2.475  -4.518   9.672
  231   1HB   CYS  27          1HB       CYS  27   2.255  -5.849  11.823
  232   2HB   CYS  27          2HB       CYS  27   3.359  -4.686  12.563
  233    QB   CYS  27           QB       CYS  27   2.807  -5.268  12.193
  234    H    VAL  28           H        VAL  28   2.454  -2.144   9.459
  235    HA   VAL  28           HA       VAL  28   4.565  -0.624  10.812
  236    HB   VAL  28           HB       VAL  28   4.278  -0.659   7.765
  237   1HG1  VAL  28          1HG1      VAL  28   6.075   0.997   9.584
  238   2HG1  VAL  28          2HG1      VAL  28   6.201   0.927   7.816
  239   3HG1  VAL  28          3HG1      VAL  28   4.757   1.605   8.557
  240   1HG2  VAL  28          3HG2      VAL  28   6.645  -1.580   9.469
  241   2HG2  VAL  28          1HG2      VAL  28   5.632  -2.602   8.432
  242   3HG2  VAL  28          2HG2      VAL  28   6.666  -1.361   7.724
  243    QG1  VAL  28           QG1      VAL  28   5.678   1.176   8.652
  244    QG2  VAL  28           QG2      VAL  28   6.314  -1.848   8.541
  245    QQG  VAL  28           QQG      VAL  28   5.996  -0.336   8.597
  246    H    GLY  29           H        GLY  29   3.773   1.457  11.266
  247   1HA   GLY  29          1HA       GLY  29   1.082   2.127  10.471
  248   2HA   GLY  29          2HA       GLY  29   2.007   2.816  11.783
  249    QA   GLY  29           QA       GLY  29   1.544   2.472  11.127
  250    H    ILE  30           H        ILE  30   0.573   3.980   9.357
  251    HA   ILE  30           HA       ILE  30   2.691   5.596   7.993
  252    HB   ILE  30           HB       ILE  30   0.019   4.567   6.944
  253   1HG1  ILE  30          1HG1      ILE  30   1.582   3.079   5.459
  254   2HG1  ILE  30          2HG1      ILE  30   2.737   3.194   6.853
  255   1HG2  ILE  30          3HG2      ILE  30   2.387   5.803   5.508
  256   2HG2  ILE  30          1HG2      ILE  30   0.943   5.116   4.727
  257   3HG2  ILE  30          2HG2      ILE  30   0.775   6.541   5.707
  258   1HD1  ILE  30          2HD1      ILE  30  -0.016   2.244   6.753
  259   2HD1  ILE  30          3HD1      ILE  30   1.473   1.234   6.821
  260   3HD1  ILE  30          1HD1      ILE  30   1.102   2.249   8.180
  261    QG1  ILE  30           QG1      ILE  30   2.160   3.136   6.156
  262    QG2  ILE  30           QG2      ILE  30   1.368   5.820   5.314
  263    QD1  ILE  30           QD1      ILE  30   0.853   1.909   7.251
  264    H    GLY  31           H        GLY  31   1.751   7.739   7.206
  265   1HA   GLY  31          1HA       GLY  31  -0.725   8.504   7.115
  266   2HA   GLY  31          2HA       GLY  31  -0.465   8.836   8.841
  267    QA   GLY  31           QA       GLY  31  -0.595   8.670   7.978
  268    H    ALA  32           H        ALA  32  -1.163  10.834   7.662
  269    HA   ALA  32           HA       ALA  32  -0.824  13.027   7.395
  270   1HB   ALA  32          2HB       ALA  32   0.258  12.777   9.580
  271   2HB   ALA  32          3HB       ALA  32   1.818  12.438   8.799
  272   3HB   ALA  32          1HB       ALA  32   1.069  14.037   8.628
  273    QB   ALA  32           QB       ALA  32   1.048  13.084   9.002
  274    H    ASN  33           H        ASN  33  -0.870  13.286   5.286
  275    HA   ASN  33           HA       ASN  33  -0.288  13.723   3.203
  276   1HB   ASN  33          1HB       ASN  33   0.939  15.490   2.837
  277   2HB   ASN  33          2HB       ASN  33   1.067  15.596   4.586
  278   1HD2  ASN  33          2HD2      ASN  33   4.594  14.479   4.488
  279   2HD2  ASN  33          1HD2      ASN  33   3.122  14.042   5.331
  280    QB   ASN  33           QB       ASN  33   1.003  15.543   3.712
  281    QD2  ASN  33           QD2      ASN  33   3.858  14.261   4.909
  282    H    VAL  34           H        VAL  34   0.370  11.128   4.356
  283    HA   VAL  34           HA       VAL  34   1.876  10.156   1.968
  284    HB   VAL  34           HB       VAL  34   1.712   8.976   4.768
  285   1HG1  VAL  34          3HG1      VAL  34   3.029   7.896   2.222
  286   2HG1  VAL  34          1HG1      VAL  34   3.203   7.185   3.826
  287   3HG1  VAL  34          2HG1      VAL  34   1.622   7.188   3.039
  288   1HG2  VAL  34          1HG2      VAL  34   3.414  10.788   4.583
  289   2HG2  VAL  34          2HG2      VAL  34   4.163   9.203   4.819
  290   3HG2  VAL  34          3HG2      VAL  34   4.150   9.941   3.208
  291    QG1  VAL  34           QG1      VAL  34   2.618   7.423   3.029
  292    QG2  VAL  34           QG2      VAL  34   3.909   9.978   4.203
  293    QQG  VAL  34           QQG      VAL  34   3.263   8.700   3.616
  294    H    HIS  35           H        HIS  35   0.199   9.846   0.635
  295    HA   HIS  35           HA       HIS  35  -1.567   7.670   1.443
  296   1HB   HIS  35          1HB       HIS  35  -3.651   8.628   0.899
  297   2HB   HIS  35          2HB       HIS  35  -2.939   9.623   2.160
  298    HD1  HIS  35          1HD       HIS  35  -4.845   9.832  -0.850
  299    HD2  HIS  35          2HD       HIS  35  -1.651  11.997   0.840
  300    HE1  HIS  35          1HE       HIS  35  -4.939  12.196  -1.855
  301    QB   HIS  35           QB       HIS  35  -3.295   9.125   1.530
  302    H    TRP  36           H        TRP  36   0.633   7.827  -0.430
  303    HA   TRP  36           HA       TRP  36  -0.939   7.078  -2.884
  304   1HB   TRP  36          1HB       TRP  36   1.495   8.807  -2.711
  305   2HB   TRP  36          2HB       TRP  36   0.864   8.129  -4.202
  306    HD1  TRP  36           HD       TRP  36  -0.328  10.583  -1.445
  307    HE1  TRP  36          1HE       TRP  36  -2.123  12.076  -2.353
  308    HE3  TRP  36          3HE       TRP  36  -0.836   8.404  -5.971
  309    HZ2  TRP  36          2HZ       TRP  36  -3.406  12.542  -4.983
  310    HZ3  TRP  36          3HZ       TRP  36  -2.404   9.357  -7.692
  311    HH2  TRP  36           HH       TRP  36  -3.653  11.443  -7.206
  312    QB   TRP  36           QB       TRP  36   1.180   8.468  -3.456
  313    H    MET  37           H        MET  37  -0.586   5.098  -3.235
  314    HA   MET  37           HA       MET  37   1.974   3.751  -2.530
  315   1HB   MET  37          1HB       MET  37   0.054   2.497  -1.964
  316   2HB   MET  37          2HB       MET  37  -0.690   2.720  -3.561
  317   1HG   MET  37          1HG       MET  37   0.561   1.094  -4.545
  318   2HG   MET  37          2HG       MET  37   1.967   1.339  -3.514
  319   1HE   MET  37          3HE       MET  37   2.506   0.201  -1.354
  320   2HE   MET  37          1HE       MET  37   1.155   1.073  -0.605
  321   3HE   MET  37          2HE       MET  37   1.320  -0.676  -0.356
  322    QB   MET  37           QB       MET  37  -0.318   2.609  -2.762
  323    QG   MET  37           QG       MET  37   1.264   1.217  -4.030
  324    QE   MET  37           QE       MET  37   1.660   0.199  -0.772
  325    H    VAL  38           H        VAL  38   3.404   3.068  -4.212
  326    HA   VAL  38           HA       VAL  38   2.641   3.742  -6.991
  327    HB   VAL  38           HB       VAL  38   5.327   4.638  -5.902
  328   1HG1  VAL  38          3HG1      VAL  38   4.926   4.453  -8.385
  329   2HG1  VAL  38          1HG1      VAL  38   3.596   5.618  -8.221
  330   3HG1  VAL  38          2HG1      VAL  38   5.249   6.118  -7.856
  331   1HG2  VAL  38          1HG2      VAL  38   2.791   6.345  -5.989
  332   2HG2  VAL  38          2HG2      VAL  38   3.734   5.934  -4.537
  333   3HG2  VAL  38          3HG2      VAL  38   4.432   6.970  -5.785
  334    QG1  VAL  38           QG1      VAL  38   4.591   5.396  -8.154
  335    QG2  VAL  38           QG2      VAL  38   3.653   6.416  -5.437
  336    QQG  VAL  38           QQG      VAL  38   4.122   5.906  -6.795
  337    H    THR  39           H        THR  39   3.316   2.121  -8.366
  338    HA   THR  39           HA       THR  39   5.439   0.305  -7.472
  339    HB   THR  39           HB       THR  39   3.633  -0.789  -6.376
  340    HG1  THR  39          1HG       THR  39   4.769  -2.215  -7.698
  341   1HG2  THR  39          2HG2      THR  39   1.948   0.064  -8.673
  342   2HG2  THR  39          3HG2      THR  39   1.484  -1.319  -7.648
  343   3HG2  THR  39          1HG2      THR  39   1.746   0.289  -6.933
  344    QG2  THR  39           QG2      THR  39   1.726  -0.322  -7.751
  345    H    GLY  40           H        GLY  40   6.360  -0.862  -9.167
  346   1HA   GLY  40          1HA       GLY  40   5.909  -1.304 -11.758
  347   2HA   GLY  40          2HA       GLY  40   5.866   0.459 -11.780
  348    QA   GLY  40           QA       GLY  40   5.888  -0.422 -11.769
  349    H    GLY  41           H        GLY  41   7.587   0.933 -12.790
  350   1HA   GLY  41          1HA       GLY  41   9.848   1.573 -12.937
  351   2HA   GLY  41          2HA       GLY  41  10.314   0.256 -11.836
  352    QA   GLY  41           QA       GLY  41  10.081   0.915 -12.386
  353    H    SER  42           H        SER  42   9.266  -1.880 -12.525
  354    HA   SER  42           HA       SER  42  10.729  -2.481 -14.979
  355   1HB   SER  42          1HB       SER  42   9.747  -4.189 -12.702
  356   2HB   SER  42          2HB       SER  42  10.969  -4.600 -13.896
  357    HG   SER  42           HG       SER  42  12.436  -3.494 -12.818
  358    QB   SER  42           QB       SER  42  10.358  -4.394 -13.299
  359    H    THR  43           H        THR  43   9.684  -5.116 -15.335
  360    HA   THR  43           HA       THR  43   7.627  -4.321 -17.276
  361    HB   THR  43           HB       THR  43   8.965  -6.263 -18.440
  362    HG1  THR  43          1HG       THR  43  10.260  -7.191 -17.006
  363   1HG2  THR  43          3HG2      THR  43  10.392  -3.686 -17.617
  364   2HG2  THR  43          1HG2      THR  43  10.813  -4.699 -18.991
  365   3HG2  THR  43          2HG2      THR  43   9.258  -3.856 -18.974
  366    QG2  THR  43           QG2      THR  43  10.154  -4.081 -18.527
  367    H    ASP  44           H        ASP  44   8.753  -7.545 -16.296
  368    HA   ASP  44           HA       ASP  44   6.048  -8.637 -16.224
  369   1HB   ASP  44          1HB       ASP  44   7.451 -10.680 -15.513
  370   2HB   ASP  44          2HB       ASP  44   7.635 -10.108 -17.158
  371    QB   ASP  44           QB       ASP  44   7.543 -10.394 -16.335
  372    H    GLY  45           H        GLY  45   5.413  -7.147 -14.449
  373   1HA   GLY  45          1HA       GLY  45   6.775  -7.508 -11.850
  374   2HA   GLY  45          2HA       GLY  45   5.683  -6.200 -12.307
  375    QA   GLY  45           QA       GLY  45   6.229  -6.854 -12.079
  376    H    LYS  46           H        LYS  46   3.583  -7.500 -13.233
  377    HA   LYS  46           HA       LYS  46   1.616  -8.395 -12.739
  378   1HB   LYS  46          1HB       LYS  46   2.889  -9.856 -10.419
  379   2HB   LYS  46          2HB       LYS  46   1.269 -10.060 -11.117
  380   1HG   LYS  46          1HG       LYS  46   2.270 -10.664 -13.278
  381   2HG   LYS  46          2HG       LYS  46   3.882 -10.594 -12.512
  382   1HD   LYS  46          1HD       LYS  46   3.262 -12.351 -10.917
  383   2HD   LYS  46          2HD       LYS  46   1.639 -12.450 -11.611
  384   1HE   LYS  46          1HE       LYS  46   4.292 -13.169 -12.960
  385   2HE   LYS  46          2HE       LYS  46   3.005 -14.274 -12.502
  386   1HZ   LYS  46          1HZ       LYS  46   1.608 -13.111 -14.174
  387   2HZ   LYS  46          2HZ       LYS  46   2.965 -12.218 -14.605
  388   3HZ   LYS  46          3HZ       LYS  46   2.975 -13.842 -14.793
  389    QB   LYS  46           QB       LYS  46   2.079  -9.958 -10.768
  390    QG   LYS  46           QG       LYS  46   3.076 -10.629 -12.895
  391    QD   LYS  46           QD       LYS  46   2.451 -12.401 -11.264
  392    QE   LYS  46           QE       LYS  46   3.648 -13.721 -12.731
  393    QZ   LYS  46           QZ       LYS  46   2.516 -13.057 -14.524
  394    H    GLN  47           H        GLN  47  -0.055  -7.397 -11.686
  395    HA   GLN  47           HA       GLN  47   0.575  -5.289  -9.934
  396   1HB   GLN  47          1HB       GLN  47  -1.830  -5.007  -9.669
  397   2HB   GLN  47          2HB       GLN  47  -1.403  -5.369 -11.372
  398   1HG   GLN  47          1HG       GLN  47  -2.243  -7.661 -11.064
  399   2HG   GLN  47          2HG       GLN  47  -2.769  -7.180  -9.431
  400   1HE2  GLN  47          2HE2      GLN  47  -5.587  -6.536 -11.916
  401   2HE2  GLN  47          1HE2      GLN  47  -4.625  -7.985 -11.559
  402    QB   GLN  47           QB       GLN  47  -1.616  -5.188 -10.520
  403    QG   GLN  47           QG       GLN  47  -2.506  -7.420 -10.247
  404    QE2  GLN  47           QE2      GLN  47  -5.106  -7.260 -11.737
  405    H    GLY  48           H        GLY  48   0.289  -4.932  -7.739
  406   1HA   GLY  48          1HA       GLY  48   0.571  -7.409  -6.061
  407   2HA   GLY  48          2HA       GLY  48   1.273  -5.819  -5.725
  408    QA   GLY  48           QA       GLY  48   0.922  -6.614  -5.893
  409    H    CYS  49           H        CYS  49  -0.676  -7.392  -4.021
  410    HA   CYS  49           HA       CYS  49  -2.642  -5.198  -3.786
  411   1HB   CYS  49          1HB       CYS  49  -3.106  -8.162  -3.362
  412   2HB   CYS  49          2HB       CYS  49  -4.275  -6.934  -2.975
  413    QB   CYS  49           QB       CYS  49  -3.691  -7.548  -3.169
  414    H    ALA  50           H        ALA  50  -3.401  -4.889  -1.715
  415    HA   ALA  50           HA       ALA  50  -1.709  -5.896   0.453
  416   1HB   ALA  50          2HB       ALA  50  -1.988  -2.923  -0.294
  417   2HB   ALA  50          3HB       ALA  50  -1.165  -3.529   1.151
  418   3HB   ALA  50          1HB       ALA  50  -0.486  -3.853  -0.460
  419    QB   ALA  50           QB       ALA  50  -1.213  -3.435   0.132
  420    H    THR  51           H        THR  51  -2.659  -5.953   2.349
  421    HA   THR  51           HA       THR  51  -5.511  -5.084   2.421
  422    HB   THR  51           HB       THR  51  -3.887  -6.743   4.394
  423    HG1  THR  51          1HG       THR  51  -4.444  -7.689   2.323
  424   1HG2  THR  51          2HG2      THR  51  -6.875  -6.097   4.249
  425   2HG2  THR  51          3HG2      THR  51  -6.112  -7.217   5.399
  426   3HG2  THR  51          1HG2      THR  51  -5.743  -5.486   5.482
  427    QG2  THR  51           QG2      THR  51  -6.243  -6.267   5.043
  428    H    ILE  52           H        ILE  52  -5.796  -3.095   3.040
  429    HA   ILE  52           HA       ILE  52  -3.730  -1.681   4.611
  430    HB   ILE  52           HB       ILE  52  -6.193  -0.542   3.249
  431   1HG1  ILE  52          1HG1      ILE  52  -3.406  -0.979   2.103
  432   2HG1  ILE  52          2HG1      ILE  52  -4.950  -1.550   1.447
  433   1HG2  ILE  52          3HG2      ILE  52  -5.018   0.768   5.047
  434   2HG2  ILE  52          1HG2      ILE  52  -3.561   0.761   4.038
  435   3HG2  ILE  52          2HG2      ILE  52  -5.024   1.565   3.467
  436   1HD1  ILE  52          2HD1      ILE  52  -5.626   0.839   1.061
  437   2HD1  ILE  52          3HD1      ILE  52  -3.976   1.334   1.519
  438   3HD1  ILE  52          1HD1      ILE  52  -4.226   0.307   0.113
  439    QG1  ILE  52           QG1      ILE  52  -4.178  -1.265   1.775
  440    QG2  ILE  52           QG2      ILE  52  -4.534   1.031   4.184
  441    QD1  ILE  52           QD1      ILE  52  -4.609   0.827   0.898
  442    H    TRP  53           H        TRP  53  -4.450  -0.737   6.631
  443    HA   TRP  53           HA       TRP  53  -6.958  -1.837   7.793
  444   1HB   TRP  53          1HB       TRP  53  -4.153  -1.845   8.847
  445   2HB   TRP  53          2HB       TRP  53  -5.503  -1.761   9.972
  446    HD1  TRP  53           HD       TRP  53  -7.066  -3.859  10.252
  447    HE1  TRP  53          1HE       TRP  53  -6.715  -6.341   9.834
  448    HE3  TRP  53          3HE       TRP  53  -2.962  -3.571   7.217
  449    HZ2  TRP  53          2HZ       TRP  53  -4.904  -8.025   8.308
  450    HZ3  TRP  53          3HZ       TRP  53  -1.963  -5.637   6.271
  451    HH2  TRP  53           HH       TRP  53  -2.972  -7.855   6.760
  452    QB   TRP  53           QB       TRP  53  -4.828  -1.803   9.409
  453    H    GLU  54           H        GLU  54  -7.982  -0.571   9.295
  454    HA   GLU  54           HA       GLU  54  -7.626   2.320   9.151
  455   1HB   GLU  54          1HB       GLU  54  -9.796   1.020   9.206
  456   2HB   GLU  54          2HB       GLU  54  -9.446   0.574  10.878
  457   1HG   GLU  54          1HG       GLU  54  -9.642   2.925  11.548
  458   2HG   GLU  54          2HG       GLU  54  -9.832   3.415   9.852
  459    QB   GLU  54           QB       GLU  54  -9.621   0.797  10.042
  460    QG   GLU  54           QG       GLU  54  -9.737   3.170  10.700
  461    H    GLY  55           H        GLY  55  -7.188  -0.351  11.523
  462   1HA   GLY  55          1HA       GLY  55  -6.700   1.180  13.795
  463   2HA   GLY  55          2HA       GLY  55  -6.111  -0.442  13.560
  464    QA   GLY  55           QA       GLY  55  -6.405   0.369  13.677
  465    H    SER  56           H        SER  56  -4.902   1.884  14.831
  466    HA   SER  56           HA       SER  56  -2.437   2.505  13.382
  467   1HB   SER  56          1HB       SER  56  -3.069   2.555  16.378
  468   2HB   SER  56          2HB       SER  56  -1.705   3.334  15.571
  469    HG   SER  56           HG       SER  56  -4.473   3.892  15.051
  470    QB   SER  56           QB       SER  56  -2.387   2.944  15.975
  471    H    GLY  57           H        GLY  57  -1.266   0.664  12.777
  472   1HA   GLY  57          1HA       GLY  57   0.286  -0.946  13.266
  473   2HA   GLY  57          2HA       GLY  57  -0.362  -1.075  14.899
  474    QA   GLY  57           QA       GLY  57  -0.038  -1.010  14.083
  475    H    CYS  58           H        CYS  58  -1.862  -1.214  11.709
  476    HA   CYS  58           HA       CYS  58  -3.110  -2.769  10.600
  477   1HB   CYS  58          1HB       CYS  58  -1.928  -4.750  10.020
  478   2HB   CYS  58          2HB       CYS  58  -0.769  -3.424  10.089
  479    QB   CYS  58           QB       CYS  58  -1.349  -4.087  10.054
  480    H    VAL  59           H        VAL  59  -4.373  -2.429  12.963
  481    HA   VAL  59           HA       VAL  59  -5.585  -5.102  13.345
  482    HB   VAL  59           HB       VAL  59  -6.206  -4.206  15.615
  483   1HG1  VAL  59          1HG1      VAL  59  -4.535  -5.981  15.326
  484   2HG1  VAL  59          2HG1      VAL  59  -3.254  -4.770  15.141
  485   3HG1  VAL  59          3HG1      VAL  59  -4.107  -4.927  16.686
  486   1HG2  VAL  59          2HG2      VAL  59  -5.655  -1.834  15.344
  487   2HG2  VAL  59          3HG2      VAL  59  -4.794  -2.550  16.710
  488   3HG2  VAL  59          1HG2      VAL  59  -3.926  -2.235  15.205
  489    QG1  VAL  59           QG1      VAL  59  -3.965  -5.226  15.718
  490    QG2  VAL  59           QG2      VAL  59  -4.792  -2.206  15.753
  491    QQG  VAL  59           QQG      VAL  59  -4.379  -3.716  15.735
  492    H    GLY  60           H        GLY  60  -7.944  -4.657  14.163
  493   1HA   GLY  60          1HA       GLY  60  -9.929  -3.388  14.039
  494   2HA   GLY  60          2HA       GLY  60  -9.000  -2.050  13.388
  495    QA   GLY  60           QA       GLY  60  -9.465  -2.719  13.714
  496    H    ARG  61           H        ARG  61 -10.162  -1.588  11.676
  497    HA   ARG  61           HA       ARG  61 -11.575  -3.587  10.003
  498   1HB   ARG  61          1HB       ARG  61 -12.544  -1.400  10.984
  499   2HB   ARG  61          2HB       ARG  61 -11.334  -0.557  10.023
  500   1HG   ARG  61          1HG       ARG  61 -12.472  -1.486   7.936
  501   2HG   ARG  61          2HG       ARG  61 -13.773  -2.056   9.025
  502   1HD   ARG  61          1HD       ARG  61 -13.807   0.317  10.014
  503   2HD   ARG  61          2HD       ARG  61 -12.631   0.775   8.769
  504    HE   ARG  61           HE       ARG  61 -14.765  -0.262   7.361
  505   1HH1  ARG  61          2HH2      ARG  61 -13.820   2.489   9.381
  506   2HH1  ARG  61          1HH2      ARG  61 -15.163   3.489   8.997
  507   1HH2  ARG  61          2HH1      ARG  61 -16.462   1.135   6.597
  508   2HH2  ARG  61          1HH1      ARG  61 -16.612   2.762   7.189
  509    QB   ARG  61           QB       ARG  61 -11.939  -0.979  10.504
  510    QG   ARG  61           QG       ARG  61 -13.122  -1.771   8.480
  511    QD   ARG  61           QD       ARG  61 -13.219   0.546   9.391
  512    QH1  ARG  61           QH2      ARG  61 -14.492   2.989   9.189
  513    QH2  ARG  61           QH1      ARG  61 -16.537   1.948   6.893
  514    H    SER  62           H        SER  62 -11.234  -3.917   7.831
  515    HA   SER  62           HA       SER  62  -8.750  -2.756   6.878
  516   1HB   SER  62          1HB       SER  62  -8.146  -5.140   6.117
  517   2HB   SER  62          2HB       SER  62  -8.026  -4.782   7.823
  518    HG   SER  62           HG       SER  62  -9.265  -6.774   7.072
  519    QB   SER  62           QB       SER  62  -8.086  -4.961   6.970
  520    H    THR  63           H        THR  63  -8.292  -3.297   4.598
  521    HA   THR  63           HA       THR  63 -10.551  -3.919   2.849
  522    HB   THR  63           HB       THR  63 -11.222  -1.736   3.277
  523    HG1  THR  63          1HG       THR  63  -9.615  -1.569   0.960
  524   1HG2  THR  63          1HG2      THR  63  -9.156  -0.870   4.449
  525   2HG2  THR  63          2HG2      THR  63  -8.415  -0.650   2.857
  526   3HG2  THR  63          3HG2      THR  63  -9.872   0.258   3.310
  527    QG2  THR  63           QG2      THR  63  -9.147  -0.420   3.539
  528    H    THR  64           H        THR  64  -9.595  -5.177   1.333
  529    HA   THR  64           HA       THR  64  -6.751  -5.012   0.765
  530    HB   THR  64           HB       THR  64  -8.017  -7.119   0.720
  531    HG1  THR  64          1HG       THR  64  -7.013  -7.759  -1.333
  532   1HG2  THR  64          1HG2      THR  64 -10.043  -6.159  -0.577
  533   2HG2  THR  64          2HG2      THR  64  -9.009  -6.312  -2.010
  534   3HG2  THR  64          3HG2      THR  64  -9.424  -7.742  -1.063
  535    QG2  THR  64           QG2      THR  64  -9.492  -6.737  -1.217
  536    H    MET  65           H        MET  65  -5.859  -3.470  -0.411
  537    HA   MET  65           HA       MET  65  -7.403  -2.302  -2.718
  538   1HB   MET  65          1HB       MET  65  -6.467  -0.707  -0.868
  539   2HB   MET  65          2HB       MET  65  -4.893  -1.095  -1.581
  540   1HG   MET  65          1HG       MET  65  -6.126  -0.460  -3.863
  541   2HG   MET  65          2HG       MET  65  -7.298   0.297  -2.793
  542   1HE   MET  65          3HE       MET  65  -3.931   0.395  -4.545
  543   2HE   MET  65          1HE       MET  65  -2.956   1.564  -3.633
  544   3HE   MET  65          2HE       MET  65  -3.338  -0.016  -2.917
  545    QB   MET  65           QB       MET  65  -5.680  -0.901  -1.224
  546    QG   MET  65           QG       MET  65  -6.712  -0.081  -3.328
  547    QE   MET  65           QE       MET  65  -3.408   0.647  -3.698
  548    H    CYS  66           H        CYS  66  -6.525  -2.644  -4.739
  549    HA   CYS  66           HA       CYS  66  -3.982  -4.216  -4.941
  550   1HB   CYS  66          1HB       CYS  66  -6.489  -4.302  -6.592
  551   2HB   CYS  66          2HB       CYS  66  -4.970  -5.041  -7.098
  552    QB   CYS  66           QB       CYS  66  -5.729  -4.671  -6.845
  553    H    CYS  67           H        CYS  67  -2.500  -3.567  -6.540
  554    HA   CYS  67           HA       CYS  67  -3.113  -1.114  -8.062
  555   1HB   CYS  67          1HB       CYS  67  -2.223  -0.598  -5.754
  556   2HB   CYS  67          2HB       CYS  67  -0.741  -1.436  -6.199
  557    QB   CYS  67           QB       CYS  67  -1.482  -1.017  -5.977
  558    HA   PRO  68           HA       PRO  68  -0.544  -3.609 -10.682
  559   1HB   PRO  68          1HB       PRO  68  -0.587  -2.039 -12.997
  560   2HB   PRO  68          2HB       PRO  68  -1.692  -3.361 -12.553
  561   1HG   PRO  68          1HG       PRO  68  -1.975  -0.394 -12.235
  562   2HG   PRO  68          2HG       PRO  68  -3.256  -1.586 -12.612
  563   1HD   PRO  68          1HD       PRO  68  -2.914  -0.428 -10.123
  564   2HD   PRO  68          2HD       PRO  68  -3.529  -2.082 -10.291
  565    QB   PRO  68           QB       PRO  68  -1.140  -2.700 -12.775
  566    QG   PRO  68           QG       PRO  68  -2.616  -0.990 -12.423
  567    QD   PRO  68           QD       PRO  68  -3.222  -1.255 -10.207
  568    H    ALA  69           H        ALA  69   1.312  -3.874 -11.659
  569    HA   ALA  69           HA       ALA  69   3.456  -2.129 -10.656
  570   1HB   ALA  69          3HB       ALA  69   3.473  -4.605 -12.444
  571   2HB   ALA  69          1HB       ALA  69   4.919  -3.751 -11.859
  572   3HB   ALA  69          2HB       ALA  69   3.824  -4.538 -10.704
  573    QB   ALA  69           QB       ALA  69   4.072  -4.298 -11.669
  574    H    ASN  70           H        ASN  70   3.492  -0.253 -11.652
  575    HA   ASN  70           HA       ASN  70   4.321   1.145 -13.373
  576   1HB   ASN  70          1HB       ASN  70   2.744  -0.520 -15.387
  577   2HB   ASN  70          2HB       ASN  70   3.499   1.029 -15.665
  578   1HD2  ASN  70          2HD2      ASN  70   5.987  -2.207 -15.571
  579   2HD2  ASN  70          1HD2      ASN  70   4.293  -2.358 -15.093
  580    QB   ASN  70           QB       ASN  70   3.121   0.255 -15.526
  581    QD2  ASN  70           QD2      ASN  70   5.140  -2.283 -15.332
  582    H    THR  71           H        THR  71   2.429   1.393 -11.320
  583    HA   THR  71           HA       THR  71   1.128   3.618 -12.590
  584    HB   THR  71           HB       THR  71  -0.534   1.632 -12.682
  585    HG1  THR  71          1HG       THR  71  -1.477   3.982 -11.383
  586   1HG2  THR  71          3HG2      THR  71  -0.370   0.894 -10.326
  587   2HG2  THR  71          1HG2      THR  71  -0.917   2.485  -9.781
  588   3HG2  THR  71          2HG2      THR  71  -2.008   1.463 -10.708
  589    QG2  THR  71           QG2      THR  71  -1.098   1.614 -10.272
  590    H    CYS  72           H        CYS  72   0.417   5.134 -11.192
  591    HA   CYS  72           HA       CYS  72   1.369   5.121  -8.368
  592   1HB   CYS  72          1HB       CYS  72   2.073   7.111  -9.426
  593   2HB   CYS  72          2HB       CYS  72   0.607   7.199 -10.422
  594    QB   CYS  72           QB       CYS  72   1.340   7.155  -9.924
  595    H    CYS  73           H        CYS  73  -0.188   5.105  -6.767
  596    HA   CYS  73           HA       CYS  73  -3.068   4.661  -7.480
  597   1HB   CYS  73          1HB       CYS  73  -1.150   2.942  -5.931
  598   2HB   CYS  73          2HB       CYS  73  -2.862   2.984  -5.512
  599    QB   CYS  73           QB       CYS  73  -2.006   2.963  -5.721
  600    H    ASN  74           H        ASN  74  -3.744   6.668  -6.717
  601    HA   ASN  74           HA       ASN  74  -3.087   7.795  -4.169
  602   1HB   ASN  74          1HB       ASN  74  -4.537   8.950  -5.833
  603   2HB   ASN  74          2HB       ASN  74  -5.793   7.737  -5.597
  604   1HD2  ASN  74          2HD2      ASN  74  -6.754   9.018  -2.375
  605   2HD2  ASN  74          1HD2      ASN  74  -6.984   7.702  -3.515
  606    QB   ASN  74           QB       ASN  74  -5.165   8.343  -5.715
  607    QD2  ASN  74           QD2      ASN  74  -6.869   8.360  -2.945
  608    H    ILE  75           H        ILE  75  -3.280   6.783  -2.155
  609    HA   ILE  75           HA       ILE  75  -5.339   4.779  -1.657
  610    HB   ILE  75           HB       ILE  75  -2.983   5.991  -0.233
  611   1HG1  ILE  75          1HG1      ILE  75  -2.640   3.646   0.361
  612   2HG1  ILE  75          2HG1      ILE  75  -4.165   3.204  -0.456
  613   1HG2  ILE  75          2HG2      ILE  75  -5.273   4.715   1.238
  614   2HG2  ILE  75          3HG2      ILE  75  -3.631   5.028   1.880
  615   3HG2  ILE  75          1HG2      ILE  75  -4.668   6.390   1.448
  616   1HD1  ILE  75          2HD1      ILE  75  -1.749   4.473  -1.745
  617   2HD1  ILE  75          3HD1      ILE  75  -2.128   2.732  -1.762
  618   3HD1  ILE  75          1HD1      ILE  75  -3.176   3.869  -2.621
  619    QG1  ILE  75           QG1      ILE  75  -3.402   3.425  -0.047
  620    QG2  ILE  75           QG2      ILE  75  -4.524   5.378   1.522
  621    QD1  ILE  75           QD1      ILE  75  -2.351   3.691  -2.043
  622    H    ASN  76           H        ASN  76  -7.299   5.257  -1.083
  623    HA   ASN  76           HA       ASN  76  -8.050   6.939   0.980
  624   1HB   ASN  76          1HB       ASN  76  -8.631   8.220  -1.733
  625   2HB   ASN  76          2HB       ASN  76  -9.774   8.347  -0.410
  626   1HD2  ASN  76          2HD2      ASN  76  -7.384  11.284  -0.349
  627   2HD2  ASN  76          1HD2      ASN  76  -8.189  10.564  -1.726
  628    QB   ASN  76           QB       ASN  76  -9.202   8.284  -1.072
  629    QD2  ASN  76           QD2      ASN  76  -7.786  10.924  -1.038
  630    H    THR  77           H        THR  77  -9.100   5.118   1.649
  631    HA   THR  77           HA       THR  77 -11.076   3.774  -0.098
  632    HB   THR  77           HB       THR  77 -11.124   2.272   2.042
  633    HG1  THR  77          1HG       THR  77  -9.966   3.796   3.419
  634   1HG2  THR  77          2HG2      THR  77  -9.923   1.726  -0.117
  635   2HG2  THR  77          3HG2      THR  77  -8.483   2.540   0.558
  636   3HG2  THR  77          1HG2      THR  77  -9.122   1.092   1.325
  637    QG2  THR  77           QG2      THR  77  -9.176   1.786   0.589
  638    H    GLY  78           H        GLY  78 -13.067   3.119   1.543
  639   1HA   GLY  78          1HA       GLY  78 -14.570   5.533   1.834
  640   2HA   GLY  78          2HA       GLY  78 -15.034   3.921   2.390
  641    QA   GLY  78           QA       GLY  78 -14.802   4.727   2.112
  642    H    PHE  79           H        PHE  79 -12.096   4.376   3.926
  643    HA   PHE  79           HA       PHE  79 -12.893   6.197   6.027
  644   1HB   PHE  79          1HB       PHE  79 -12.032   4.389   7.610
  645   2HB   PHE  79          2HB       PHE  79 -13.687   4.209   7.058
  646    HD1  PHE  79          1HD       PHE  79 -14.069   2.491   5.086
  647    HD2  PHE  79          2HD       PHE  79 -10.400   2.696   7.353
  648    HE1  PHE  79          1HE       PHE  79 -13.588   0.105   4.543
  649    HE2  PHE  79          2HE       PHE  79  -9.929   0.341   6.790
  650   1HZ   PHE  79           HZ       PHE  79 -11.577  -0.986   5.485
  651    QB   PHE  79           QB       PHE  79 -12.859   4.299   7.334
  652    QG   PHE  79           QD       PHE  79 -12.234   2.594   6.220
  653    QZ   PHE  79           QE       PHE  79 -11.759   0.223   5.666
  654    QZ   PHE  79           QR       PHE  79 -11.913   0.930   5.851
  655    H    TYR  80           H        TYR  80 -11.092   6.637   7.347
  656    HA   TYR  80           HA       TYR  80  -8.829   7.117   5.660
  657   1HB   TYR  80          1HB       TYR  80  -9.444   8.812   7.283
  658   2HB   TYR  80          2HB       TYR  80  -9.390   7.640   8.604
  659    HD1  TYR  80          1HD       TYR  80  -7.180   9.159   5.967
  660    HD2  TYR  80          2HD       TYR  80  -7.417   7.318   9.856
  661    HE1  TYR  80          1HE       TYR  80  -4.714   9.188   6.140
  662    HE2  TYR  80          2HE       TYR  80  -4.960   7.406  10.045
  663    HH   TYR  80           HH       TYR  80  -3.293   7.152   7.691
  664    QB   TYR  80           QB       TYR  80  -9.417   8.226   7.943
  665    QG   TYR  80           QD       TYR  80  -7.298   8.239   7.911
  666    QZ   TYR  80           QE       TYR  80  -4.837   8.297   8.093
  667    QR   TYR  80           QR       TYR  80  -6.068   8.268   8.002
  668    H    ILE  81           H        ILE  81  -6.734   6.062   5.842
  669    HA   ILE  81           HA       ILE  81  -6.854   3.452   7.162
  670    HB   ILE  81           HB       ILE  81  -5.082   2.986   5.394
  671   1HG1  ILE  81          1HG1      ILE  81  -5.193   5.521   4.700
  672   2HG1  ILE  81          2HG1      ILE  81  -5.053   4.259   3.518
  673   1HG2  ILE  81          1HG2      ILE  81  -8.110   3.129   5.051
  674   2HG2  ILE  81          2HG2      ILE  81  -7.069   2.315   3.872
  675   3HG2  ILE  81          3HG2      ILE  81  -7.131   1.755   5.550
  676   1HD1  ILE  81          3HD1      ILE  81  -7.819   5.224   4.246
  677   2HD1  ILE  81          1HD1      ILE  81  -6.798   6.097   3.100
  678   3HD1  ILE  81          2HD1      ILE  81  -7.239   4.387   2.812
  679    QG1  ILE  81           QG1      ILE  81  -5.123   4.890   4.109
  680    QG2  ILE  81           QG2      ILE  81  -7.437   2.400   4.824
  681    QD1  ILE  81           QD1      ILE  81  -7.285   5.236   3.386
  682    H    ARG  82           H        ARG  82  -4.988   2.804   8.397
  683    HA   ARG  82           HA       ARG  82  -2.783   4.829   8.582
  684   1HB   ARG  82          1HB       ARG  82  -4.631   4.827  10.487
  685   2HB   ARG  82          2HB       ARG  82  -3.675   3.455  11.086
  686   1HG   ARG  82          1HG       ARG  82  -1.616   4.916  10.890
  687   2HG   ARG  82          2HG       ARG  82  -2.655   6.256  10.373
  688   1HD   ARG  82          1HD       ARG  82  -3.799   6.178  12.578
  689   2HD   ARG  82          2HD       ARG  82  -2.790   4.776  13.009
  690    HE   ARG  82           HE       ARG  82  -1.115   6.964  12.192
  691   1HH1  ARG  82          2HH2      ARG  82  -2.916   5.800  15.008
  692   2HH1  ARG  82          1HH2      ARG  82  -2.078   6.822  16.131
  693   1HH2  ARG  82          2HH1      ARG  82   0.131   8.002  13.552
  694   2HH2  ARG  82          1HH1      ARG  82  -0.115   8.055  15.292
  695    QB   ARG  82           QB       ARG  82  -4.153   4.141  10.786
  696    QG   ARG  82           QG       ARG  82  -2.135   5.586  10.631
  697    QD   ARG  82           QD       ARG  82  -3.295   5.477  12.794
  698    QH1  ARG  82           QH2      ARG  82  -2.497   6.311  15.569
  699    QH2  ARG  82           QH1      ARG  82   0.008   8.028  14.422
  700    H    SER  83           H        SER  83  -3.460   1.424   8.322
  701    HA   SER  83           HA       SER  83  -0.487   1.079   8.322
  702   1HB   SER  83          1HB       SER  83  -2.184  -1.061   9.460
  703   2HB   SER  83          2HB       SER  83  -0.452  -0.837   9.607
  704    HG   SER  83           HG       SER  83  -2.502   0.713  10.865
  705    QB   SER  83           QB       SER  83  -1.318  -0.949   9.533
  706    H    TYR  84           H        TYR  84   0.113  -1.046   7.135
  707    HA   TYR  84           HA       TYR  84  -1.924  -2.302   5.639
  708   1HB   TYR  84          1HB       TYR  84  -1.422  -1.701   3.419
  709   2HB   TYR  84          2HB       TYR  84  -1.586  -0.153   4.222
  710    HD1  TYR  84          2HD       TYR  84   0.514   1.136   4.819
  711    HD2  TYR  84          1HD       TYR  84   0.617  -2.280   2.248
  712    HE1  TYR  84          2HE       TYR  84   3.013   1.116   4.957
  713    HE2  TYR  84          1HE       TYR  84   3.083  -2.246   2.275
  714    HH   TYR  84           HH       TYR  84   5.037  -0.928   3.176
  715    QB   TYR  84           QB       TYR  84  -1.504  -0.927   3.820
  716    QG   TYR  84           QD       TYR  84   0.565  -0.572   3.534
  717    QZ   TYR  84           QE       TYR  84   3.048  -0.565   3.616
  718    QR   TYR  84           QR       TYR  84   1.807  -0.568   3.575
  719    H    ARG  85           H        ARG  85  -1.020  -3.976   4.197
  720    HA   ARG  85           HA       ARG  85   1.807  -4.060   3.886
  721   1HB   ARG  85          1HB       ARG  85   1.067  -5.431   6.187
  722   2HB   ARG  85          2HB       ARG  85   0.949  -6.705   4.965
  723   1HG   ARG  85          1HG       ARG  85   3.106  -6.769   5.916
  724   2HG   ARG  85          2HG       ARG  85   3.269  -6.184   4.275
  725   1HD   ARG  85          1HD       ARG  85   3.498  -3.841   5.104
  726   2HD   ARG  85          2HD       ARG  85   3.164  -4.376   6.747
  727    HE   ARG  85           HE       ARG  85   5.316  -5.886   6.163
  728   1HH1  ARG  85          2HH2      ARG  85   4.842  -2.380   5.496
  729   2HH1  ARG  85          1HH2      ARG  85   6.550  -2.085   5.610
  730   1HH2  ARG  85          2HH1      ARG  85   7.416  -5.287   6.716
  731   2HH2  ARG  85          1HH1      ARG  85   7.907  -3.620   6.853
  732    QB   ARG  85           QB       ARG  85   1.008  -6.068   5.576
  733    QG   ARG  85           QG       ARG  85   3.188  -6.477   5.096
  734    QD   ARG  85           QD       ARG  85   3.331  -4.109   5.926
  735    QH1  ARG  85           QH2      ARG  85   5.696  -2.232   5.553
  736    QH2  ARG  85           QH1      ARG  85   7.662  -4.453   6.784
  737    H    ARG  86           H        ARG  86   2.462  -5.329   2.097
  738    HA   ARG  86           HA       ARG  86   0.299  -5.911   0.265
  739   1HB   ARG  86          1HB       ARG  86   1.941  -6.773  -1.277
  740   2HB   ARG  86          2HB       ARG  86   2.111  -5.086  -0.817
  741   1HG   ARG  86          1HG       ARG  86   3.984  -5.472   0.506
  742   2HG   ARG  86          2HG       ARG  86   3.708  -7.226   0.565
  743   1HD   ARG  86          1HD       ARG  86   4.286  -5.821  -2.070
  744   2HD   ARG  86          2HD       ARG  86   5.606  -6.128  -0.946
  745    HE   ARG  86           HE       ARG  86   3.771  -8.246  -2.072
  746   1HH1  ARG  86          2HH2      ARG  86   7.197  -7.224  -1.426
  747   2HH1  ARG  86          1HH2      ARG  86   7.713  -8.894  -1.556
  748   1HH2  ARG  86          2HH1      ARG  86   4.751 -10.208  -2.701
  749   2HH2  ARG  86          1HH1      ARG  86   6.494 -10.264  -2.843
  750    QB   ARG  86           QB       ARG  86   2.026  -5.929  -1.047
  751    QG   ARG  86           QG       ARG  86   3.846  -6.349   0.535
  752    QD   ARG  86           QD       ARG  86   4.946  -5.975  -1.508
  753    QH1  ARG  86           QH2      ARG  86   7.455  -8.059  -1.491
  754    QH2  ARG  86           QH1      ARG  86   5.623 -10.236  -2.772
  755    H    VAL  87           H        VAL  87  -0.538  -7.889  -0.309
  756    HA   VAL  87           HA       VAL  87  -0.002 -10.141   1.583
  757    HB   VAL  87           HB       VAL  87  -2.326 -10.859   1.046
  758   1HG1  VAL  87          2HG1      VAL  87  -1.658  -9.678   3.121
  759   2HG1  VAL  87          3HG1      VAL  87  -2.125  -8.135   2.382
  760   3HG1  VAL  87          1HG1      VAL  87  -3.339  -9.413   2.665
  761   1HG2  VAL  87          1HG2      VAL  87  -2.639  -9.498  -1.048
  762   2HG2  VAL  87          2HG2      VAL  87  -3.940  -9.302   0.142
  763   3HG2  VAL  87          3HG2      VAL  87  -2.716  -8.038  -0.038
  764    QG1  VAL  87           QG1      VAL  87  -2.374  -9.075   2.723
  765    QG2  VAL  87           QG2      VAL  87  -3.098  -8.946  -0.315
  766    QQG  VAL  87           QQG      VAL  87  -2.736  -9.011   1.204
  767    H    GLU  88           H        GLU  88   0.413  -9.187  -1.669
  768    HA   GLU  88           HA       GLU  88   1.473 -11.836  -2.099
  769   1HB   GLU  88          1HB       GLU  88   0.667 -12.320  -4.104
  770   2HB   GLU  88          2HB       GLU  88  -0.788 -11.650  -3.410
  771   1HG   GLU  88          1HG       GLU  88  -0.901 -10.051  -4.963
  772   2HG   GLU  88          2HG       GLU  88   0.779  -9.572  -4.846
  773    QB   GLU  88           QB       GLU  88  -0.061 -11.985  -3.757
  774    QG   GLU  88           QG       GLU  88  -0.061  -9.811  -4.905
   
  No H/Q in entry =         774
  Start of MODEL   11
    1   1HA   GLY   1          1HA       GLY   1  10.766  -8.735  -9.271
    2   2HA   GLY   1          2HA       GLY   1  10.258  -7.567  -8.038
    3    QA   GLY   1           QA       GLY   1  10.512  -8.151  -8.654
    4    H    ASP   2           H        ASP   2  12.911  -6.482  -7.696
    5    HA   ASP   2           HA       ASP   2  14.312  -4.857  -8.477
    6   1HB   ASP   2          1HB       ASP   2  13.411  -5.480 -11.338
    7   2HB   ASP   2          2HB       ASP   2  14.544  -4.260 -10.816
    8    QB   ASP   2           QB       ASP   2  13.977  -4.870 -11.077
    9    H    GLY   3           H        GLY   3  11.327  -4.781 -10.472
   10   1HA   GLY   3          1HA       GLY   3  10.443  -2.164  -9.674
   11   2HA   GLY   3          2HA       GLY   3   9.403  -3.519 -10.168
   12    QA   GLY   3           QA       GLY   3   9.923  -2.841  -9.921
   13    H    TYR   4           H        TYR   4   8.338  -2.027  -8.149
   14    HA   TYR   4           HA       TYR   4   8.784  -3.496  -5.624
   15   1HB   TYR   4          1HB       TYR   4   9.263  -1.226  -4.531
   16   2HB   TYR   4          2HB       TYR   4  10.553  -1.897  -5.497
   17    HD1  TYR   4          2HD       TYR   4   7.825   0.655  -5.470
   18    HD2  TYR   4          1HD       TYR   4  11.292  -0.801  -7.587
   19    HE1  TYR   4          2HE       TYR   4   7.900   2.741  -6.796
   20    HE2  TYR   4          1HE       TYR   4  11.266   1.224  -9.002
   21    HH   TYR   4           HH       TYR   4  10.012   3.098  -9.589
   22    QB   TYR   4           QB       TYR   4   9.908  -1.562  -5.014
   23    QG   TYR   4           QD       TYR   4   9.558  -0.073  -6.529
   24    QZ   TYR   4           QE       TYR   4   9.583   1.982  -7.899
   25    QR   TYR   4           QR       TYR   4   9.571   0.955  -7.214
   26    H    LEU   5           H        LEU   5   7.515  -2.496  -3.925
   27    HA   LEU   5           HA       LEU   5   5.136  -0.931  -4.750
   28   1HB   LEU   5          1HB       LEU   5   4.390  -3.225  -4.425
   29   2HB   LEU   5          2HB       LEU   5   5.186  -3.314  -2.852
   30    HG   LEU   5           HG       LEU   5   3.067  -1.203  -3.289
   31   1HD1  LEU   5          2HD1      LEU   5   2.621  -4.196  -3.013
   32   2HD1  LEU   5          3HD1      LEU   5   1.393  -3.025  -2.508
   33   3HD1  LEU   5          1HD1      LEU   5   1.932  -3.054  -4.185
   34   1HD2  LEU   5          3HD2      LEU   5   3.915  -2.956  -0.935
   35   2HD2  LEU   5          1HD2      LEU   5   4.157  -1.194  -1.111
   36   3HD2  LEU   5          2HD2      LEU   5   2.544  -1.859  -0.884
   37    QB   LEU   5           QB       LEU   5   4.788  -3.270  -3.639
   38    QD1  LEU   5           QD1      LEU   5   1.982  -3.425  -3.235
   39    QD2  LEU   5           QD2      LEU   5   3.539  -2.003  -0.977
   40    QQD  LEU   5           QQD      LEU   5   2.761  -2.714  -2.106
   41    H    ILE   6           H        ILE   6   5.676   0.988  -3.838
   42    HA   ILE   6           HA       ILE   6   6.680   1.026  -1.030
   43    HB   ILE   6           HB       ILE   6   7.786   3.156  -1.514
   44   1HG1  ILE   6          1HG1      ILE   6   7.052   2.659  -4.422
   45   2HG1  ILE   6          2HG1      ILE   6   6.590   4.010  -3.385
   46   1HG2  ILE   6          3HG2      ILE   6   9.000   0.988  -1.552
   47   2HG2  ILE   6          1HG2      ILE   6   8.949   1.019  -3.324
   48   3HG2  ILE   6          2HG2      ILE   6   9.780   2.313  -2.442
   49   1HD1  ILE   6          3HD1      ILE   6   9.075   4.576  -3.198
   50   2HD1  ILE   6          1HD1      ILE   6   9.346   3.379  -4.479
   51   3HD1  ILE   6          2HD1      ILE   6   8.342   4.800  -4.800
   52    QG1  ILE   6           QG1      ILE   6   6.821   3.335  -3.903
   53    QG2  ILE   6           QG2      ILE   6   9.243   1.440  -2.439
   54    QD1  ILE   6           QD1      ILE   6   8.921   4.251  -4.159
   55    H    MET   7           H        MET   7   5.913   3.159  -0.004
   56    HA   MET   7           HA       MET   7   3.613   4.277  -1.431
   57   1HB   MET   7          1HB       MET   7   2.497   4.640   0.670
   58   2HB   MET   7          2HB       MET   7   2.795   2.920   0.339
   59   1HG   MET   7          1HG       MET   7   4.520   2.838   1.994
   60   2HG   MET   7          2HG       MET   7   4.444   4.605   2.211
   61   1HE   MET   7          2HE       MET   7   2.051   1.512   2.165
   62   2HE   MET   7          3HE       MET   7   0.768   2.030   3.282
   63   3HE   MET   7          1HE       MET   7   0.974   2.866   1.742
   64    QB   MET   7           QB       MET   7   2.646   3.780   0.504
   65    QG   MET   7           QG       MET   7   4.482   3.722   2.103
   66    QE   MET   7           QE       MET   7   1.264   2.136   2.397
   67    H    CYS   8           H        CYS   8   3.187   6.402  -1.038
   68    HA   CYS   8           HA       CYS   8   5.752   7.900  -0.770
   69   1HB   CYS   8          1HB       CYS   8   3.842   7.638  -3.117
   70   2HB   CYS   8          2HB       CYS   8   4.995   8.977  -2.985
   71    QB   CYS   8           QB       CYS   8   4.419   8.307  -3.051
   72    H    LYS   9           H        LYS   9   5.584  10.120  -0.613
   73    HA   LYS   9           HA       LYS   9   3.323  11.234   0.801
   74   1HB   LYS   9          1HB       LYS   9   5.916  12.312  -0.382
   75   2HB   LYS   9          2HB       LYS   9   4.782  13.338   0.489
   76   1HG   LYS   9          1HG       LYS   9   5.721  10.741   1.771
   77   2HG   LYS   9          2HG       LYS   9   6.785  12.142   1.767
   78   1HD   LYS   9          1HD       LYS   9   3.924  12.455   2.667
   79   2HD   LYS   9          2HD       LYS   9   5.131  11.767   3.767
   80   1HE   LYS   9          1HE       LYS   9   6.458  13.701   3.825
   81   2HE   LYS   9          2HE       LYS   9   5.745  14.395   2.365
   82   1HZ   LYS   9          2HZ       LYS   9   3.989  14.005   4.662
   83   2HZ   LYS   9          3HZ       LYS   9   5.063  15.267   4.652
   84   3HZ   LYS   9          1HZ       LYS   9   3.966  15.133   3.462
   85    QB   LYS   9           QB       LYS   9   5.349  12.825   0.054
   86    QG   LYS   9           QG       LYS   9   6.253  11.442   1.769
   87    QD   LYS   9           QD       LYS   9   4.527  12.111   3.217
   88    QE   LYS   9           QE       LYS   9   6.102  14.048   3.095
   89    QZ   LYS   9           QZ       LYS   9   4.339  14.802   4.258
   90    H    ASN  10           H        ASN  10   3.747  10.634  -2.505
   91    HA   ASN  10           HA       ASN  10   1.544  12.281  -3.327
   92   1HB   ASN  10          1HB       ASN  10   2.765  13.567  -5.022
   93   2HB   ASN  10          2HB       ASN  10   3.243  14.015  -3.394
   94   1HD2  ASN  10          2HD2      ASN  10   6.462  13.868  -4.965
   95   2HD2  ASN  10          1HD2      ASN  10   5.079  14.940  -4.715
   96    QB   ASN  10           QB       ASN  10   3.004  13.791  -4.208
   97    QD2  ASN  10           QD2      ASN  10   5.771  14.404  -4.840
   98    H    CYS  11           H        CYS  11   1.631  12.050  -5.906
   99    HA   CYS  11           HA       CYS  11   1.634   9.179  -6.436
  100   1HB   CYS  11          1HB       CYS  11  -0.065  10.838  -7.145
  101   2HB   CYS  11          2HB       CYS  11   1.107  11.599  -8.211
  102    QB   CYS  11           QB       CYS  11   0.521  11.219  -7.678
  103    H    ASP  12           H        ASP  12   4.213  11.139  -6.294
  104    HA   ASP  12           HA       ASP  12   5.392  10.504  -8.965
  105   1HB   ASP  12          1HB       ASP  12   4.540  12.792  -8.643
  106   2HB   ASP  12          2HB       ASP  12   5.663  13.003  -7.301
  107    QB   ASP  12           QB       ASP  12   5.102  12.897  -7.972
  108    HA   PRO  13           HA       PRO  13   7.980   8.739  -5.625
  109   1HB   PRO  13          1HB       PRO  13   9.366   6.857  -7.115
  110   2HB   PRO  13          2HB       PRO  13   7.744   6.599  -6.412
  111   1HG   PRO  13          1HG       PRO  13   8.473   7.424  -9.219
  112   2HG   PRO  13          2HG       PRO  13   7.257   6.216  -8.719
  113   1HD   PRO  13          1HD       PRO  13   6.623   8.770  -9.448
  114   2HD   PRO  13          2HD       PRO  13   5.694   7.948  -8.160
  115    QB   PRO  13           QB       PRO  13   8.555   6.728  -6.763
  116    QG   PRO  13           QG       PRO  13   7.865   6.820  -8.969
  117    QD   PRO  13           QD       PRO  13   6.158   8.359  -8.804
  118    H    ASN  14           H        ASN  14   8.911  10.281  -8.604
  119    HA   ASN  14           HA       ASN  14  11.757  10.336  -8.138
  120   1HB   ASN  14          1HB       ASN  14  10.515  10.739 -10.329
  121   2HB   ASN  14          2HB       ASN  14  10.069  12.321  -9.676
  122   1HD2  ASN  14          2HD2      ASN  14  13.736  11.676 -11.238
  123   2HD2  ASN  14          1HD2      ASN  14  12.821  10.272 -10.694
  124    QB   ASN  14           QB       ASN  14  10.292  11.530 -10.003
  125    QD2  ASN  14           QD2      ASN  14  13.278  10.974 -10.966
  126    H    THR  15           H        THR  15   8.997  12.113  -6.825
  127    HA   THR  15           HA       THR  15  10.820  14.000  -5.426
  128    HB   THR  15           HB       THR  15  10.056  14.821  -7.675
  129    HG1  THR  15          1HG       THR  15   9.101  16.273  -5.421
  130   1HG2  THR  15          1HG2      THR  15   7.700  13.736  -7.144
  131   2HG2  THR  15          2HG2      THR  15   7.318  15.343  -6.532
  132   3HG2  THR  15          3HG2      THR  15   7.874  15.128  -8.215
  133    QG2  THR  15           QG2      THR  15   7.631  14.736  -7.297
  134    H    GLY  16           H        GLY  16   8.684  11.759  -4.718
  135   1HA   GLY  16          1HA       GLY  16   7.655  13.301  -2.385
  136   2HA   GLY  16          2HA       GLY  16   6.983  11.767  -2.941
  137    QA   GLY  16           QA       GLY  16   7.319  12.534  -2.663
  138    H    SER  17           H        SER  17   8.543  12.686  -0.347
  139    HA   SER  17           HA       SER  17  10.824  10.833  -0.423
  140   1HB   SER  17          1HB       SER  17  10.954  11.224   1.981
  141   2HB   SER  17          2HB       SER  17  10.926  12.683   0.989
  142    HG   SER  17           HG       SER  17   8.749  11.500   2.399
  143    QB   SER  17           QB       SER  17  10.940  11.953   1.485
  144    H    CYS  18           H        CYS  18  10.106   8.901  -1.064
  145    HA   CYS  18           HA       CYS  18   7.652   7.694   0.053
  146   1HB   CYS  18          1HB       CYS  18   9.595   6.791  -2.119
  147   2HB   CYS  18          2HB       CYS  18   8.051   6.048  -1.744
  148    QB   CYS  18           QB       CYS  18   8.823   6.419  -1.932
  149    H    ASP  19           H        ASP  19   7.709   5.486   1.012
  150    HA   ASP  19           HA       ASP  19  10.394   4.998   2.163
  151   1HB   ASP  19          1HB       ASP  19   9.526   3.972   3.850
  152   2HB   ASP  19          2HB       ASP  19   8.525   5.382   3.604
  153    QB   ASP  19           QB       ASP  19   9.026   4.677   3.727
  154    H    TRP  20           H        TRP  20  11.539   3.978   0.904
  155    HA   TRP  20           HA       TRP  20  10.863   1.628  -0.733
  156   1HB   TRP  20          1HB       TRP  20  13.498   2.954  -0.096
  157   2HB   TRP  20          2HB       TRP  20  13.188   1.758  -1.353
  158    HD1  TRP  20           HD       TRP  20  12.330   5.380  -0.454
  159    HE1  TRP  20          1HE       TRP  20  11.841   6.737  -2.538
  160    HE3  TRP  20          3HE       TRP  20  12.340   1.556  -3.764
  161    HZ2  TRP  20          2HZ       TRP  20  11.441   6.170  -5.398
  162    HZ3  TRP  20          3HZ       TRP  20  12.130   1.999  -6.210
  163    HH2  TRP  20           HH       TRP  20  11.684   4.300  -7.030
  164    QB   TRP  20           QB       TRP  20  13.343   2.356  -0.724
  165    H    LYS  21           H        LYS  21  10.163   1.354   1.989
  166    HA   LYS  21           HA       LYS  21  12.259  -0.242   3.317
  167   1HB   LYS  21          1HB       LYS  21   9.982   1.400   4.105
  168   2HB   LYS  21          2HB       LYS  21   9.786  -0.217   4.766
  169   1HG   LYS  21          1HG       LYS  21  12.332   1.436   5.050
  170   2HG   LYS  21          2HG       LYS  21  10.988   1.492   6.204
  171   1HD   LYS  21          1HD       LYS  21  11.137  -0.985   6.503
  172   2HD   LYS  21          2HD       LYS  21  12.572  -1.026   5.494
  173   1HE   LYS  21          1HE       LYS  21  12.244   0.427   8.159
  174   2HE   LYS  21          2HE       LYS  21  13.184  -1.035   7.841
  175   1HZ   LYS  21          3HZ       LYS  21  14.564   0.318   6.328
  176   2HZ   LYS  21          1HZ       LYS  21  13.834   1.684   6.864
  177   3HZ   LYS  21          2HZ       LYS  21  14.657   0.736   7.931
  178    QB   LYS  21           QB       LYS  21   9.884   0.592   4.436
  179    QG   LYS  21           QG       LYS  21  11.660   1.464   5.627
  180    QD   LYS  21           QD       LYS  21  11.854  -1.006   5.999
  181    QE   LYS  21           QE       LYS  21  12.714  -0.304   8.000
  182    QZ   LYS  21           QZ       LYS  21  14.351   0.913   7.041
  183    H    GLN  22           H        GLN  22  11.802  -2.449   3.880
  184    HA   GLN  22           HA       GLN  22  10.166  -4.069   2.189
  185   1HB   GLN  22          1HB       GLN  22  12.012  -4.873   3.790
  186   2HB   GLN  22          2HB       GLN  22  10.846  -4.467   5.075
  187   1HG   GLN  22          1HG       GLN  22   9.257  -6.168   4.041
  188   2HG   GLN  22          2HG       GLN  22  10.611  -6.686   3.029
  189   1HE2  GLN  22          2HE2      GLN  22  10.858  -9.009   5.809
  190   2HE2  GLN  22          1HE2      GLN  22  10.276  -8.838   4.170
  191    QB   GLN  22           QB       GLN  22  11.429  -4.670   4.432
  192    QG   GLN  22           QG       GLN  22   9.934  -6.427   3.535
  193    QE2  GLN  22           QE2      GLN  22  10.567  -8.924   4.990
  194    H    ASN  23           H        ASN  23   8.058  -4.735   2.528
  195    HA   ASN  23           HA       ASN  23   6.453  -3.667   4.802
  196   1HB   ASN  23          1HB       ASN  23   4.812  -2.672   3.291
  197   2HB   ASN  23          2HB       ASN  23   6.386  -1.887   3.169
  198   1HD2  ASN  23          2HD2      ASN  23   6.033  -2.098  -0.343
  199   2HD2  ASN  23          1HD2      ASN  23   6.170  -1.089   1.086
  200    QB   ASN  23           QB       ASN  23   5.599  -2.279   3.230
  201    QD2  ASN  23           QD2      ASN  23   6.102  -1.593   0.372
  202    H    TRP  24           H        TRP  24   7.299  -6.449   3.797
  203    HA   TRP  24           HA       TRP  24   4.641  -7.584   3.226
  204   1HB   TRP  24          1HB       TRP  24   6.144  -7.642   1.331
  205   2HB   TRP  24          2HB       TRP  24   7.526  -8.044   2.348
  206    HD1  TRP  24           HD       TRP  24   7.632 -10.312   3.417
  207    HE1  TRP  24          1HE       TRP  24   6.819 -12.704   2.586
  208    HE3  TRP  24          3HE       TRP  24   4.314  -8.779  -0.052
  209    HZ2  TRP  24          2HZ       TRP  24   4.811 -13.676   0.663
  210    HZ3  TRP  24          3HZ       TRP  24   3.113 -10.353  -1.486
  211    HH2  TRP  24           HH       TRP  24   3.198 -12.776  -1.059
  212    QB   TRP  24           QB       TRP  24   6.835  -7.843   1.839
  213    H    ASN  25           H        ASN  25   4.141  -9.244   4.677
  214    HA   ASN  25           HA       ASN  25   4.169 -10.428   6.636
  215   1HB   ASN  25          1HB       ASN  25   6.900 -10.793   5.575
  216   2HB   ASN  25          2HB       ASN  25   6.839 -10.934   7.309
  217   1HD2  ASN  25          2HD2      ASN  25   4.905 -13.724   5.016
  218   2HD2  ASN  25          1HD2      ASN  25   5.372 -12.185   4.300
  219    QB   ASN  25           QB       ASN  25   6.869 -10.863   6.442
  220    QD2  ASN  25           QD2      ASN  25   5.139 -12.954   4.658
  221    H    THR  26           H        THR  26   4.441  -7.376   6.667
  222    HA   THR  26           HA       THR  26   5.282  -7.038   9.477
  223    HB   THR  26           HB       THR  26   6.395  -4.893   8.519
  224    HG1  THR  26          1HG       THR  26   6.747  -6.611   6.287
  225   1HG2  THR  26          2HG2      THR  26   7.645  -6.699   9.588
  226   2HG2  THR  26          3HG2      THR  26   7.730  -7.606   8.064
  227   3HG2  THR  26          1HG2      THR  26   8.546  -6.040   8.205
  228    QG2  THR  26           QG2      THR  26   7.973  -6.782   8.619
  229    H    CYS  27           H        CYS  27   3.924  -5.639  10.554
  230    HA   CYS  27           HA       CYS  27   1.563  -4.794   9.113
  231   1HB   CYS  27          1HB       CYS  27   1.284  -5.870  11.346
  232   2HB   CYS  27          2HB       CYS  27   2.286  -4.581  12.022
  233    QB   CYS  27           QB       CYS  27   1.785  -5.225  11.684
  234    H    VAL  28           H        VAL  28   2.730  -3.121   7.837
  235    HA   VAL  28           HA       VAL  28   4.430  -1.257   9.359
  236    HB   VAL  28           HB       VAL  28   3.871  -1.508   6.386
  237   1HG1  VAL  28          1HG1      VAL  28   4.628   0.783   7.019
  238   2HG1  VAL  28          2HG1      VAL  28   6.015   0.081   7.876
  239   3HG1  VAL  28          3HG1      VAL  28   5.856  -0.112   6.114
  240   1HG2  VAL  28          2HG2      VAL  28   6.083  -2.493   8.239
  241   2HG2  VAL  28          3HG2      VAL  28   5.063  -3.446   7.130
  242   3HG2  VAL  28          1HG2      VAL  28   6.296  -2.346   6.494
  243    QG1  VAL  28           QG1      VAL  28   5.500   0.251   7.003
  244    QG2  VAL  28           QG2      VAL  28   5.814  -2.762   7.287
  245    QQG  VAL  28           QQG      VAL  28   5.657  -1.255   7.145
  246    H    GLY  29           H        GLY  29   4.091   0.924   9.611
  247   1HA   GLY  29          1HA       GLY  29   1.352   1.778   9.775
  248   2HA   GLY  29          2HA       GLY  29   2.786   2.664  10.288
  249    QA   GLY  29           QA       GLY  29   2.069   2.221  10.031
  250    H    ILE  30           H        ILE  30   0.645   3.871   8.887
  251    HA   ILE  30           HA       ILE  30   2.054   4.902   6.463
  252    HB   ILE  30           HB       ILE  30  -0.956   4.916   6.988
  253   1HG1  ILE  30          1HG1      ILE  30   0.676   2.941   5.370
  254   2HG1  ILE  30          2HG1      ILE  30  -0.382   2.595   6.741
  255   1HG2  ILE  30          3HG2      ILE  30   0.020   6.695   5.506
  256   2HG2  ILE  30          1HG2      ILE  30   0.611   5.413   4.432
  257   3HG2  ILE  30          2HG2      ILE  30  -1.132   5.655   4.685
  258   1HD1  ILE  30          1HD1      ILE  30  -2.345   3.370   5.423
  259   2HD1  ILE  30          2HD1      ILE  30  -1.291   3.504   3.992
  260   3HD1  ILE  30          3HD1      ILE  30  -1.533   1.934   4.766
  261    QG1  ILE  30           QG1      ILE  30   0.147   2.768   6.055
  262    QG2  ILE  30           QG2      ILE  30  -0.167   5.921   4.874
  263    QD1  ILE  30           QD1      ILE  30  -1.723   2.936   4.727
  264    H    GLY  31           H        GLY  31   2.493   7.176   6.745
  265   1HA   GLY  31          1HA       GLY  31   0.772   8.667   8.590
  266   2HA   GLY  31          2HA       GLY  31   2.445   8.501   9.101
  267    QA   GLY  31           QA       GLY  31   1.608   8.584   8.845
  268    H    ALA  32           H        ALA  32   0.683  10.715   8.192
  269    HA   ALA  32           HA       ALA  32   1.066  12.779   7.595
  270   1HB   ALA  32          3HB       ALA  32   3.115  12.453   8.970
  271   2HB   ALA  32          1HB       ALA  32   4.019  12.008   7.503
  272   3HB   ALA  32          2HB       ALA  32   3.372  13.651   7.686
  273    QB   ALA  32           QB       ALA  32   3.502  12.704   8.053
  274    H    ASN  33           H        ASN  33  -0.169  12.456   5.832
  275    HA   ASN  33           HA       ASN  33  -0.757  12.940   3.738
  276   1HB   ASN  33          1HB       ASN  33   1.907  14.043   2.937
  277   2HB   ASN  33          2HB       ASN  33   0.294  14.620   2.543
  278   1HD2  ASN  33          2HD2      ASN  33   0.024  16.482   5.688
  279   2HD2  ASN  33          1HD2      ASN  33  -0.978  15.473   4.653
  280    QB   ASN  33           QB       ASN  33   1.100  14.331   2.740
  281    QD2  ASN  33           QD2      ASN  33  -0.477  15.978   5.171
  282    H    VAL  34           H        VAL  34   1.140  10.561   4.518
  283    HA   VAL  34           HA       VAL  34   1.958   9.665   1.809
  284    HB   VAL  34           HB       VAL  34   1.898   8.243   4.486
  285   1HG1  VAL  34          1HG1      VAL  34   2.940   7.278   1.774
  286   2HG1  VAL  34          2HG1      VAL  34   3.125   6.448   3.329
  287   3HG1  VAL  34          3HG1      VAL  34   1.523   6.620   2.607
  288   1HG2  VAL  34          3HG2      VAL  34   3.636  10.045   4.127
  289   2HG2  VAL  34          1HG2      VAL  34   4.351   8.436   4.261
  290   3HG2  VAL  34          2HG2      VAL  34   4.173   9.192   2.671
  291    QG1  VAL  34           QG1      VAL  34   2.529   6.782   2.570
  292    QG2  VAL  34           QG2      VAL  34   4.053   9.224   3.686
  293    QQG  VAL  34           QQG      VAL  34   3.291   8.003   3.128
  294    H    HIS  35           H        HIS  35   0.121   9.734   0.576
  295    HA   HIS  35           HA       HIS  35  -2.002   7.720   1.200
  296   1HB   HIS  35          1HB       HIS  35  -3.680   9.250   0.374
  297   2HB   HIS  35          2HB       HIS  35  -2.993   9.849   1.891
  298    HD1  HIS  35          1HD       HIS  35  -3.593  10.718  -1.731
  299    HD2  HIS  35          2HD       HIS  35  -1.791  12.267   1.727
  300    HE1  HIS  35          1HE       HIS  35  -3.350  13.214  -2.105
  301    QB   HIS  35           QB       HIS  35  -3.336   9.550   1.133
  302    H    TRP  36           H        TRP  36   0.287   7.386  -0.351
  303    HA   TRP  36           HA       TRP  36  -1.078   6.744  -2.890
  304   1HB   TRP  36          1HB       TRP  36   1.587   8.175  -2.634
  305   2HB   TRP  36          2HB       TRP  36   0.897   7.548  -4.129
  306    HD1  TRP  36           HD       TRP  36   0.343  10.340  -1.530
  307    HE1  TRP  36          1HE       TRP  36  -0.990  12.193  -2.578
  308    HE3  TRP  36          3HE       TRP  36  -1.060   7.897  -5.762
  309    HZ2  TRP  36          2HZ       TRP  36  -2.750  12.515  -4.916
  310    HZ3  TRP  36          3HZ       TRP  36  -2.746   8.931  -7.302
  311    HH2  TRP  36           HH       TRP  36  -3.503  11.269  -6.925
  312    QB   TRP  36           QB       TRP  36   1.242   7.861  -3.381
  313    H    MET  37           H        MET  37  -0.518   4.727  -3.534
  314    HA   MET  37           HA       MET  37   1.979   3.494  -2.484
  315   1HB   MET  37          1HB       MET  37  -0.120   2.407  -1.643
  316   2HB   MET  37          2HB       MET  37  -0.513   1.986  -3.338
  317   1HG   MET  37          1HG       MET  37   1.490   0.644  -3.502
  318   2HG   MET  37          2HG       MET  37   2.014   1.124  -1.882
  319   1HE   MET  37          1HE       MET  37   0.900   0.370   0.335
  320   2HE   MET  37          2HE       MET  37  -0.730   0.929  -0.127
  321   3HE   MET  37          3HE       MET  37  -0.490  -0.725   0.455
  322    QB   MET  37           QB       MET  37  -0.316   2.197  -2.491
  323    QG   MET  37           QG       MET  37   1.752   0.884  -2.692
  324    QE   MET  37           QE       MET  37  -0.107   0.191   0.221
  325    H    VAL  38           H        VAL  38   3.347   2.894  -4.135
  326    HA   VAL  38           HA       VAL  38   2.390   3.378  -6.924
  327    HB   VAL  38           HB       VAL  38   5.053   4.341  -5.824
  328   1HG1  VAL  38          3HG1      VAL  38   4.818   4.137  -8.305
  329   2HG1  VAL  38          1HG1      VAL  38   3.387   5.184  -8.245
  330   3HG1  VAL  38          2HG1      VAL  38   4.961   5.826  -7.775
  331   1HG2  VAL  38          3HG2      VAL  38   2.432   5.907  -5.985
  332   2HG2  VAL  38          1HG2      VAL  38   3.393   5.578  -4.524
  333   3HG2  VAL  38          2HG2      VAL  38   4.033   6.636  -5.783
  334    QG1  VAL  38           QG1      VAL  38   4.388   5.049  -8.109
  335    QG2  VAL  38           QG2      VAL  38   3.286   6.040  -5.431
  336    QQG  VAL  38           QQG      VAL  38   3.837   5.545  -6.770
  337    H    THR  39           H        THR  39   2.599   1.520  -8.012
  338    HA   THR  39           HA       THR  39   4.396  -0.517  -6.883
  339    HB   THR  39           HB       THR  39   2.852  -1.904  -8.576
  340    HG1  THR  39          1HG       THR  39   0.970  -0.860  -8.935
  341   1HG2  THR  39          2HG2      THR  39   2.013  -0.817  -5.859
  342   2HG2  THR  39          3HG2      THR  39   1.389  -2.296  -6.626
  343   3HG2  THR  39          1HG2      THR  39   3.087  -2.213  -6.132
  344    QG2  THR  39           QG2      THR  39   2.163  -1.775  -6.206
  345    H    GLY  40           H        GLY  40   6.195   0.762  -7.758
  346   1HA   GLY  40          1HA       GLY  40   8.029   0.415  -9.145
  347   2HA   GLY  40          2HA       GLY  40   7.102  -0.843  -9.941
  348    QA   GLY  40           QA       GLY  40   7.566  -0.214  -9.543
  349    H    GLY  41           H        GLY  41   8.747   0.474 -11.388
  350   1HA   GLY  41          1HA       GLY  41   7.089   1.456 -13.516
  351   2HA   GLY  41          2HA       GLY  41   8.244   2.676 -12.935
  352    QA   GLY  41           QA       GLY  41   7.667   2.066 -13.225
  353    H    SER  42           H        SER  42   7.970  -0.813 -13.640
  354    HA   SER  42           HA       SER  42  10.820  -1.001 -14.532
  355   1HB   SER  42          1HB       SER  42  10.604  -1.325 -12.112
  356   2HB   SER  42          2HB       SER  42   9.428  -2.604 -12.352
  357    HG   SER  42           HG       SER  42  11.170  -3.749 -13.527
  358    QB   SER  42           QB       SER  42  10.016  -1.965 -12.232
  359    H    THR  43           H        THR  43   9.296  -3.875 -13.806
  360    HA   THR  43           HA       THR  43   8.714  -4.617 -16.607
  361    HB   THR  43           HB       THR  43  10.488  -6.448 -16.074
  362    HG1  THR  43          1HG       THR  43  11.974  -5.849 -14.485
  363   1HG2  THR  43          3HG2      THR  43  10.901  -4.475 -17.604
  364   2HG2  THR  43          1HG2      THR  43  11.561  -3.580 -16.223
  365   3HG2  THR  43          2HG2      THR  43  12.359  -5.048 -16.772
  366    QG2  THR  43           QG2      THR  43  11.607  -4.367 -16.866
  367    H    ASP  44           H        ASP  44   9.536  -6.188 -13.627
  368    HA   ASP  44           HA       ASP  44   7.874  -7.897 -12.685
  369   1HB   ASP  44          1HB       ASP  44   9.462  -6.485 -11.416
  370   2HB   ASP  44          2HB       ASP  44   8.247  -5.208 -11.294
  371    QB   ASP  44           QB       ASP  44   8.854  -5.846 -11.355
  372    H    GLY  45           H        GLY  45   5.876  -8.231 -13.563
  373   1HA   GLY  45          1HA       GLY  45   4.060  -5.935 -13.946
  374   2HA   GLY  45          2HA       GLY  45   4.125  -7.454 -14.839
  375    QA   GLY  45           QA       GLY  45   4.092  -6.694 -14.393
  376    H    LYS  46           H        LYS  46   4.308  -8.141 -11.525
  377    HA   LYS  46           HA       LYS  46   1.494  -8.964 -11.389
  378   1HB   LYS  46          1HB       LYS  46   1.940  -9.809  -9.287
  379   2HB   LYS  46          2HB       LYS  46   3.376 -10.183 -10.263
  380   1HG   LYS  46          1HG       LYS  46   4.346  -7.996  -9.329
  381   2HG   LYS  46          2HG       LYS  46   2.971  -8.011  -8.217
  382   1HD   LYS  46          1HD       LYS  46   4.284  -9.257  -6.802
  383   2HD   LYS  46          2HD       LYS  46   3.894 -10.591  -7.879
  384   1HE   LYS  46          1HE       LYS  46   6.290 -10.544  -7.645
  385   2HE   LYS  46          2HE       LYS  46   5.941  -9.967  -9.279
  386   1HZ   LYS  46          3HZ       LYS  46   6.240  -7.681  -8.373
  387   2HZ   LYS  46          1HZ       LYS  46   6.683  -8.325  -6.912
  388   3HZ   LYS  46          2HZ       LYS  46   7.543  -8.578  -8.298
  389    QB   LYS  46           QB       LYS  46   2.658  -9.996  -9.775
  390    QG   LYS  46           QG       LYS  46   3.659  -8.004  -8.773
  391    QD   LYS  46           QD       LYS  46   4.089  -9.924  -7.341
  392    QE   LYS  46           QE       LYS  46   6.116 -10.256  -8.462
  393    QZ   LYS  46           QZ       LYS  46   6.822  -8.195  -7.861
  394    H    GLN  47           H        GLN  47  -0.183  -7.545 -10.823
  395    HA   GLN  47           HA       GLN  47   0.268  -4.914  -9.861
  396   1HB   GLN  47          1HB       GLN  47  -2.036  -5.115  -8.938
  397   2HB   GLN  47          2HB       GLN  47  -1.967  -5.606 -10.633
  398   1HG   GLN  47          1HG       GLN  47  -1.822  -7.767  -8.553
  399   2HG   GLN  47          2HG       GLN  47  -3.348  -6.973  -8.877
  400   1HE2  GLN  47          2HE2      GLN  47  -4.004  -8.731 -11.839
  401   2HE2  GLN  47          1HE2      GLN  47  -4.577  -7.757 -10.495
  402    QB   GLN  47           QB       GLN  47  -2.001  -5.360  -9.786
  403    QG   GLN  47           QG       GLN  47  -2.585  -7.370  -8.715
  404    QE2  GLN  47           QE2      GLN  47  -4.290  -8.244 -11.167
  405    H    GLY  48           H        GLY  48   0.465  -4.157  -7.740
  406   1HA   GLY  48          1HA       GLY  48   1.565  -6.224  -5.831
  407   2HA   GLY  48          2HA       GLY  48   2.056  -4.540  -5.879
  408    QA   GLY  48           QA       GLY  48   1.810  -5.382  -5.855
  409    H    CYS  49           H        CYS  49   0.558  -6.460  -3.842
  410    HA   CYS  49           HA       CYS  49  -1.864  -4.778  -3.488
  411   1HB   CYS  49          1HB       CYS  49  -1.612  -7.786  -3.200
  412   2HB   CYS  49          2HB       CYS  49  -3.104  -6.885  -3.061
  413    QB   CYS  49           QB       CYS  49  -2.358  -7.335  -3.130
  414    H    ALA  50           H        ALA  50  -2.743  -4.707  -1.549
  415    HA   ALA  50           HA       ALA  50  -1.165  -5.720   0.746
  416   1HB   ALA  50          1HB       ALA  50  -1.689  -2.748   0.276
  417   2HB   ALA  50          2HB       ALA  50  -1.027  -3.454   1.765
  418   3HB   ALA  50          3HB       ALA  50  -0.087  -3.527   0.255
  419    QB   ALA  50           QB       ALA  50  -0.934  -3.243   0.765
  420    H    THR  51           H        THR  51  -2.336  -5.980   2.563
  421    HA   THR  51           HA       THR  51  -5.235  -5.226   2.473
  422    HB   THR  51           HB       THR  51  -3.820  -6.963   4.480
  423    HG1  THR  51          1HG       THR  51  -4.112  -7.822   2.317
  424   1HG2  THR  51          2HG2      THR  51  -5.857  -5.717   5.331
  425   2HG2  THR  51          3HG2      THR  51  -6.787  -6.344   3.959
  426   3HG2  THR  51          1HG2      THR  51  -6.160  -7.457   5.187
  427    QG2  THR  51           QG2      THR  51  -6.268  -6.506   4.825
  428    H    ILE  52           H        ILE  52  -5.588  -3.255   3.061
  429    HA   ILE  52           HA       ILE  52  -3.622  -1.824   4.761
  430    HB   ILE  52           HB       ILE  52  -5.860  -0.710   3.016
  431   1HG1  ILE  52          1HG1      ILE  52  -2.913  -1.144   2.350
  432   2HG1  ILE  52          2HG1      ILE  52  -4.313  -1.852   1.528
  433   1HG2  ILE  52          1HG2      ILE  52  -4.969   0.702   4.926
  434   2HG2  ILE  52          2HG2      ILE  52  -3.381   0.642   4.152
  435   3HG2  ILE  52          3HG2      ILE  52  -4.743   1.422   3.330
  436   1HD1  ILE  52          1HD1      ILE  52  -5.027   0.453   0.838
  437   2HD1  ILE  52          2HD1      ILE  52  -3.478   1.064   1.475
  438   3HD1  ILE  52          3HD1      ILE  52  -3.487  -0.101   0.147
  439    QG1  ILE  52           QG1      ILE  52  -3.613  -1.498   1.939
  440    QG2  ILE  52           QG2      ILE  52  -4.364   0.922   4.136
  441    QD1  ILE  52           QD1      ILE  52  -3.997   0.472   0.820
  442    H    TRP  53           H        TRP  53  -4.425  -0.977   6.767
  443    HA   TRP  53           HA       TRP  53  -7.194  -1.764   7.500
  444   1HB   TRP  53          1HB       TRP  53  -4.554  -2.111   8.887
  445   2HB   TRP  53          2HB       TRP  53  -5.982  -1.791   9.865
  446    HD1  TRP  53           HD       TRP  53  -7.742  -3.636  10.209
  447    HE1  TRP  53          1HE       TRP  53  -7.681  -6.131   9.973
  448    HE3  TRP  53          3HE       TRP  53  -3.702  -3.955   7.132
  449    HZ2  TRP  53          2HZ       TRP  53  -5.987  -8.132   8.580
  450    HZ3  TRP  53          3HZ       TRP  53  -2.761  -6.125   6.513
  451    HH2  TRP  53           HH       TRP  53  -3.909  -8.252   7.208
  452    QB   TRP  53           QB       TRP  53  -5.268  -1.951   9.376
  453    H    GLU  54           H        GLU  54  -8.127  -0.465   9.136
  454    HA   GLU  54           HA       GLU  54  -7.782   2.266   8.791
  455   1HB   GLU  54          1HB       GLU  54  -9.843   1.189   9.677
  456   2HB   GLU  54          2HB       GLU  54  -8.945   0.624  11.082
  457   1HG   GLU  54          1HG       GLU  54  -8.809   3.563  10.791
  458   2HG   GLU  54          2HG       GLU  54 -10.459   2.981  10.920
  459    QB   GLU  54           QB       GLU  54  -9.394   0.906  10.380
  460    QG   GLU  54           QG       GLU  54  -9.634   3.272  10.855
  461    H    GLY  55           H        GLY  55  -6.468   0.180  11.509
  462   1HA   GLY  55          1HA       GLY  55  -4.110   1.857  11.224
  463   2HA   GLY  55          2HA       GLY  55  -5.174   2.377  12.563
  464    QA   GLY  55           QA       GLY  55  -4.642   2.117  11.894
  465    H    SER  56           H        SER  56  -2.994   2.306  13.198
  466    HA   SER  56           HA       SER  56  -1.327   1.429  14.448
  467   1HB   SER  56          1HB       SER  56  -3.872   1.339  16.163
  468   2HB   SER  56          2HB       SER  56  -2.272   1.916  16.654
  469    HG   SER  56           HG       SER  56  -4.293   3.100  15.132
  470    QB   SER  56           QB       SER  56  -3.072   1.628  16.409
  471    H    GLY  57           H        GLY  57  -0.592  -0.712  13.777
  472   1HA   GLY  57          1HA       GLY  57  -0.195  -2.918  14.266
  473   2HA   GLY  57          2HA       GLY  57  -1.393  -2.843  15.546
  474    QA   GLY  57           QA       GLY  57  -0.794  -2.881  14.906
  475    H    CYS  58           H        CYS  58  -2.291  -1.592  12.450
  476    HA   CYS  58           HA       CYS  58  -3.889  -2.196  10.992
  477   1HB   CYS  58          1HB       CYS  58  -3.433  -4.448   9.856
  478   2HB   CYS  58          2HB       CYS  58  -2.242  -3.172   9.670
  479    QB   CYS  58           QB       CYS  58  -2.838  -3.810   9.763
  480    H    VAL  59           H        VAL  59  -5.294  -2.005  12.838
  481    HA   VAL  59           HA       VAL  59  -7.075  -4.352  12.924
  482    HB   VAL  59           HB       VAL  59  -7.694  -3.510  15.191
  483   1HG1  VAL  59          2HG1      VAL  59  -6.261  -5.522  14.857
  484   2HG1  VAL  59          3HG1      VAL  59  -4.822  -4.493  14.951
  485   3HG1  VAL  59          1HG1      VAL  59  -5.872  -4.663  16.360
  486   1HG2  VAL  59          2HG2      VAL  59  -6.632  -1.242  15.049
  487   2HG2  VAL  59          3HG2      VAL  59  -6.193  -2.148  16.508
  488   3HG2  VAL  59          1HG2      VAL  59  -5.049  -2.039  15.167
  489    QG1  VAL  59           QG1      VAL  59  -5.652  -4.892  15.390
  490    QG2  VAL  59           QG2      VAL  59  -5.958  -1.810  15.575
  491    QQG  VAL  59           QQG      VAL  59  -5.805  -3.351  15.482
  492    H    GLY  60           H        GLY  60  -9.300  -3.433  13.567
  493   1HA   GLY  60          1HA       GLY  60 -10.992  -1.760  13.291
  494   2HA   GLY  60          2HA       GLY  60  -9.822  -0.714  12.520
  495    QA   GLY  60           QA       GLY  60 -10.407  -1.237  12.906
  496    H    ARG  61           H        ARG  61 -11.163  -0.450  10.622
  497    HA   ARG  61           HA       ARG  61 -12.180  -2.783   9.148
  498   1HB   ARG  61          1HB       ARG  61 -13.399  -0.647   9.414
  499   2HB   ARG  61          2HB       ARG  61 -12.052   0.238   8.677
  500   1HG   ARG  61          1HG       ARG  61 -12.427  -0.697   6.555
  501   2HG   ARG  61          2HG       ARG  61 -13.470  -1.998   7.173
  502   1HD   ARG  61          1HD       ARG  61 -14.224   0.876   7.760
  503   2HD   ARG  61          2HD       ARG  61 -14.452   0.268   6.158
  504    HE   ARG  61           HE       ARG  61 -15.780  -0.611   8.681
  505   1HH1  ARG  61          2HH2      ARG  61 -15.292  -1.391   5.225
  506   2HH1  ARG  61          1HH2      ARG  61 -16.936  -1.887   4.974
  507   1HH2  ARG  61          2HH1      ARG  61 -17.518  -2.154   8.510
  508   2HH2  ARG  61          1HH1      ARG  61 -17.900  -2.843   6.945
  509    QB   ARG  61           QB       ARG  61 -12.725  -0.205   9.045
  510    QG   ARG  61           QG       ARG  61 -12.949  -1.348   6.864
  511    QD   ARG  61           QD       ARG  61 -14.338   0.572   6.959
  512    QH1  ARG  61           QH2      ARG  61 -16.114  -1.639   5.099
  513    QH2  ARG  61           QH1      ARG  61 -17.709  -2.499   7.727
  514    H    SER  62           H        SER  62 -11.618  -3.241   6.991
  515    HA   SER  62           HA       SER  62  -9.029  -2.196   6.290
  516   1HB   SER  62          1HB       SER  62  -8.211  -4.655   5.880
  517   2HB   SER  62          2HB       SER  62  -8.277  -4.022   7.499
  518    HG   SER  62           HG       SER  62  -9.268  -6.155   7.203
  519    QB   SER  62           QB       SER  62  -8.244  -4.338   6.689
  520    H    THR  63           H        THR  63  -8.307  -2.957   4.100
  521    HA   THR  63           HA       THR  63 -10.342  -4.198   2.411
  522    HB   THR  63           HB       THR  63 -10.957  -1.777   2.510
  523    HG1  THR  63          1HG       THR  63 -10.148  -2.459  -0.095
  524   1HG2  THR  63          3HG2      THR  63  -8.556  -0.900   2.619
  525   2HG2  THR  63          1HG2      THR  63  -8.478  -1.172   0.875
  526   3HG2  THR  63          2HG2      THR  63  -9.702  -0.074   1.555
  527    QG2  THR  63           QG2      THR  63  -8.912  -0.716   1.683
  528    H    THR  64           H        THR  64  -9.283  -5.362   0.766
  529    HA   THR  64           HA       THR  64  -6.329  -5.245   0.791
  530    HB   THR  64           HB       THR  64  -8.153  -7.252  -0.494
  531    HG1  THR  64          1HG       THR  64  -6.464  -7.482   1.793
  532   1HG2  THR  64          1HG2      THR  64  -5.120  -7.124  -0.126
  533   2HG2  THR  64          2HG2      THR  64  -6.010  -8.570  -0.640
  534   3HG2  THR  64          3HG2      THR  64  -5.999  -7.124  -1.668
  535    QG2  THR  64           QG2      THR  64  -5.710  -7.606  -0.811
  536    H    MET  65           H        MET  65  -5.544  -3.695  -0.366
  537    HA   MET  65           HA       MET  65  -6.880  -2.718  -2.830
  538   1HB   MET  65          1HB       MET  65  -5.805  -1.219  -0.983
  539   2HB   MET  65          2HB       MET  65  -4.257  -1.864  -1.533
  540   1HG   MET  65          1HG       MET  65  -4.585   0.236  -2.640
  541   2HG   MET  65          2HG       MET  65  -4.813  -1.021  -3.848
  542   1HE   MET  65          3HE       MET  65  -6.382   1.870  -1.787
  543   2HE   MET  65          1HE       MET  65  -8.118   1.693  -2.120
  544   3HE   MET  65          2HE       MET  65  -7.297   0.528  -1.059
  545    QB   MET  65           QB       MET  65  -5.031  -1.541  -1.258
  546    QG   MET  65           QG       MET  65  -4.699  -0.393  -3.244
  547    QE   MET  65           QE       MET  65  -7.266   1.364  -1.655
  548    H    CYS  66           H        CYS  66  -5.911  -3.065  -4.827
  549    HA   CYS  66           HA       CYS  66  -3.279  -4.359  -4.873
  550   1HB   CYS  66          1HB       CYS  66  -5.623  -5.052  -6.661
  551   2HB   CYS  66          2HB       CYS  66  -3.956  -5.282  -7.166
  552    QB   CYS  66           QB       CYS  66  -4.789  -5.167  -6.913
  553    H    CYS  67           H        CYS  67  -1.978  -3.265  -6.366
  554    HA   CYS  67           HA       CYS  67  -3.197  -1.019  -7.920
  555   1HB   CYS  67          1HB       CYS  67  -2.081  -0.235  -5.859
  556   2HB   CYS  67          2HB       CYS  67  -0.575  -0.974  -6.416
  557    QB   CYS  67           QB       CYS  67  -1.328  -0.604  -6.137
  558    HA   PRO  68           HA       PRO  68  -1.141  -3.687 -11.009
  559   1HB   PRO  68          1HB       PRO  68  -1.893  -1.184 -12.547
  560   2HB   PRO  68          2HB       PRO  68  -1.943  -2.891 -13.121
  561   1HG   PRO  68          1HG       PRO  68  -4.222  -1.696 -12.328
  562   2HG   PRO  68          2HG       PRO  68  -3.841  -3.318 -11.676
  563   1HD   PRO  68          1HD       PRO  68  -3.377  -0.622 -10.352
  564   2HD   PRO  68          2HD       PRO  68  -4.101  -2.109  -9.660
  565    QB   PRO  68           QB       PRO  68  -1.918  -2.038 -12.834
  566    QG   PRO  68           QG       PRO  68  -4.032  -2.507 -12.002
  567    QD   PRO  68           QD       PRO  68  -3.739  -1.365 -10.006
  568    H    ALA  69           H        ALA  69   0.895  -3.664 -12.042
  569    HA   ALA  69           HA       ALA  69   2.673  -1.804 -10.792
  570   1HB   ALA  69          2HB       ALA  69   3.283  -4.188 -11.235
  571   2HB   ALA  69          3HB       ALA  69   3.349  -3.811 -12.970
  572   3HB   ALA  69          1HB       ALA  69   4.468  -3.020 -11.842
  573    QB   ALA  69           QB       ALA  69   3.700  -3.673 -12.015
  574    H    ASN  70           H        ASN  70   4.243  -0.510 -11.917
  575    HA   ASN  70           HA       ASN  70   4.848   1.167 -13.345
  576   1HB   ASN  70          1HB       ASN  70   3.937  -0.914 -15.182
  577   2HB   ASN  70          2HB       ASN  70   3.454   0.650 -15.810
  578   1HD2  ASN  70          2HD2      ASN  70   7.280  -0.549 -16.138
  579   2HD2  ASN  70          1HD2      ASN  70   6.009  -1.593 -15.524
  580    QB   ASN  70           QB       ASN  70   3.696  -0.132 -15.496
  581    QD2  ASN  70           QD2      ASN  70   6.645  -1.071 -15.831
  582    H    THR  71           H        THR  71   2.828   1.458 -11.455
  583    HA   THR  71           HA       THR  71   1.465   3.707 -12.550
  584    HB   THR  71           HB       THR  71   0.121   1.181 -12.691
  585    HG1  THR  71          1HG       THR  71  -0.721   3.860 -13.116
  586   1HG2  THR  71          3HG2      THR  71  -0.653   1.559 -10.382
  587   2HG2  THR  71          1HG2      THR  71  -1.446   3.066 -10.908
  588   3HG2  THR  71          2HG2      THR  71  -1.949   1.508 -11.576
  589    QG2  THR  71           QG2      THR  71  -1.349   2.044 -10.955
  590    H    CYS  72           H        CYS  72   0.234   4.859 -11.008
  591    HA   CYS  72           HA       CYS  72   1.171   4.705  -8.168
  592   1HB   CYS  72          1HB       CYS  72   1.937   6.800  -9.014
  593   2HB   CYS  72          2HB       CYS  72   0.642   6.849 -10.200
  594    QB   CYS  72           QB       CYS  72   1.289   6.825  -9.607
  595    H    CYS  73           H        CYS  73  -0.513   4.434  -6.642
  596    HA   CYS  73           HA       CYS  73  -3.331   4.806  -7.568
  597   1HB   CYS  73          1HB       CYS  73  -2.135   2.684  -5.739
  598   2HB   CYS  73          2HB       CYS  73  -3.841   3.028  -5.961
  599    QB   CYS  73           QB       CYS  73  -2.988   2.856  -5.850
  600    H    ASN  74           H        ASN  74  -4.595   6.029  -6.212
  601    HA   ASN  74           HA       ASN  74  -3.335   7.370  -3.941
  602   1HB   ASN  74          1HB       ASN  74  -4.723   8.699  -5.361
  603   2HB   ASN  74          2HB       ASN  74  -6.067   7.557  -5.220
  604   1HD2  ASN  74          2HD2      ASN  74  -5.377   9.559  -1.699
  605   2HD2  ASN  74          1HD2      ASN  74  -3.997   8.846  -2.508
  606    QB   ASN  74           QB       ASN  74  -5.395   8.128  -5.291
  607    QD2  ASN  74           QD2      ASN  74  -4.687   9.202  -2.104
  608    H    ILE  75           H        ILE  75  -3.459   6.767  -1.881
  609    HA   ILE  75           HA       ILE  75  -5.258   4.619  -0.915
  610    HB   ILE  75           HB       ILE  75  -2.603   5.860  -0.171
  611   1HG1  ILE  75          1HG1      ILE  75  -1.868   3.608  -0.064
  612   2HG1  ILE  75          2HG1      ILE  75  -3.544   2.991  -0.190
  613   1HG2  ILE  75          1HG2      ILE  75  -4.173   4.216   1.809
  614   2HG2  ILE  75          2HG2      ILE  75  -2.449   4.601   1.898
  615   3HG2  ILE  75          3HG2      ILE  75  -3.614   5.898   2.043
  616   1HD1  ILE  75          1HD1      ILE  75  -2.151   4.628  -2.296
  617   2HD1  ILE  75          2HD1      ILE  75  -2.187   2.845  -2.284
  618   3HD1  ILE  75          3HD1      ILE  75  -3.682   3.731  -2.485
  619    QG1  ILE  75           QG1      ILE  75  -2.706   3.300  -0.127
  620    QG2  ILE  75           QG2      ILE  75  -3.412   4.905   1.917
  621    QD1  ILE  75           QD1      ILE  75  -2.673   3.735  -2.355
  622    H    ASN  76           H        ASN  76  -7.229   5.819  -0.905
  623    HA   ASN  76           HA       ASN  76  -7.563   7.340   1.551
  624   1HB   ASN  76          1HB       ASN  76  -7.721   8.703  -1.133
  625   2HB   ASN  76          2HB       ASN  76  -8.897   9.132   0.117
  626   1HD2  ASN  76          2HD2      ASN  76  -5.885  11.397   0.363
  627   2HD2  ASN  76          1HD2      ASN  76  -6.785  10.874  -1.062
  628    QB   ASN  76           QB       ASN  76  -8.309   8.918  -0.508
  629    QD2  ASN  76           QD2      ASN  76  -6.335  11.136  -0.350
  630    H    THR  77           H        THR  77  -8.429   5.105   1.593
  631    HA   THR  77           HA       THR  77 -10.765   4.487   0.035
  632    HB   THR  77           HB       THR  77 -10.763   2.612   1.960
  633    HG1  THR  77          1HG       THR  77  -9.345   3.753   3.349
  634   1HG2  THR  77          2HG2      THR  77  -8.673   3.077  -0.201
  635   2HG2  THR  77          3HG2      THR  77  -8.626   1.632   0.812
  636   3HG2  THR  77          1HG2      THR  77 -10.038   1.949  -0.207
  637    QG2  THR  77           QG2      THR  77  -9.112   2.219   0.135
  638    H    GLY  78           H        GLY  78 -12.797   3.750   1.389
  639   1HA   GLY  78          1HA       GLY  78 -14.224   5.954   2.107
  640   2HA   GLY  78          2HA       GLY  78 -14.569   4.348   2.770
  641    QA   GLY  78           QA       GLY  78 -14.396   5.151   2.438
  642    H    PHE  79           H        PHE  79 -12.436   3.872   4.334
  643    HA   PHE  79           HA       PHE  79 -12.764   5.746   6.633
  644   1HB   PHE  79          1HB       PHE  79 -11.795   3.881   7.933
  645   2HB   PHE  79          2HB       PHE  79 -13.288   3.443   7.170
  646    HD1  PHE  79          1HD       PHE  79 -13.065   1.974   4.917
  647    HD2  PHE  79          2HD       PHE  79  -9.850   2.639   7.712
  648    HE1  PHE  79          1HE       PHE  79 -11.673   0.281   3.748
  649    HE2  PHE  79          2HE       PHE  79  -8.530   0.866   6.612
  650   1HZ   PHE  79           HZ       PHE  79  -9.410  -0.285   4.613
  651    QB   PHE  79           QB       PHE  79 -12.541   3.662   7.552
  652    QG   PHE  79           QD       PHE  79 -11.457   2.306   6.315
  653    QZ   PHE  79           QE       PHE  79 -10.101   0.574   5.180
  654    QZ   PHE  79           QR       PHE  79 -10.506   1.095   5.521
  655    H    TYR  80           H        TYR  80 -10.996   6.072   7.980
  656    HA   TYR  80           HA       TYR  80  -8.825   7.144   6.400
  657   1HB   TYR  80          1HB       TYR  80  -9.618   8.455   8.281
  658   2HB   TYR  80          2HB       TYR  80  -9.373   7.108   9.388
  659    HD1  TYR  80          1HD       TYR  80  -7.300   9.056   6.898
  660    HD2  TYR  80          2HD       TYR  80  -7.453   7.093  10.735
  661    HE1  TYR  80          1HE       TYR  80  -4.880   9.467   7.212
  662    HE2  TYR  80          2HE       TYR  80  -5.058   7.553  11.065
  663    HH   TYR  80           HH       TYR  80  -3.087   8.222  10.018
  664    QB   TYR  80           QB       TYR  80  -9.496   7.781   8.834
  665    QG   TYR  80           QD       TYR  80  -7.377   8.075   8.816
  666    QZ   TYR  80           QE       TYR  80  -4.969   8.510   9.139
  667    QR   TYR  80           QR       TYR  80  -6.173   8.292   8.977
  668    H    ILE  81           H        ILE  81  -6.636   6.279   6.387
  669    HA   ILE  81           HA       ILE  81  -6.481   3.512   7.313
  670    HB   ILE  81           HB       ILE  81  -4.711   3.433   5.487
  671   1HG1  ILE  81          1HG1      ILE  81  -5.054   6.059   5.195
  672   2HG1  ILE  81          2HG1      ILE  81  -4.794   5.022   3.839
  673   1HG2  ILE  81          1HG2      ILE  81  -7.729   3.432   5.068
  674   2HG2  ILE  81          2HG2      ILE  81  -6.548   2.774   3.913
  675   3HG2  ILE  81          3HG2      ILE  81  -6.696   2.084   5.531
  676   1HD1  ILE  81          1HD1      ILE  81  -7.625   5.667   4.697
  677   2HD1  ILE  81          2HD1      ILE  81  -6.667   6.689   3.623
  678   3HD1  ILE  81          3HD1      ILE  81  -7.034   4.992   3.189
  679    QG1  ILE  81           QG1      ILE  81  -4.924   5.541   4.517
  680    QG2  ILE  81           QG2      ILE  81  -6.991   2.763   4.837
  681    QD1  ILE  81           QD1      ILE  81  -7.109   5.783   3.836
  682    H    ARG  82           H        ARG  82  -4.759   2.997   8.704
  683    HA   ARG  82           HA       ARG  82  -2.402   4.822   8.775
  684   1HB   ARG  82          1HB       ARG  82  -3.685   5.638  10.524
  685   2HB   ARG  82          2HB       ARG  82  -4.043   4.052  11.195
  686   1HG   ARG  82          1HG       ARG  82  -1.750   3.691  11.841
  687   2HG   ARG  82          2HG       ARG  82  -1.240   5.133  10.934
  688   1HD   ARG  82          1HD       ARG  82  -2.444   6.569  12.519
  689   2HD   ARG  82          2HD       ARG  82  -3.134   5.145  13.311
  690    HE   ARG  82           HE       ARG  82  -1.263   5.064  14.633
  691   1HH1  ARG  82          2HH2      ARG  82  -0.288   6.940  11.763
  692   2HH1  ARG  82          1HH2      ARG  82   1.419   6.552  11.995
  693   1HH2  ARG  82          2HH1      ARG  82   1.057   4.545  14.819
  694   2HH2  ARG  82          1HH1      ARG  82   2.147   5.357  13.689
  695    QB   ARG  82           QB       ARG  82  -3.864   4.845  10.860
  696    QG   ARG  82           QG       ARG  82  -1.495   4.412  11.388
  697    QD   ARG  82           QD       ARG  82  -2.789   5.857  12.915
  698    QH1  ARG  82           QH2      ARG  82   0.565   6.746  11.879
  699    QH2  ARG  82           QH1      ARG  82   1.602   4.951  14.254
  700    H    SER  83           H        SER  83  -3.465   1.493   8.771
  701    HA   SER  83           HA       SER  83  -0.519   0.915   8.671
  702   1HB   SER  83          1HB       SER  83  -2.352  -0.946  10.075
  703   2HB   SER  83          2HB       SER  83  -0.605  -1.102   9.918
  704    HG   SER  83           HG       SER  83  -1.912   0.983  11.349
  705    QB   SER  83           QB       SER  83  -1.478  -1.024   9.996
  706    H    TYR  84           H        TYR  84  -0.067  -1.335   7.765
  707    HA   TYR  84           HA       TYR  84  -2.076  -2.634   6.200
  708   1HB   TYR  84          1HB       TYR  84  -1.292  -2.110   3.990
  709   2HB   TYR  84          2HB       TYR  84  -1.548  -0.557   4.763
  710    HD1  TYR  84          2HD       TYR  84   0.588   0.502   5.953
  711    HD2  TYR  84          1HD       TYR  84   0.744  -2.484   2.844
  712    HE1  TYR  84          2HE       TYR  84   2.914   1.127   5.462
  713    HE2  TYR  84          1HE       TYR  84   3.010  -1.717   2.239
  714    HH   TYR  84           HH       TYR  84   4.776   0.770   4.118
  715    QB   TYR  84           QB       TYR  84  -1.420  -1.333   4.377
  716    QG   TYR  84           QD       TYR  84   0.666  -0.991   4.398
  717    QZ   TYR  84           QE       TYR  84   2.962  -0.295   3.851
  718    QR   TYR  84           QR       TYR  84   1.814  -0.643   4.124
  719    H    ARG  85           H        ARG  85  -1.041  -4.294   4.734
  720    HA   ARG  85           HA       ARG  85   1.705  -5.153   5.432
  721   1HB   ARG  85          1HB       ARG  85  -0.059  -6.094   7.051
  722   2HB   ARG  85          2HB       ARG  85  -0.767  -6.944   5.678
  723   1HG   ARG  85          1HG       ARG  85   2.006  -7.379   6.871
  724   2HG   ARG  85          2HG       ARG  85   0.545  -8.324   7.150
  725   1HD   ARG  85          1HD       ARG  85   0.492  -8.676   4.590
  726   2HD   ARG  85          2HD       ARG  85   2.190  -8.130   4.641
  727    HE   ARG  85           HE       ARG  85   1.946 -10.112   6.623
  728   1HH1  ARG  85          2HH2      ARG  85   1.523 -10.010   3.110
  729   2HH1  ARG  85          1HH2      ARG  85   1.632 -11.742   2.910
  730   1HH2  ARG  85          2HH1      ARG  85   2.246 -12.409   6.326
  731   2HH2  ARG  85          1HH1      ARG  85   2.201 -13.069   4.711
  732    QB   ARG  85           QB       ARG  85  -0.413  -6.519   6.364
  733    QG   ARG  85           QG       ARG  85   1.276  -7.852   7.010
  734    QD   ARG  85           QD       ARG  85   1.341  -8.403   4.615
  735    QH1  ARG  85           QH2      ARG  85   1.578 -10.876   3.010
  736    QH2  ARG  85           QH1      ARG  85   2.224 -12.739   5.519
  737    H    ARG  86           H        ARG  86   2.620  -5.613   3.360
  738    HA   ARG  86           HA       ARG  86   0.969  -5.684   1.015
  739   1HB   ARG  86          1HB       ARG  86   3.344  -4.939   1.001
  740   2HB   ARG  86          2HB       ARG  86   3.848  -6.625   1.258
  741   1HG   ARG  86          1HG       ARG  86   2.492  -7.204  -0.841
  742   2HG   ARG  86          2HG       ARG  86   2.304  -5.466  -1.088
  743   1HD   ARG  86          1HD       ARG  86   4.624  -5.211  -1.560
  744   2HD   ARG  86          2HD       ARG  86   5.026  -6.825  -0.978
  745    HE   ARG  86           HE       ARG  86   3.165  -7.446  -2.863
  746   1HH1  ARG  86          2HH2      ARG  86   6.058  -5.361  -3.252
  747   2HH1  ARG  86          1HH2      ARG  86   5.811  -5.368  -5.005
  748   1HH2  ARG  86          2HH1      ARG  86   3.319  -7.754  -5.022
  749   2HH2  ARG  86          1HH1      ARG  86   4.343  -6.651  -5.985
  750    QB   ARG  86           QB       ARG  86   3.596  -5.782   1.130
  751    QG   ARG  86           QG       ARG  86   2.398  -6.335  -0.964
  752    QD   ARG  86           QD       ARG  86   4.825  -6.018  -1.269
  753    QH1  ARG  86           QH2      ARG  86   5.935  -5.364  -4.129
  754    QH2  ARG  86           QH1      ARG  86   3.831  -7.202  -5.503
  755    H    VAL  87           H        VAL  87   0.288  -7.543  -0.234
  756    HA   VAL  87           HA       VAL  87   0.486 -10.156   1.223
  757    HB   VAL  87           HB       VAL  87  -1.794 -10.621   0.722
  758   1HG1  VAL  87          2HG1      VAL  87  -1.052  -9.415   2.841
  759   2HG1  VAL  87          3HG1      VAL  87  -1.670  -7.928   2.104
  760   3HG1  VAL  87          1HG1      VAL  87  -2.764  -9.283   2.427
  761   1HG2  VAL  87          2HG2      VAL  87  -2.008  -7.772  -0.348
  762   2HG2  VAL  87          3HG2      VAL  87  -2.184  -9.263  -1.299
  763   3HG2  VAL  87          1HG2      VAL  87  -3.363  -8.863  -0.041
  764    QG1  VAL  87           QG1      VAL  87  -1.829  -8.875   2.457
  765    QG2  VAL  87           QG2      VAL  87  -2.518  -8.633  -0.563
  766    QQG  VAL  87           QQG      VAL  87  -2.174  -8.754   0.947
  767    H    GLU  88           H        GLU  88   0.582  -8.536  -1.950
  768    HA   GLU  88           HA       GLU  88   1.676 -10.961  -3.012
  769   1HB   GLU  88          1HB       GLU  88  -0.872 -11.164  -3.308
  770   2HB   GLU  88          2HB       GLU  88  -0.757  -9.778  -4.392
  771   1HG   GLU  88          1HG       GLU  88  -0.715 -11.829  -5.729
  772   2HG   GLU  88          2HG       GLU  88   0.921 -11.125  -5.778
  773    QB   GLU  88           QB       GLU  88  -0.815 -10.471  -3.850
  774    QG   GLU  88           QG       GLU  88   0.103 -11.477  -5.754
   
  No H/Q in entry =         774
  Start of MODEL   12
    1   1HA   GLY   1          1HA       GLY   1  14.130  -4.708 -12.229
    2   2HA   GLY   1          2HA       GLY   1  13.260  -5.784 -13.336
    3    QA   GLY   1           QA       GLY   1  13.695  -5.246 -12.782
    4    H    ASP   2           H        ASP   2  12.040  -7.467 -12.448
    5    HA   ASP   2           HA       ASP   2  10.414  -8.428 -11.253
    6   1HB   ASP   2          1HB       ASP   2  12.079  -9.301  -9.836
    7   2HB   ASP   2          2HB       ASP   2  12.319  -7.755  -9.009
    8    QB   ASP   2           QB       ASP   2  12.199  -8.528  -9.422
    9    H    GLY   3           H        GLY   3  11.233  -5.490  -9.350
   10   1HA   GLY   3          1HA       GLY   3   9.697  -3.592  -9.910
   11   2HA   GLY   3          2HA       GLY   3   8.355  -4.649  -9.419
   12    QA   GLY   3           QA       GLY   3   9.026  -4.120  -9.664
   13    H    TYR   4           H        TYR   4   7.953  -2.903  -7.796
   14    HA   TYR   4           HA       TYR   4   8.871  -3.847  -5.239
   15   1HB   TYR   4          1HB       TYR   4   9.578  -1.510  -4.460
   16   2HB   TYR   4          2HB       TYR   4  10.712  -2.383  -5.452
   17    HD1  TYR   4          1HD       TYR   4   8.187   0.364  -5.433
   18    HD2  TYR   4          2HD       TYR   4  11.332  -1.554  -7.685
   19    HE1  TYR   4          1HE       TYR   4   8.172   2.230  -7.054
   20    HE2  TYR   4          2HE       TYR   4  11.374   0.347  -9.238
   21    HH   TYR   4           HH       TYR   4  10.504   2.370  -9.763
   22    QB   TYR   4           QB       TYR   4  10.145  -1.946  -4.956
   23    QG   TYR   4           QD       TYR   4   9.760  -0.595  -6.559
   24    QZ   TYR   4           QE       TYR   4   9.773   1.289  -8.146
   25    QR   TYR   4           QR       TYR   4   9.766   0.347  -7.353
   26    H    LEU   5           H        LEU   5   7.822  -2.555  -3.533
   27    HA   LEU   5           HA       LEU   5   5.330  -1.131  -4.340
   28   1HB   LEU   5          1HB       LEU   5   4.891  -3.353  -3.228
   29   2HB   LEU   5          2HB       LEU   5   5.833  -2.820  -1.841
   30    HG   LEU   5           HG       LEU   5   4.151  -0.996  -1.442
   31   1HD1  LEU   5          3HD1      LEU   5   2.786  -2.355  -3.802
   32   2HD1  LEU   5          1HD1      LEU   5   1.931  -1.296  -2.691
   33   3HD1  LEU   5          2HD1      LEU   5   3.251  -0.628  -3.661
   34   1HD2  LEU   5          2HD2      LEU   5   3.920  -3.318  -0.417
   35   2HD2  LEU   5          3HD2      LEU   5   2.404  -2.414  -0.580
   36   3HD2  LEU   5          1HD2      LEU   5   2.793  -3.705  -1.727
   37    QB   LEU   5           QB       LEU   5   5.362  -3.087  -2.534
   38    QD1  LEU   5           QD1      LEU   5   2.656  -1.426  -3.385
   39    QD2  LEU   5           QD2      LEU   5   3.039  -3.146  -0.908
   40    QQD  LEU   5           QQD      LEU   5   2.848  -2.286  -2.146
   41    H    ILE   6           H        ILE   6   5.277   0.974  -3.471
   42    HA   ILE   6           HA       ILE   6   6.689   1.482  -0.962
   43    HB   ILE   6           HB       ILE   6   7.549   3.671  -1.850
   44   1HG1  ILE   6          1HG1      ILE   6   7.024   2.396  -4.576
   45   2HG1  ILE   6          2HG1      ILE   6   6.312   3.883  -3.928
   46   1HG2  ILE   6          3HG2      ILE   6   8.884   1.553  -1.423
   47   2HG2  ILE   6          1HG2      ILE   6   8.999   1.378  -3.185
   48   3HG2  ILE   6          2HG2      ILE   6   9.631   2.837  -2.388
   49   1HD1  ILE   6          1HD1      ILE   6   8.689   4.818  -3.835
   50   2HD1  ILE   6          2HD1      ILE   6   9.189   3.355  -4.713
   51   3HD1  ILE   6          3HD1      ILE   6   8.061   4.491  -5.464
   52    QG1  ILE   6           QG1      ILE   6   6.668   3.140  -4.252
   53    QG2  ILE   6           QG2      ILE   6   9.171   1.923  -2.332
   54    QD1  ILE   6           QD1      ILE   6   8.647   4.221  -4.671
   55    H    MET   7           H        MET   7   5.812   3.180   0.180
   56    HA   MET   7           HA       MET   7   3.232   4.231  -0.836
   57   1HB   MET   7          1HB       MET   7   2.518   4.511   1.347
   58   2HB   MET   7          2HB       MET   7   3.420   2.994   1.436
   59   1HG   MET   7          1HG       MET   7   5.421   4.342   2.210
   60   2HG   MET   7          2HG       MET   7   4.310   5.717   2.381
   61   1HE   MET   7          2HE       MET   7   4.603   1.945   3.212
   62   2HE   MET   7          3HE       MET   7   5.932   2.776   3.980
   63   3HE   MET   7          1HE       MET   7   4.692   1.991   4.988
   64    QB   MET   7           QB       MET   7   2.969   3.753   1.391
   65    QG   MET   7           QG       MET   7   4.866   5.030   2.295
   66    QE   MET   7           QE       MET   7   5.076   2.237   4.060
   67    H    CYS   8           H        CYS   8   3.116   6.475  -1.099
   68    HA   CYS   8           HA       CYS   8   5.722   7.943  -0.902
   69   1HB   CYS   8          1HB       CYS   8   3.737   7.759  -3.210
   70   2HB   CYS   8          2HB       CYS   8   4.999   8.971  -3.146
   71    QB   CYS   8           QB       CYS   8   4.368   8.365  -3.178
   72    H    LYS   9           H        LYS   9   5.416  10.284  -1.154
   73    HA   LYS   9           HA       LYS   9   3.227  11.261   0.503
   74   1HB   LYS   9          1HB       LYS   9   5.739  12.419  -0.751
   75   2HB   LYS   9          2HB       LYS   9   4.405  13.512  -0.383
   76   1HG   LYS   9          1HG       LYS   9   5.731  13.553   1.487
   77   2HG   LYS   9          2HG       LYS   9   4.280  12.636   1.921
   78   1HD   LYS   9          1HD       LYS   9   5.696  10.498   1.518
   79   2HD   LYS   9          2HD       LYS   9   7.103  11.568   1.420
   80   1HE   LYS   9          1HE       LYS   9   5.160  11.213   3.745
   81   2HE   LYS   9          2HE       LYS   9   6.840  10.679   3.691
   82   1HZ   LYS   9          3HZ       LYS   9   6.148  13.568   3.579
   83   2HZ   LYS   9          1HZ       LYS   9   6.548  12.764   4.948
   84   3HZ   LYS   9          2HZ       LYS   9   7.600  12.855   3.718
   85    QB   LYS   9           QB       LYS   9   5.072  12.966  -0.567
   86    QG   LYS   9           QG       LYS   9   5.006  13.094   1.704
   87    QD   LYS   9           QD       LYS   9   6.400  11.033   1.469
   88    QE   LYS   9           QE       LYS   9   6.000  10.946   3.718
   89    QZ   LYS   9           QZ       LYS   9   6.765  13.062   4.082
   90    H    ASN  10           H        ASN  10   3.886  11.009  -2.960
   91    HA   ASN  10           HA       ASN  10   1.344  12.306  -3.606
   92   1HB   ASN  10          1HB       ASN  10   2.192  13.838  -5.169
   93   2HB   ASN  10          2HB       ASN  10   2.911  14.189  -3.619
   94   1HD2  ASN  10          2HD2      ASN  10   5.694  14.473  -6.021
   95   2HD2  ASN  10          1HD2      ASN  10   4.222  15.345  -5.586
   96    QB   ASN  10           QB       ASN  10   2.552  14.013  -4.394
   97    QD2  ASN  10           QD2      ASN  10   4.958  14.909  -5.804
   98    H    CYS  11           H        CYS  11   1.480  12.224  -6.242
   99    HA   CYS  11           HA       CYS  11   1.441   9.313  -6.750
  100   1HB   CYS  11          1HB       CYS  11  -0.393  10.918  -7.294
  101   2HB   CYS  11          2HB       CYS  11   0.666  11.676  -8.481
  102    QB   CYS  11           QB       CYS  11   0.136  11.297  -7.887
  103    H    ASP  12           H        ASP  12   3.919  11.406  -6.766
  104    HA   ASP  12           HA       ASP  12   5.144  10.461  -9.293
  105   1HB   ASP  12          1HB       ASP  12   4.479  12.801  -9.457
  106   2HB   ASP  12          2HB       ASP  12   5.337  13.189  -7.958
  107    QB   ASP  12           QB       ASP  12   4.908  12.995  -8.707
  108    HA   PRO  13           HA       PRO  13   7.800   9.168  -5.790
  109   1HB   PRO  13          1HB       PRO  13   9.148   7.189  -7.190
  110   2HB   PRO  13          2HB       PRO  13   7.658   6.909  -6.262
  111   1HG   PRO  13          1HG       PRO  13   8.021   7.361  -9.214
  112   2HG   PRO  13          2HG       PRO  13   6.900   6.226  -8.417
  113   1HD   PRO  13          1HD       PRO  13   6.134   8.610  -9.459
  114   2HD   PRO  13          2HD       PRO  13   5.348   8.029  -7.977
  115    QB   PRO  13           QB       PRO  13   8.403   7.049  -6.726
  116    QG   PRO  13           QG       PRO  13   7.460   6.794  -8.815
  117    QD   PRO  13           QD       PRO  13   5.741   8.319  -8.718
  118    H    ASN  14           H        ASN  14   8.498  10.472  -8.936
  119    HA   ASN  14           HA       ASN  14  11.371  10.638  -8.536
  120   1HB   ASN  14          1HB       ASN  14  10.483  10.832 -10.802
  121   2HB   ASN  14          2HB       ASN  14   9.569  12.272 -10.326
  122   1HD2  ASN  14          2HD2      ASN  14  13.661  12.679 -10.676
  123   2HD2  ASN  14          1HD2      ASN  14  13.002  11.091 -10.303
  124    QB   ASN  14           QB       ASN  14  10.026  11.552 -10.564
  125    QD2  ASN  14           QD2      ASN  14  13.332  11.885 -10.490
  126    H    THR  15           H        THR  15   8.567  12.705  -7.740
  127    HA   THR  15           HA       THR  15  10.467  14.413  -6.158
  128    HB   THR  15           HB       THR  15   9.241  16.353  -6.683
  129    HG1  THR  15          1HG       THR  15   7.517  14.784  -8.323
  130   1HG2  THR  15          2HG2      THR  15  10.897  15.528  -8.408
  131   2HG2  THR  15          3HG2      THR  15   9.517  14.867  -9.322
  132   3HG2  THR  15          1HG2      THR  15   9.647  16.610  -9.038
  133    QG2  THR  15           QG2      THR  15  10.020  15.668  -8.923
  134    H    GLY  16           H        GLY  16   8.413  12.093  -5.492
  135   1HA   GLY  16          1HA       GLY  16   7.632  13.391  -2.928
  136   2HA   GLY  16          2HA       GLY  16   6.942  11.893  -3.532
  137    QA   GLY  16           QA       GLY  16   7.287  12.642  -3.230
  138    H    SER  17           H        SER  17   8.877  12.783  -1.171
  139    HA   SER  17           HA       SER  17  11.093  10.876  -1.687
  140   1HB   SER  17          1HB       SER  17  10.576  11.906   1.068
  141   2HB   SER  17          2HB       SER  17  12.080  11.623   0.186
  142    HG   SER  17           HG       SER  17  11.465  13.501  -1.107
  143    QB   SER  17           QB       SER  17  11.328  11.765   0.627
  144    H    CYS  18           H        CYS  18   9.987   8.955  -2.022
  145    HA   CYS  18           HA       CYS  18   7.834   8.079  -0.272
  146   1HB   CYS  18          1HB       CYS  18   9.440   6.505  -2.315
  147   2HB   CYS  18          2HB       CYS  18   7.860   6.095  -1.678
  148    QB   CYS  18           QB       CYS  18   8.650   6.300  -1.996
  149    H    ASP  19           H        ASP  19   8.008   6.131   1.183
  150    HA   ASP  19           HA       ASP  19  10.777   5.637   1.996
  151   1HB   ASP  19          1HB       ASP  19  10.188   5.022   3.955
  152   2HB   ASP  19          2HB       ASP  19   9.212   6.445   3.642
  153    QB   ASP  19           QB       ASP  19   9.700   5.734   3.799
  154    H    TRP  20           H        TRP  20  11.727   4.349   0.894
  155    HA   TRP  20           HA       TRP  20  10.745   1.987  -0.575
  156   1HB   TRP  20          1HB       TRP  20  13.426   3.380  -0.307
  157   2HB   TRP  20          2HB       TRP  20  13.102   1.971  -1.311
  158    HD1  TRP  20           HD       TRP  20  12.077   5.680  -1.103
  159    HE1  TRP  20          1HE       TRP  20  11.607   6.544  -3.435
  160    HE3  TRP  20          3HE       TRP  20  12.187   1.248  -3.534
  161    HZ2  TRP  20          2HZ       TRP  20  11.205   5.391  -6.075
  162    HZ3  TRP  20          3HZ       TRP  20  11.983   1.157  -6.023
  163    HH2  TRP  20           HH       TRP  20  11.548   3.250  -7.306
  164    QB   TRP  20           QB       TRP  20  13.264   2.676  -0.809
  165    H    LYS  21           H        LYS  21  10.188   1.658   1.952
  166    HA   LYS  21           HA       LYS  21  12.419   0.200   3.317
  167   1HB   LYS  21          1HB       LYS  21  10.356   2.262   4.056
  168   2HB   LYS  21          2HB       LYS  21  10.501   0.943   5.205
  169   1HG   LYS  21          1HG       LYS  21  12.769   2.706   4.279
  170   2HG   LYS  21          2HG       LYS  21  11.891   2.849   5.792
  171   1HD   LYS  21          1HD       LYS  21  12.705   0.545   6.445
  172   2HD   LYS  21          2HD       LYS  21  13.732   0.543   4.985
  173   1HE   LYS  21          1HE       LYS  21  14.787   2.663   5.710
  174   2HE   LYS  21          2HE       LYS  21  13.802   2.658   7.185
  175   1HZ   LYS  21          1HZ       LYS  21  14.910   0.561   7.760
  176   2HZ   LYS  21          2HZ       LYS  21  15.872   0.733   6.392
  177   3HZ   LYS  21          3HZ       LYS  21  15.952   1.828   7.609
  178    QB   LYS  21           QB       LYS  21  10.429   1.602   4.630
  179    QG   LYS  21           QG       LYS  21  12.330   2.777   5.035
  180    QD   LYS  21           QD       LYS  21  13.219   0.544   5.715
  181    QE   LYS  21           QE       LYS  21  14.295   2.661   6.447
  182    QZ   LYS  21           QZ       LYS  21  15.578   1.040   7.254
  183    H    GLN  22           H        GLN  22  11.344  -1.328   5.041
  184    HA   GLN  22           HA       GLN  22  10.579  -3.416   3.404
  185   1HB   GLN  22          1HB       GLN  22  11.685  -3.354   5.732
  186   2HB   GLN  22          2HB       GLN  22  10.057  -3.365   6.410
  187   1HG   GLN  22          1HG       GLN  22   9.665  -5.549   5.176
  188   2HG   GLN  22          2HG       GLN  22  11.336  -5.464   4.594
  189   1HE2  GLN  22          2HE2      GLN  22  10.598  -6.829   8.344
  190   2HE2  GLN  22          1HE2      GLN  22   9.358  -6.616   7.119
  191    QB   GLN  22           QB       GLN  22  10.871  -3.359   6.071
  192    QG   GLN  22           QG       GLN  22  10.501  -5.506   4.885
  193    QE2  GLN  22           QE2      GLN  22   9.978  -6.722   7.731
  194    H    ASN  23           H        ASN  23   8.703  -4.569   3.136
  195    HA   ASN  23           HA       ASN  23   6.099  -3.092   3.297
  196   1HB   ASN  23          1HB       ASN  23   7.675  -4.152   0.956
  197   2HB   ASN  23          2HB       ASN  23   5.930  -4.284   0.926
  198   1HD2  ASN  23          2HD2      ASN  23   7.437  -0.657   0.184
  199   2HD2  ASN  23          1HD2      ASN  23   8.559  -1.886   0.718
  200    QB   ASN  23           QB       ASN  23   6.802  -4.218   0.941
  201    QD2  ASN  23           QD2      ASN  23   7.998  -1.272   0.451
  202    H    TRP  24           H        TRP  24   7.827  -6.187   3.167
  203    HA   TRP  24           HA       TRP  24   5.330  -7.788   3.059
  204   1HB   TRP  24          1HB       TRP  24   8.354  -8.137   2.666
  205   2HB   TRP  24          2HB       TRP  24   7.360  -9.511   3.026
  206    HD1  TRP  24           HD       TRP  24   8.648  -7.804   0.171
  207    HE1  TRP  24          1HE       TRP  24   7.577  -8.671  -1.975
  208    HE3  TRP  24          3HE       TRP  24   4.697 -10.317   2.238
  209    HZ2  TRP  24          2HZ       TRP  24   5.297 -10.264  -2.705
  210    HZ3  TRP  24          3HZ       TRP  24   3.112 -11.529   0.780
  211    HH2  TRP  24           HH       TRP  24   3.416 -11.525  -1.680
  212    QB   TRP  24           QB       TRP  24   7.857  -8.824   2.846
  213    H    ASN  25           H        ASN  25   6.102  -9.937   4.578
  214    HA   ASN  25           HA       ASN  25   6.943 -10.883   6.383
  215   1HB   ASN  25          1HB       ASN  25   8.957  -9.674   6.419
  216   2HB   ASN  25          2HB       ASN  25   8.206  -8.210   7.036
  217   1HD2  ASN  25          2HD2      ASN  25   8.353  -9.076  10.414
  218   2HD2  ASN  25          1HD2      ASN  25   7.912  -7.884   9.238
  219    QB   ASN  25           QB       ASN  25   8.581  -8.942   6.727
  220    QD2  ASN  25           QD2      ASN  25   8.133  -8.480   9.826
  221    H    THR  26           H        THR  26   5.456  -7.775   7.342
  222    HA   THR  26           HA       THR  26   3.417  -9.023   8.711
  223    HB   THR  26           HB       THR  26   5.486  -9.504  10.331
  224    HG1  THR  26          1HG       THR  26   3.832  -9.594  11.982
  225   1HG2  THR  26          3HG2      THR  26   6.002  -7.082  10.745
  226   2HG2  THR  26          1HG2      THR  26   4.446  -6.966  11.596
  227   3HG2  THR  26          2HG2      THR  26   5.691  -8.064  12.188
  228    QG2  THR  26           QG2      THR  26   5.380  -7.371  11.509
  229    H    CYS  27           H        CYS  27   2.088  -7.700   9.806
  230    HA   CYS  27           HA       CYS  27   1.218  -5.252   9.053
  231   1HB   CYS  27          1HB       CYS  27  -0.009  -6.528  10.521
  232   2HB   CYS  27          2HB       CYS  27   1.277  -6.664  11.721
  233    QB   CYS  27           QB       CYS  27   0.634  -6.596  11.121
  234    H    VAL  28           H        VAL  28   2.082  -3.291   8.850
  235    HA   VAL  28           HA       VAL  28   4.095  -2.258  10.789
  236    HB   VAL  28           HB       VAL  28   4.038  -2.405   7.786
  237   1HG1  VAL  28          1HG1      VAL  28   5.479  -0.120   9.148
  238   2HG1  VAL  28          2HG1      VAL  28   5.679  -0.631   7.469
  239   3HG1  VAL  28          3HG1      VAL  28   4.127  -0.008   7.998
  240   1HG2  VAL  28          1HG2      VAL  28   6.186  -2.696   9.932
  241   2HG2  VAL  28          2HG2      VAL  28   5.553  -3.938   8.861
  242   3HG2  VAL  28          3HG2      VAL  28   6.582  -2.651   8.223
  243    QG1  VAL  28           QG1      VAL  28   5.095  -0.253   8.205
  244    QG2  VAL  28           QG2      VAL  28   6.107  -3.095   9.005
  245    QQG  VAL  28           QQG      VAL  28   5.601  -1.674   8.605
  246    H    GLY  29           H        GLY  29   3.934  -0.019  11.192
  247   1HA   GLY  29          1HA       GLY  29   1.276   1.089  10.992
  248   2HA   GLY  29          2HA       GLY  29   2.616   1.723  11.927
  249    QA   GLY  29           QA       GLY  29   1.946   1.406  11.459
  250    H    ILE  30           H        ILE  30   0.798   3.100   9.939
  251    HA   ILE  30           HA       ILE  30   2.858   4.310   8.166
  252    HB   ILE  30           HB       ILE  30   0.099   3.174   7.498
  253   1HG1  ILE  30          1HG1      ILE  30   1.605   2.633   5.366
  254   2HG1  ILE  30          2HG1      ILE  30   2.940   2.846   6.511
  255   1HG2  ILE  30          3HG2      ILE  30   1.541   5.272   5.855
  256   2HG2  ILE  30          1HG2      ILE  30   0.157   4.302   5.320
  257   3HG2  ILE  30          2HG2      ILE  30  -0.053   5.430   6.642
  258   1HD1  ILE  30          3HD1      ILE  30   1.880   0.989   7.863
  259   2HD1  ILE  30          1HD1      ILE  30   0.755   0.805   6.503
  260   3HD1  ILE  30          2HD1      ILE  30   2.479   0.537   6.263
  261    QG1  ILE  30           QG1      ILE  30   2.273   2.740   5.938
  262    QG2  ILE  30           QG2      ILE  30   0.549   5.002   5.939
  263    QD1  ILE  30           QD1      ILE  30   1.705   0.777   6.876
  264    H    GLY  31           H        GLY  31   2.445   6.522   7.624
  265   1HA   GLY  31          1HA       GLY  31   0.117   7.900   7.937
  266   2HA   GLY  31          2HA       GLY  31   0.966   8.160   9.478
  267    QA   GLY  31           QA       GLY  31   0.542   8.030   8.707
  268    H    ALA  32           H        ALA  32   0.856  10.397   8.485
  269    HA   ALA  32           HA       ALA  32   2.028  12.193   8.179
  270   1HB   ALA  32          2HB       ALA  32   3.697  11.028   9.592
  271   2HB   ALA  32          3HB       ALA  32   4.504  10.419   8.128
  272   3HB   ALA  32          1HB       ALA  32   4.457  12.163   8.459
  273    QB   ALA  32           QB       ALA  32   4.220  11.203   8.726
  274    H    ASN  33           H        ASN  33   0.920  12.543   6.361
  275    HA   ASN  33           HA       ASN  33   0.758  13.532   4.340
  276   1HB   ASN  33          1HB       ASN  33   3.790  13.350   4.086
  277   2HB   ASN  33          2HB       ASN  33   2.697  14.288   3.071
  278   1HD2  ASN  33          2HD2      ASN  33   4.176  16.668   5.448
  279   2HD2  ASN  33          1HD2      ASN  33   4.792  15.660   4.152
  280    QB   ASN  33           QB       ASN  33   3.244  13.819   3.579
  281    QD2  ASN  33           QD2      ASN  33   4.484  16.164   4.800
  282    H    VAL  34           H        VAL  34   1.486  10.440   4.860
  283    HA   VAL  34           HA       VAL  34   1.977   9.602   2.070
  284    HB   VAL  34           HB       VAL  34   1.411   8.035   4.613
  285   1HG1  VAL  34          3HG1      VAL  34   2.127   7.010   1.828
  286   2HG1  VAL  34          1HG1      VAL  34   2.018   6.040   3.315
  287   3HG1  VAL  34          2HG1      VAL  34   0.568   6.766   2.645
  288   1HG2  VAL  34          2HG2      VAL  34   3.936   8.412   2.928
  289   2HG2  VAL  34          3HG2      VAL  34   3.651   9.121   4.526
  290   3HG2  VAL  34          1HG2      VAL  34   3.791   7.368   4.354
  291    QG1  VAL  34           QG1      VAL  34   1.571   6.605   2.596
  292    QG2  VAL  34           QG2      VAL  34   3.793   8.300   3.936
  293    QQG  VAL  34           QQG      VAL  34   2.682   7.453   3.266
  294    H    HIS  35           H        HIS  35   0.327   9.703   0.636
  295    HA   HIS  35           HA       HIS  35  -2.002   8.082   1.186
  296   1HB   HIS  35          1HB       HIS  35  -3.680   9.631   0.431
  297   2HB   HIS  35          2HB       HIS  35  -2.988  10.202   1.947
  298    HD1  HIS  35          1HD       HIS  35  -4.212  11.716  -1.005
  299    HD2  HIS  35          2HD       HIS  35  -0.804  12.123   1.429
  300    HE1  HIS  35          1HE       HIS  35  -3.295  14.053  -1.403
  301    QB   HIS  35           QB       HIS  35  -3.334   9.917   1.189
  302    H    TRP  36           H        TRP  36   0.266   7.681  -0.330
  303    HA   TRP  36           HA       TRP  36  -1.143   7.142  -2.845
  304   1HB   TRP  36          1HB       TRP  36   1.481   8.667  -2.651
  305   2HB   TRP  36          2HB       TRP  36   0.850   7.932  -4.126
  306    HD1  TRP  36           HD       TRP  36   0.157  10.837  -1.720
  307    HE1  TRP  36          1HE       TRP  36  -1.409  12.528  -2.851
  308    HE3  TRP  36          3HE       TRP  36  -1.187   8.046  -5.761
  309    HZ2  TRP  36          2HZ       TRP  36  -3.186  12.573  -5.126
  310    HZ3  TRP  36          3HZ       TRP  36  -3.006   8.846  -7.268
  311    HH2  TRP  36           HH       TRP  36  -3.932  11.133  -7.019
  312    QB   TRP  36           QB       TRP  36   1.165   8.299  -3.388
  313    H    MET  37           H        MET  37  -0.571   5.184  -3.600
  314    HA   MET  37           HA       MET  37   1.786   3.769  -2.443
  315   1HB   MET  37          1HB       MET  37  -0.434   2.802  -1.767
  316   2HB   MET  37          2HB       MET  37  -0.804   2.548  -3.484
  317   1HG   MET  37          1HG       MET  37   0.231   0.574  -3.378
  318   2HG   MET  37          2HG       MET  37   1.759   1.364  -2.974
  319   1HE   MET  37          1HE       MET  37   1.273   2.720  -0.319
  320   2HE   MET  37          2HE       MET  37   1.575   1.496   0.903
  321   3HE   MET  37          3HE       MET  37   2.680   1.633  -0.482
  322    QB   MET  37           QB       MET  37  -0.619   2.675  -2.626
  323    QG   MET  37           QG       MET  37   0.995   0.969  -3.176
  324    QE   MET  37           QE       MET  37   1.843   1.949   0.034
  325    H    VAL  38           H        VAL  38   3.230   3.273  -4.059
  326    HA   VAL  38           HA       VAL  38   2.247   3.499  -6.873
  327    HB   VAL  38           HB       VAL  38   4.908   4.643  -6.003
  328   1HG1  VAL  38          1HG1      VAL  38   4.464   4.084  -8.430
  329   2HG1  VAL  38          2HG1      VAL  38   3.058   5.170  -8.380
  330   3HG1  VAL  38          3HG1      VAL  38   4.678   5.822  -8.136
  331   1HG2  VAL  38          3HG2      VAL  38   2.238   6.119  -6.259
  332   2HG2  VAL  38          1HG2      VAL  38   3.224   5.989  -4.789
  333   3HG2  VAL  38          2HG2      VAL  38   3.825   6.902  -6.175
  334    QG1  VAL  38           QG1      VAL  38   4.066   5.025  -8.315
  335    QG2  VAL  38           QG2      VAL  38   3.096   6.337  -5.741
  336    QQG  VAL  38           QQG      VAL  38   3.581   5.681  -7.028
  337    H    THR  39           H        THR  39   2.570   1.666  -7.870
  338    HA   THR  39           HA       THR  39   4.645  -0.249  -6.852
  339    HB   THR  39           HB       THR  39   2.989  -1.748  -8.395
  340    HG1  THR  39          1HG       THR  39   1.457  -0.304  -8.939
  341   1HG2  THR  39          2HG2      THR  39   3.486  -2.094  -5.980
  342   2HG2  THR  39          3HG2      THR  39   2.195  -0.897  -5.615
  343   3HG2  THR  39          1HG2      THR  39   1.800  -2.427  -6.427
  344    QG2  THR  39           QG2      THR  39   2.494  -1.806  -6.007
  345    H    GLY  40           H        GLY  40   6.082  -1.191  -8.366
  346   1HA   GLY  40          1HA       GLY  40   5.788  -1.953 -10.776
  347   2HA   GLY  40          2HA       GLY  40   5.861  -0.225 -11.204
  348    QA   GLY  40           QA       GLY  40   5.825  -1.089 -10.990
  349    H    GLY  41           H        GLY  41   7.620  -0.407 -12.470
  350   1HA   GLY  41          1HA       GLY  41   9.869  -0.139 -12.846
  351   2HA   GLY  41          2HA       GLY  41  10.251  -0.645 -11.197
  352    QA   GLY  41           QA       GLY  41  10.060  -0.392 -12.021
  353    H    SER  42           H        SER  42   8.154  -2.536 -13.613
  354    HA   SER  42           HA       SER  42  10.441  -4.463 -13.857
  355   1HB   SER  42          1HB       SER  42   8.358  -5.966 -14.202
  356   2HB   SER  42          2HB       SER  42   8.811  -5.488 -12.555
  357    HG   SER  42           HG       SER  42   6.678  -5.071 -12.661
  358    QB   SER  42           QB       SER  42   8.584  -5.727 -13.378
  359    H    THR  43           H        THR  43   7.337  -4.257 -15.333
  360    HA   THR  43           HA       THR  43   8.056  -2.634 -17.570
  361    HB   THR  43           HB       THR  43   7.030  -4.299 -19.245
  362    HG1  THR  43          1HG       THR  43   7.251  -6.468 -18.789
  363   1HG2  THR  43          3HG2      THR  43   9.464  -3.608 -19.235
  364   2HG2  THR  43          1HG2      THR  43   9.805  -5.094 -18.322
  365   3HG2  THR  43          2HG2      THR  43   9.131  -5.193 -19.952
  366    QG2  THR  43           QG2      THR  43   9.466  -4.632 -19.170
  367    H    ASP  44           H        ASP  44   5.811  -5.261 -17.066
  368    HA   ASP  44           HA       ASP  44   3.923  -3.825 -15.519
  369   1HB   ASP  44          1HB       ASP  44   3.359  -3.161 -17.974
  370   2HB   ASP  44          2HB       ASP  44   2.951  -4.863 -18.245
  371    QB   ASP  44           QB       ASP  44   3.155  -4.012 -18.110
  372    H    GLY  45           H        GLY  45   1.917  -5.492 -15.379
  373   1HA   GLY  45          1HA       GLY  45   1.022  -7.540 -15.372
  374   2HA   GLY  45          2HA       GLY  45   2.435  -8.184 -16.230
  375    QA   GLY  45           QA       GLY  45   1.729  -7.862 -15.801
  376    H    LYS  46           H        LYS  46   2.877  -6.522 -13.236
  377    HA   LYS  46           HA       LYS  46   2.997  -9.016 -11.593
  378   1HB   LYS  46          1HB       LYS  46   4.893  -6.685 -11.574
  379   2HB   LYS  46          2HB       LYS  46   4.921  -8.204 -10.601
  380   1HG   LYS  46          1HG       LYS  46   4.999  -9.393 -12.870
  381   2HG   LYS  46          2HG       LYS  46   5.422  -7.851 -13.618
  382   1HD   LYS  46          1HD       LYS  46   7.478  -7.657 -12.533
  383   2HD   LYS  46          2HD       LYS  46   7.057  -8.761 -11.228
  384   1HE   LYS  46          1HE       LYS  46   8.743  -9.648 -12.867
  385   2HE   LYS  46          2HE       LYS  46   7.349 -10.697 -12.580
  386   1HZ   LYS  46          1HZ       LYS  46   7.521  -8.874 -14.918
  387   2HZ   LYS  46          2HZ       LYS  46   8.039 -10.404 -14.919
  388   3HZ   LYS  46          3HZ       LYS  46   6.465 -10.134 -14.667
  389    QB   LYS  46           QB       LYS  46   4.907  -7.445 -11.088
  390    QG   LYS  46           QG       LYS  46   5.211  -8.622 -13.244
  391    QD   LYS  46           QD       LYS  46   7.268  -8.209 -11.880
  392    QE   LYS  46           QE       LYS  46   8.046 -10.173 -12.724
  393    QZ   LYS  46           QZ       LYS  46   7.342  -9.804 -14.835
  394    H    GLN  47           H        GLN  47   0.950  -7.505 -11.699
  395    HA   GLN  47           HA       GLN  47   0.620  -5.449  -9.726
  396   1HB   GLN  47          1HB       GLN  47  -1.720  -5.989  -9.604
  397   2HB   GLN  47          2HB       GLN  47  -1.244  -6.237 -11.287
  398   1HG   GLN  47          1HG       GLN  47  -1.043  -8.722 -10.769
  399   2HG   GLN  47          2HG       GLN  47  -1.667  -8.404  -9.148
  400   1HE2  GLN  47          2HE2      GLN  47  -5.031  -8.230 -10.218
  401   2HE2  GLN  47          1HE2      GLN  47  -3.931  -8.371  -8.862
  402    QB   GLN  47           QB       GLN  47  -1.482  -6.113 -10.445
  403    QG   GLN  47           QG       GLN  47  -1.355  -8.563  -9.959
  404    QE2  GLN  47           QE2      GLN  47  -4.481  -8.300  -9.540
  405    H    GLY  48           H        GLY  48  -0.138  -5.601  -7.521
  406   1HA   GLY  48          1HA       GLY  48  -0.288  -8.182  -6.278
  407   2HA   GLY  48          2HA       GLY  48   1.117  -7.259  -5.724
  408    QA   GLY  48           QA       GLY  48   0.415  -7.721  -6.001
  409    H    CYS  49           H        CYS  49  -0.527  -7.528  -3.707
  410    HA   CYS  49           HA       CYS  49  -2.274  -5.181  -3.592
  411   1HB   CYS  49          1HB       CYS  49  -2.947  -7.985  -2.607
  412   2HB   CYS  49          2HB       CYS  49  -3.998  -6.600  -2.523
  413    QB   CYS  49           QB       CYS  49  -3.473  -7.293  -2.565
  414    H    ALA  50           H        ALA  50  -2.744  -4.457  -1.658
  415    HA   ALA  50           HA       ALA  50  -1.117  -5.397   0.638
  416   1HB   ALA  50          1HB       ALA  50  -1.978  -2.560  -0.102
  417   2HB   ALA  50          2HB       ALA  50  -1.291  -3.027   1.460
  418   3HB   ALA  50          3HB       ALA  50  -0.308  -3.169  -0.015
  419    QB   ALA  50           QB       ALA  50  -1.192  -2.919   0.448
  420    H    THR  51           H        THR  51  -2.306  -5.906   2.392
  421    HA   THR  51           HA       THR  51  -5.238  -5.352   2.357
  422    HB   THR  51           HB       THR  51  -3.515  -6.659   4.520
  423    HG1  THR  51          1HG       THR  51  -3.940  -7.679   2.239
  424   1HG2  THR  51          3HG2      THR  51  -6.533  -6.606   4.012
  425   2HG2  THR  51          1HG2      THR  51  -5.721  -7.512   5.303
  426   3HG2  THR  51          2HG2      THR  51  -5.673  -5.745   5.309
  427    QG2  THR  51           QG2      THR  51  -5.976  -6.621   4.875
  428    H    ILE  52           H        ILE  52  -5.580  -3.233   2.851
  429    HA   ILE  52           HA       ILE  52  -3.648  -1.740   4.542
  430    HB   ILE  52           HB       ILE  52  -5.989  -0.727   2.879
  431   1HG1  ILE  52          1HG1      ILE  52  -3.034  -0.848   2.117
  432   2HG1  ILE  52          2HG1      ILE  52  -4.358  -1.742   1.351
  433   1HG2  ILE  52          1HG2      ILE  52  -5.156   0.739   4.780
  434   2HG2  ILE  52          2HG2      ILE  52  -3.591   0.823   3.955
  435   3HG2  ILE  52          3HG2      ILE  52  -5.054   1.458   3.177
  436   1HD1  ILE  52          2HD1      ILE  52  -5.404   0.409   0.668
  437   2HD1  ILE  52          3HD1      ILE  52  -3.988   1.277   1.288
  438   3HD1  ILE  52          1HD1      ILE  52  -3.797   0.138  -0.040
  439    QG1  ILE  52           QG1      ILE  52  -3.696  -1.295   1.734
  440    QG2  ILE  52           QG2      ILE  52  -4.600   1.006   3.970
  441    QD1  ILE  52           QD1      ILE  52  -4.396   0.608   0.639
  442    H    TRP  53           H        TRP  53  -4.450  -0.748   6.496
  443    HA   TRP  53           HA       TRP  53  -7.192  -1.478   7.289
  444   1HB   TRP  53          1HB       TRP  53  -4.653  -1.755   8.910
  445   2HB   TRP  53          2HB       TRP  53  -6.221  -1.613   9.674
  446    HD1  TRP  53           HD       TRP  53  -7.812  -3.674   9.760
  447    HE1  TRP  53          1HE       TRP  53  -7.406  -6.163   9.464
  448    HE3  TRP  53          3HE       TRP  53  -3.289  -3.428   7.433
  449    HZ2  TRP  53          2HZ       TRP  53  -5.291  -7.875   8.389
  450    HZ3  TRP  53          3HZ       TRP  53  -2.053  -5.509   6.832
  451    HH2  TRP  53           HH       TRP  53  -3.024  -7.712   7.368
  452    QB   TRP  53           QB       TRP  53  -5.437  -1.684   9.292
  453    H    GLU  54           H        GLU  54  -8.153  -0.214   8.802
  454    HA   GLU  54           HA       GLU  54  -7.500   2.613   8.845
  455   1HB   GLU  54          1HB       GLU  54  -9.824   1.874   8.700
  456   2HB   GLU  54          2HB       GLU  54  -9.600   0.744  10.020
  457   1HG   GLU  54          1HG       GLU  54 -11.032   2.507  10.739
  458   2HG   GLU  54          2HG       GLU  54  -9.534   2.522  11.657
  459    QB   GLU  54           QB       GLU  54  -9.712   1.309   9.360
  460    QG   GLU  54           QG       GLU  54 -10.283   2.514  11.198
  461    H    GLY  55           H        GLY  55  -7.438  -0.048  11.218
  462   1HA   GLY  55          1HA       GLY  55  -6.890   1.558  13.493
  463   2HA   GLY  55          2HA       GLY  55  -6.518  -0.158  13.309
  464    QA   GLY  55           QA       GLY  55  -6.704   0.700  13.401
  465    H    SER  56           H        SER  56  -4.820   1.653  14.718
  466    HA   SER  56           HA       SER  56  -2.683   2.457  12.894
  467   1HB   SER  56          1HB       SER  56  -2.575   2.414  15.947
  468   2HB   SER  56          2HB       SER  56  -1.732   3.486  14.820
  469    HG   SER  56           HG       SER  56  -4.517   3.392  15.416
  470    QB   SER  56           QB       SER  56  -2.153   2.950  15.383
  471    H    GLY  57           H        GLY  57  -2.791  -0.117  12.367
  472   1HA   GLY  57          1HA       GLY  57  -0.718  -1.622  12.442
  473   2HA   GLY  57          2HA       GLY  57  -1.059  -1.566  14.178
  474    QA   GLY  57           QA       GLY  57  -0.889  -1.594  13.310
  475    H    CYS  58           H        CYS  58  -2.803  -2.090  11.130
  476    HA   CYS  58           HA       CYS  58  -4.165  -3.681  10.465
  477   1HB   CYS  58          1HB       CYS  58  -3.316  -5.985  10.798
  478   2HB   CYS  58          2HB       CYS  58  -2.105  -4.829  10.291
  479    QB   CYS  58           QB       CYS  58  -2.710  -5.407  10.545
  480    H    VAL  59           H        VAL  59  -5.420  -2.475  12.692
  481    HA   VAL  59           HA       VAL  59  -7.312  -4.660  13.190
  482    HB   VAL  59           HB       VAL  59  -7.877  -3.494  15.254
  483   1HG1  VAL  59          2HG1      VAL  59  -6.421  -5.520  15.273
  484   2HG1  VAL  59          3HG1      VAL  59  -4.990  -4.469  15.262
  485   3HG1  VAL  59          1HG1      VAL  59  -6.092  -4.449  16.646
  486   1HG2  VAL  59          1HG2      VAL  59  -5.351  -1.857  14.889
  487   2HG2  VAL  59          2HG2      VAL  59  -7.040  -1.290  15.062
  488   3HG2  VAL  59          3HG2      VAL  59  -6.224  -2.056  16.413
  489    QG1  VAL  59           QG1      VAL  59  -5.834  -4.812  15.727
  490    QG2  VAL  59           QG2      VAL  59  -6.205  -1.734  15.455
  491    QQG  VAL  59           QQG      VAL  59  -6.020  -3.273  15.591
  492    H    GLY  60           H        GLY  60  -9.533  -3.525  13.558
  493   1HA   GLY  60          1HA       GLY  60 -11.069  -1.805  13.087
  494   2HA   GLY  60          2HA       GLY  60  -9.796  -0.867  12.295
  495    QA   GLY  60           QA       GLY  60 -10.433  -1.336  12.691
  496    H    ARG  61           H        ARG  61 -11.107  -0.568  10.402
  497    HA   ARG  61           HA       ARG  61 -12.146  -2.862   8.861
  498   1HB   ARG  61          1HB       ARG  61 -13.232  -0.580   8.788
  499   2HB   ARG  61          2HB       ARG  61 -11.747   0.068   8.077
  500   1HG   ARG  61          1HG       ARG  61 -12.005  -1.270   6.082
  501   2HG   ARG  61          2HG       ARG  61 -13.308  -2.231   6.821
  502   1HD   ARG  61          1HD       ARG  61 -14.723  -0.203   6.906
  503   2HD   ARG  61          2HD       ARG  61 -13.413   0.732   6.149
  504    HE   ARG  61           HE       ARG  61 -14.018  -1.547   4.515
  505   1HH1  ARG  61          2HH2      ARG  61 -15.415   1.588   5.463
  506   2HH1  ARG  61          1HH2      ARG  61 -16.565   1.616   4.153
  507   1HH2  ARG  61          2HH1      ARG  61 -15.449  -1.524   2.852
  508   2HH2  ARG  61          1HH1      ARG  61 -16.656  -0.267   2.643
  509    QB   ARG  61           QB       ARG  61 -12.490  -0.256   8.432
  510    QG   ARG  61           QG       ARG  61 -12.656  -1.750   6.451
  511    QD   ARG  61           QD       ARG  61 -14.068   0.264   6.528
  512    QH1  ARG  61           QH2      ARG  61 -15.990   1.602   4.808
  513    QH2  ARG  61           QH1      ARG  61 -16.052  -0.895   2.747
  514    H    SER  62           H        SER  62 -11.318  -3.613   6.897
  515    HA   SER  62           HA       SER  62  -8.859  -2.298   6.162
  516   1HB   SER  62          1HB       SER  62  -7.933  -4.597   5.379
  517   2HB   SER  62          2HB       SER  62  -7.957  -4.302   7.072
  518    HG   SER  62           HG       SER  62  -9.793  -5.550   7.334
  519    QB   SER  62           QB       SER  62  -7.945  -4.449   6.225
  520    H    THR  63           H        THR  63  -8.244  -2.734   3.892
  521    HA   THR  63           HA       THR  63 -10.378  -3.937   2.266
  522    HB   THR  63           HB       THR  63 -10.293  -1.242   2.265
  523    HG1  THR  63          1HG       THR  63 -11.439  -1.353   0.438
  524   1HG2  THR  63          1HG2      THR  63  -7.960  -1.164   1.264
  525   2HG2  THR  63          2HG2      THR  63  -8.603  -2.012  -0.162
  526   3HG2  THR  63          3HG2      THR  63  -9.201  -0.404   0.247
  527    QG2  THR  63           QG2      THR  63  -8.588  -1.193   0.450
  528    H    THR  64           H        THR  64  -9.463  -4.789   0.201
  529    HA   THR  64           HA       THR  64  -6.589  -5.530   0.523
  530    HB   THR  64           HB       THR  64  -7.357  -7.446  -0.908
  531    HG1  THR  64          1HG       THR  64  -9.384  -7.869  -1.164
  532   1HG2  THR  64          1HG2      THR  64  -8.524  -7.050   1.901
  533   2HG2  THR  64          2HG2      THR  64  -8.315  -8.617   1.095
  534   3HG2  THR  64          3HG2      THR  64  -6.903  -7.625   1.512
  535    QG2  THR  64           QG2      THR  64  -7.914  -7.764   1.503
  536    H    MET  65           H        MET  65  -5.835  -3.663  -0.386
  537    HA   MET  65           HA       MET  65  -7.103  -2.626  -2.873
  538   1HB   MET  65          1HB       MET  65  -6.330  -1.237  -0.778
  539   2HB   MET  65          2HB       MET  65  -4.719  -1.373  -1.496
  540   1HG   MET  65          1HG       MET  65  -7.212  -0.231  -2.835
  541   2HG   MET  65          2HG       MET  65  -5.939   0.730  -2.084
  542   1HE   MET  65          1HE       MET  65  -7.215   0.970  -5.089
  543   2HE   MET  65          2HE       MET  65  -6.079   2.154  -4.396
  544   3HE   MET  65          3HE       MET  65  -5.758   1.419  -5.988
  545    QB   MET  65           QB       MET  65  -5.524  -1.305  -1.137
  546    QG   MET  65           QG       MET  65  -6.575   0.250  -2.459
  547    QE   MET  65           QE       MET  65  -6.351   1.514  -5.158
  548    H    CYS  66           H        CYS  66  -6.021  -2.742  -4.906
  549    HA   CYS  66           HA       CYS  66  -3.459  -4.272  -4.944
  550   1HB   CYS  66          1HB       CYS  66  -5.879  -4.726  -6.675
  551   2HB   CYS  66          2HB       CYS  66  -4.345  -5.585  -6.827
  552    QB   CYS  66           QB       CYS  66  -5.112  -5.155  -6.751
  553    H    CYS  67           H        CYS  67  -2.000  -3.536  -6.400
  554    HA   CYS  67           HA       CYS  67  -2.839  -1.203  -8.111
  555   1HB   CYS  67          1HB       CYS  67  -1.949  -0.580  -5.780
  556   2HB   CYS  67          2HB       CYS  67  -0.377  -1.070  -6.418
  557    QB   CYS  67           QB       CYS  67  -1.163  -0.825  -6.099
  558    HA   PRO  68           HA       PRO  68  -0.440  -3.922 -10.756
  559   1HB   PRO  68          1HB       PRO  68  -0.980  -1.806 -12.820
  560   2HB   PRO  68          2HB       PRO  68  -1.051  -3.579 -12.950
  561   1HG   PRO  68          1HG       PRO  68  -3.355  -2.215 -12.603
  562   2HG   PRO  68          2HG       PRO  68  -3.040  -3.702 -11.670
  563   1HD   PRO  68          1HD       PRO  68  -2.697  -0.853 -10.712
  564   2HD   PRO  68          2HD       PRO  68  -3.495  -2.231  -9.922
  565    QB   PRO  68           QB       PRO  68  -1.015  -2.693 -12.885
  566    QG   PRO  68           QG       PRO  68  -3.198  -2.959 -12.137
  567    QD   PRO  68           QD       PRO  68  -3.096  -1.542 -10.317
  568    H    ALA  69           H        ALA  69   1.464  -3.779 -12.266
  569    HA   ALA  69           HA       ALA  69   3.523  -2.671 -10.618
  570   1HB   ALA  69          2HB       ALA  69   3.461  -4.934 -11.608
  571   2HB   ALA  69          3HB       ALA  69   3.713  -4.253 -13.218
  572   3HB   ALA  69          1HB       ALA  69   4.971  -4.086 -11.967
  573    QB   ALA  69           QB       ALA  69   4.048  -4.424 -12.264
  574    H    ASN  70           H        ASN  70   2.559  -0.466 -11.457
  575    HA   ASN  70           HA       ASN  70   4.230   1.340 -12.646
  576   1HB   ASN  70          1HB       ASN  70   3.188   1.482 -15.058
  577   2HB   ASN  70          2HB       ASN  70   4.362   0.222 -14.782
  578   1HD2  ASN  70          2HD2      ASN  70   2.299  -2.430 -15.374
  579   2HD2  ASN  70          1HD2      ASN  70   3.905  -1.722 -15.325
  580    QB   ASN  70           QB       ASN  70   3.775   0.852 -14.920
  581    QD2  ASN  70           QD2      ASN  70   3.102  -2.076 -15.350
  582    H    THR  71           H        THR  71   1.611   0.712 -10.988
  583    HA   THR  71           HA       THR  71  -0.073   2.899 -12.103
  584    HB   THR  71           HB       THR  71  -0.754   0.622 -10.233
  585    HG1  THR  71          1HG       THR  71  -0.416   0.326 -12.624
  586   1HG2  THR  71          1HG2      THR  71  -2.105   2.717  -9.825
  587   2HG2  THR  71          2HG2      THR  71  -2.539   2.731 -11.534
  588   3HG2  THR  71          3HG2      THR  71  -3.089   1.417 -10.477
  589    QG2  THR  71           QG2      THR  71  -2.578   2.288 -10.612
  590    H    CYS  72           H        CYS  72  -0.280   4.671 -10.931
  591    HA   CYS  72           HA       CYS  72   0.716   4.827  -8.120
  592   1HB   CYS  72          1HB       CYS  72   1.413   6.816  -9.198
  593   2HB   CYS  72          2HB       CYS  72   0.034   6.792 -10.308
  594    QB   CYS  72           QB       CYS  72   0.724   6.804  -9.753
  595    H    CYS  73           H        CYS  73  -0.826   4.593  -6.540
  596    HA   CYS  73           HA       CYS  73  -3.728   4.659  -7.241
  597   1HB   CYS  73          1HB       CYS  73  -2.187   2.804  -5.371
  598   2HB   CYS  73          2HB       CYS  73  -3.932   2.983  -5.437
  599    QB   CYS  73           QB       CYS  73  -3.059   2.894  -5.404
  600    H    ASN  74           H        ASN  74  -4.976   5.926  -5.801
  601    HA   ASN  74           HA       ASN  74  -3.453   7.661  -3.983
  602   1HB   ASN  74          1HB       ASN  74  -5.024   8.750  -5.475
  603   2HB   ASN  74          2HB       ASN  74  -6.326   7.684  -4.937
  604   1HD2  ASN  74          2HD2      ASN  74  -5.167  10.063  -1.841
  605   2HD2  ASN  74          1HD2      ASN  74  -3.882   9.271  -2.722
  606    QB   ASN  74           QB       ASN  74  -5.675   8.217  -5.206
  607    QD2  ASN  74           QD2      ASN  74  -4.525   9.667  -2.282
  608    H    ILE  75           H        ILE  75  -3.198   7.069  -1.909
  609    HA   ILE  75           HA       ILE  75  -5.053   5.199  -0.585
  610    HB   ILE  75           HB       ILE  75  -2.251   6.181  -0.123
  611   1HG1  ILE  75          1HG1      ILE  75  -1.744   3.919  -0.049
  612   2HG1  ILE  75          2HG1      ILE  75  -3.462   3.444   0.099
  613   1HG2  ILE  75          3HG2      ILE  75  -4.016   4.969   1.998
  614   2HG2  ILE  75          1HG2      ILE  75  -2.253   4.756   1.993
  615   3HG2  ILE  75          2HG2      ILE  75  -2.910   6.370   2.139
  616   1HD1  ILE  75          3HD1      ILE  75  -2.215   4.795  -2.285
  617   2HD1  ILE  75          1HD1      ILE  75  -2.522   3.035  -2.148
  618   3HD1  ILE  75          2HD1      ILE  75  -3.871   4.139  -2.200
  619    QG1  ILE  75           QG1      ILE  75  -2.603   3.681   0.025
  620    QG2  ILE  75           QG2      ILE  75  -3.060   5.365   2.044
  621    QD1  ILE  75           QD1      ILE  75  -2.869   3.990  -2.211
  622    H    ASN  76           H        ASN  76  -6.690   6.875  -1.046
  623    HA   ASN  76           HA       ASN  76  -7.223   8.062   1.631
  624   1HB   ASN  76          1HB       ASN  76  -7.870   9.438  -1.012
  625   2HB   ASN  76          2HB       ASN  76  -8.680   9.800   0.511
  626   1HD2  ASN  76          2HD2      ASN  76  -6.005  11.630   1.966
  627   2HD2  ASN  76          1HD2      ASN  76  -7.363  10.593   2.380
  628    QB   ASN  76           QB       ASN  76  -8.275   9.619  -0.251
  629    QD2  ASN  76           QD2      ASN  76  -6.684  11.112   2.173
  630    H    THR  77           H        THR  77  -8.002   5.732   1.677
  631    HA   THR  77           HA       THR  77 -10.340   5.099   0.060
  632    HB   THR  77           HB       THR  77 -10.334   3.415   2.269
  633    HG1  THR  77          1HG       THR  77  -8.530   3.974   3.240
  634   1HG2  THR  77          2HG2      THR  77  -8.702   3.183  -0.281
  635   2HG2  THR  77          3HG2      THR  77  -9.044   1.849   0.833
  636   3HG2  THR  77          1HG2      THR  77 -10.365   2.646  -0.036
  637    QG2  THR  77           QG2      THR  77  -9.370   2.559   0.172
  638    H    GLY  78           H        GLY  78 -12.368   4.393   1.523
  639   1HA   GLY  78          1HA       GLY  78 -13.434   6.877   2.462
  640   2HA   GLY  78          2HA       GLY  78 -14.207   5.307   2.557
  641    QA   GLY  78           QA       GLY  78 -13.821   6.092   2.509
  642    H    PHE  79           H        PHE  79 -11.895   4.132   4.043
  643    HA   PHE  79           HA       PHE  79 -12.247   5.320   6.753
  644   1HB   PHE  79          1HB       PHE  79 -10.748   3.442   7.420
  645   2HB   PHE  79          2HB       PHE  79 -12.334   2.943   6.899
  646    HD1  PHE  79          1HD       PHE  79 -12.509   2.053   4.379
  647    HD2  PHE  79          2HD       PHE  79  -8.823   2.371   6.604
  648    HE1  PHE  79          1HE       PHE  79 -11.314   0.805   2.609
  649    HE2  PHE  79          2HE       PHE  79  -7.637   1.158   4.830
  650   1HZ   PHE  79           HZ       PHE  79  -8.837   0.451   2.794
  651    QB   PHE  79           QB       PHE  79 -11.541   3.192   7.159
  652    QG   PHE  79           QD       PHE  79 -10.666   2.212   5.491
  653    QZ   PHE  79           QE       PHE  79  -9.475   0.981   3.719
  654    QZ   PHE  79           QR       PHE  79  -9.824   1.368   4.243
  655    H    TYR  80           H        TYR  80 -10.367   5.725   7.992
  656    HA   TYR  80           HA       TYR  80  -8.572   7.272   6.286
  657   1HB   TYR  80          1HB       TYR  80  -9.339   8.258   8.435
  658   2HB   TYR  80          2HB       TYR  80  -8.469   6.993   9.310
  659    HD1  TYR  80          2HD       TYR  80  -7.953   9.691   6.730
  660    HD2  TYR  80          1HD       TYR  80  -6.088   7.163   9.684
  661    HE1  TYR  80          2HE       TYR  80  -5.737  10.640   6.171
  662    HE2  TYR  80          1HE       TYR  80  -3.915   8.236   9.224
  663    HH   TYR  80           HH       TYR  80  -3.400  10.103   6.365
  664    QB   TYR  80           QB       TYR  80  -8.904   7.626   8.872
  665    QG   TYR  80           QD       TYR  80  -7.021   8.427   8.207
  666    QZ   TYR  80           QE       TYR  80  -4.826   9.438   7.698
  667    QR   TYR  80           QR       TYR  80  -5.923   8.933   7.952
  668    H    ILE  81           H        ILE  81  -6.130   6.723   6.583
  669    HA   ILE  81           HA       ILE  81  -5.919   3.781   6.663
  670    HB   ILE  81           HB       ILE  81  -3.973   4.327   5.126
  671   1HG1  ILE  81          1HG1      ILE  81  -4.616   6.933   5.422
  672   2HG1  ILE  81          2HG1      ILE  81  -4.114   6.332   3.897
  673   1HG2  ILE  81          1HG2      ILE  81  -6.926   4.234   4.396
  674   2HG2  ILE  81          2HG2      ILE  81  -5.607   3.921   3.232
  675   3HG2  ILE  81          3HG2      ILE  81  -5.841   2.889   4.650
  676   1HD1  ILE  81          1HD1      ILE  81  -7.073   6.476   4.593
  677   2HD1  ILE  81          2HD1      ILE  81  -6.154   7.761   3.805
  678   3HD1  ILE  81          3HD1      ILE  81  -6.324   6.158   3.033
  679    QG1  ILE  81           QG1      ILE  81  -4.365   6.632   4.660
  680    QG2  ILE  81           QG2      ILE  81  -6.125   3.681   4.093
  681    QD1  ILE  81           QD1      ILE  81  -6.517   6.798   3.810
  682    H    ARG  82           H        ARG  82  -4.499   2.987   8.077
  683    HA   ARG  82           HA       ARG  82  -2.306   4.736   9.057
  684   1HB   ARG  82          1HB       ARG  82  -4.562   4.871  10.399
  685   2HB   ARG  82          2HB       ARG  82  -4.011   3.350  11.109
  686   1HG   ARG  82          1HG       ARG  82  -2.027   4.410  11.978
  687   2HG   ARG  82          2HG       ARG  82  -2.262   5.852  10.967
  688   1HD   ARG  82          1HD       ARG  82  -4.213   6.551  12.172
  689   2HD   ARG  82          2HD       ARG  82  -4.421   4.958  12.877
  690    HE   ARG  82           HE       ARG  82  -3.127   5.458  14.602
  691   1HH1  ARG  82          2HH2      ARG  82  -2.204   7.685  12.002
  692   2HH1  ARG  82          1HH2      ARG  82  -0.988   8.505  12.991
  693   1HH2  ARG  82          2HH1      ARG  82  -1.433   6.552  15.836
  694   2HH2  ARG  82          1HH1      ARG  82  -0.654   7.942  15.093
  695    QB   ARG  82           QB       ARG  82  -4.286   4.111  10.754
  696    QG   ARG  82           QG       ARG  82  -2.145   5.131  11.473
  697    QD   ARG  82           QD       ARG  82  -4.317   5.754  12.524
  698    QH1  ARG  82           QH2      ARG  82  -1.596   8.095  12.497
  699    QH2  ARG  82           QH1      ARG  82  -1.043   7.247  15.464
  700    H    SER  83           H        SER  83  -3.291   1.564   8.273
  701    HA   SER  83           HA       SER  83  -0.407   1.028   8.309
  702   1HB   SER  83          1HB       SER  83  -0.915  -1.298   9.469
  703   2HB   SER  83          2HB       SER  83  -0.690   0.141  10.467
  704    HG   SER  83           HG       SER  83  -2.991   0.364  10.523
  705    QB   SER  83           QB       SER  83  -0.803  -0.579   9.968
  706    H    TYR  84           H        TYR  84   0.050  -1.239   7.268
  707    HA   TYR  84           HA       TYR  84  -2.070  -2.490   5.913
  708   1HB   TYR  84          1HB       TYR  84  -1.578  -2.056   3.637
  709   2HB   TYR  84          2HB       TYR  84  -1.740  -0.472   4.370
  710    HD1  TYR  84          2HD       TYR  84   0.574  -2.895   2.802
  711    HD2  TYR  84          1HD       TYR  84   0.048   1.107   4.271
  712    HE1  TYR  84          2HE       TYR  84   2.784  -2.294   1.899
  713    HE2  TYR  84          1HE       TYR  84   2.227   1.730   3.301
  714    HH   TYR  84           HH       TYR  84   4.375  -0.599   1.682
  715    QB   TYR  84           QB       TYR  84  -1.659  -1.264   4.004
  716    QG   TYR  84           QD       TYR  84   0.311  -0.894   3.536
  717    QZ   TYR  84           QE       TYR  84   2.505  -0.282   2.600
  718    QR   TYR  84           QR       TYR  84   1.408  -0.588   3.068
  719    H    ARG  85           H        ARG  85  -1.142  -4.290   4.485
  720    HA   ARG  85           HA       ARG  85   1.649  -4.334   4.329
  721   1HB   ARG  85          1HB       ARG  85   1.010  -5.620   6.657
  722   2HB   ARG  85          2HB       ARG  85   0.797  -6.960   5.533
  723   1HG   ARG  85          1HG       ARG  85   3.041  -6.933   6.434
  724   2HG   ARG  85          2HG       ARG  85   3.139  -6.581   4.717
  725   1HD   ARG  85          1HD       ARG  85   3.421  -4.154   5.202
  726   2HD   ARG  85          2HD       ARG  85   3.087  -4.442   6.924
  727    HE   ARG  85           HE       ARG  85   5.213  -6.005   6.461
  728   1HH1  ARG  85          2HH2      ARG  85   4.631  -2.594   5.691
  729   2HH1  ARG  85          1HH2      ARG  85   6.334  -2.213   5.581
  730   1HH2  ARG  85          2HH1      ARG  85   7.315  -5.515   6.429
  731   2HH2  ARG  85          1HH1      ARG  85   7.895  -3.848   6.417
  732    QB   ARG  85           QB       ARG  85   0.903  -6.290   6.095
  733    QG   ARG  85           QG       ARG  85   3.090  -6.757   5.576
  734    QD   ARG  85           QD       ARG  85   3.254  -4.298   6.063
  735    QH1  ARG  85           QH2      ARG  85   5.483  -2.403   5.636
  736    QH2  ARG  85           QH1      ARG  85   7.605  -4.682   6.423
  737    H    ARG  86           H        ARG  86   2.632  -5.651   2.793
  738    HA   ARG  86           HA       ARG  86   0.856  -6.189   0.583
  739   1HB   ARG  86          1HB       ARG  86   2.894  -5.352  -0.024
  740   2HB   ARG  86          2HB       ARG  86   3.820  -6.413   1.052
  741   1HG   ARG  86          1HG       ARG  86   3.777  -8.176  -0.350
  742   2HG   ARG  86          2HG       ARG  86   2.227  -7.800  -1.077
  743   1HD   ARG  86          1HD       ARG  86   4.636  -6.062  -1.674
  744   2HD   ARG  86          2HD       ARG  86   4.293  -7.582  -2.538
  745    HE   ARG  86           HE       ARG  86   1.912  -6.551  -2.767
  746   1HH1  ARG  86          2HH2      ARG  86   5.151  -5.708  -3.792
  747   2HH1  ARG  86          1HH2      ARG  86   4.629  -5.252  -5.379
  748   1HH2  ARG  86          2HH1      ARG  86   1.193  -5.208  -4.555
  749   2HH2  ARG  86          1HH1      ARG  86   2.398  -4.969  -5.816
  750    QB   ARG  86           QB       ARG  86   3.357  -5.883   0.514
  751    QG   ARG  86           QG       ARG  86   3.002  -7.988  -0.714
  752    QD   ARG  86           QD       ARG  86   4.465  -6.822  -2.106
  753    QH1  ARG  86           QH2      ARG  86   4.890  -5.480  -4.585
  754    QH2  ARG  86           QH1      ARG  86   1.796  -5.089  -5.186
  755    H    VAL  87           H        VAL  87  -0.016  -8.055  -0.051
  756    HA   VAL  87           HA       VAL  87   0.734 -10.570   1.382
  757    HB   VAL  87           HB       VAL  87  -1.526 -11.378   0.840
  758   1HG1  VAL  87          3HG1      VAL  87  -0.969 -10.493   3.083
  759   2HG1  VAL  87          1HG1      VAL  87  -1.434  -8.858   2.568
  760   3HG1  VAL  87          2HG1      VAL  87  -2.649 -10.149   2.648
  761   1HG2  VAL  87          3HG2      VAL  87  -1.989  -9.686  -1.014
  762   2HG2  VAL  87          1HG2      VAL  87  -3.264  -9.923   0.165
  763   3HG2  VAL  87          2HG2      VAL  87  -2.235  -8.472   0.254
  764    QG1  VAL  87           QG1      VAL  87  -1.684  -9.833   2.766
  765    QG2  VAL  87           QG2      VAL  87  -2.496  -9.360  -0.198
  766    QQG  VAL  87           QQG      VAL  87  -2.090  -9.597   1.284
  767    H    GLU  88           H        GLU  88   0.247  -9.004  -1.778
  768    HA   GLU  88           HA       GLU  88   1.811 -11.090  -3.043
  769   1HB   GLU  88          1HB       GLU  88   0.195 -11.066  -4.970
  770   2HB   GLU  88          2HB       GLU  88  -0.230 -12.119  -3.628
  771   1HG   GLU  88          1HG       GLU  88  -2.055 -10.855  -2.978
  772   2HG   GLU  88          2HG       GLU  88  -1.360  -9.343  -3.578
  773    QB   GLU  88           QB       GLU  88  -0.017 -11.593  -4.299
  774    QG   GLU  88           QG       GLU  88  -1.707 -10.099  -3.278
   
  No H/Q in entry =         774
  Start of MODEL   13
    1   1HA   GLY   1          1HA       GLY   1  16.750  -7.018  -7.297
    2   2HA   GLY   1          2HA       GLY   1  16.800  -5.249  -7.498
    3    QA   GLY   1           QA       GLY   1  16.775  -6.134  -7.398
    4    H    ASP   2           H        ASP   2  14.433  -6.746  -7.741
    5    HA   ASP   2           HA       ASP   2  13.831  -6.869 -10.676
    6   1HB   ASP   2          1HB       ASP   2  13.252  -8.930  -8.502
    7   2HB   ASP   2          2HB       ASP   2  12.652  -8.971 -10.161
    8    QB   ASP   2           QB       ASP   2  12.952  -8.950  -9.332
    9    H    GLY   3           H        GLY   3  12.924  -4.788 -10.264
   10   1HA   GLY   3          1HA       GLY   3  11.189  -3.420 -10.052
   11   2HA   GLY   3          2HA       GLY   3  10.126  -4.806  -9.732
   12    QA   GLY   3           QA       GLY   3  10.657  -4.113  -9.892
   13    H    TYR   4           H        TYR   4   9.125  -3.037  -8.233
   14    HA   TYR   4           HA       TYR   4  10.005  -3.458  -5.497
   15   1HB   TYR   4          1HB       TYR   4  10.121  -0.977  -4.957
   16   2HB   TYR   4          2HB       TYR   4  11.465  -1.613  -5.844
   17    HD1  TYR   4          1HD       TYR   4  11.768  -1.055  -8.318
   18    HD2  TYR   4          2HD       TYR   4   8.625   0.671  -5.916
   19    HE1  TYR   4          1HE       TYR   4  11.283   0.610 -10.102
   20    HE2  TYR   4          2HE       TYR   4   8.228   2.379  -7.656
   21    HH   TYR   4           HH       TYR   4  10.299   2.604 -10.561
   22    QB   TYR   4           QB       TYR   4  10.793  -1.295  -5.400
   23    QG   TYR   4           QD       TYR   4  10.197  -0.192  -7.117
   24    QZ   TYR   4           QE       TYR   4   9.756   1.495  -8.879
   25    QR   TYR   4           QR       TYR   4   9.976   0.651  -7.998
   26    H    LEU   5           H        LEU   5   8.493  -2.015  -4.088
   27    HA   LEU   5           HA       LEU   5   6.176  -0.861  -5.327
   28   1HB   LEU   5          1HB       LEU   5   5.504  -3.203  -5.385
   29   2HB   LEU   5          2HB       LEU   5   5.748  -3.376  -3.651
   30    HG   LEU   5           HG       LEU   5   3.918  -1.163  -4.572
   31   1HD1  LEU   5          1HD1      LEU   5   3.315  -3.042  -6.102
   32   2HD1  LEU   5          2HD1      LEU   5   3.051  -4.081  -4.695
   33   3HD1  LEU   5          3HD1      LEU   5   2.020  -2.668  -4.950
   34   1HD2  LEU   5          1HD2      LEU   5   3.924  -3.187  -2.302
   35   2HD2  LEU   5          2HD2      LEU   5   4.025  -1.415  -2.202
   36   3HD2  LEU   5          3HD2      LEU   5   2.515  -2.194  -2.698
   37    QB   LEU   5           QB       LEU   5   5.626  -3.290  -4.518
   38    QD1  LEU   5           QD1      LEU   5   2.795  -3.264  -5.249
   39    QD2  LEU   5           QD2      LEU   5   3.488  -2.265  -2.401
   40    QQD  LEU   5           QQD      LEU   5   3.142  -2.765  -3.825
   41    H    ILE   6           H        ILE   6   6.056   1.025  -4.221
   42    HA   ILE   6           HA       ILE   6   6.780   1.046  -1.318
   43    HB   ILE   6           HB       ILE   6   7.672   3.318  -1.739
   44   1HG1  ILE   6          1HG1      ILE   6   7.419   2.615  -4.697
   45   2HG1  ILE   6          2HG1      ILE   6   6.464   3.844  -3.834
   46   1HG2  ILE   6          1HG2      ILE   6   9.061   1.226  -1.633
   47   2HG2  ILE   6          2HG2      ILE   6   9.188   1.297  -3.405
   48   3HG2  ILE   6          3HG2      ILE   6   9.786   2.641  -2.408
   49   1HD1  ILE   6          3HD1      ILE   6   8.687   4.976  -3.290
   50   2HD1  ILE   6          1HD1      ILE   6   9.417   3.797  -4.401
   51   3HD1  ILE   6          2HD1      ILE   6   8.227   4.960  -5.009
   52    QG1  ILE   6           QG1      ILE   6   6.942   3.229  -4.266
   53    QG2  ILE   6           QG2      ILE   6   9.345   1.721  -2.482
   54    QD1  ILE   6           QD1      ILE   6   8.777   4.577  -4.233
   55    H    MET   7           H        MET   7   6.033   2.927  -0.233
   56    HA   MET   7           HA       MET   7   3.344   3.905  -1.032
   57   1HB   MET   7          1HB       MET   7   3.287   4.682   1.362
   58   2HB   MET   7          2HB       MET   7   3.205   2.938   1.145
   59   1HG   MET   7          1HG       MET   7   5.914   4.093   1.567
   60   2HG   MET   7          2HG       MET   7   4.816   4.067   2.942
   61   1HE   MET   7          3HE       MET   7   3.666   1.925   3.861
   62   2HE   MET   7          1HE       MET   7   4.757   0.546   4.169
   63   3HE   MET   7          2HE       MET   7   5.205   2.177   4.689
   64    QB   MET   7           QB       MET   7   3.246   3.810   1.253
   65    QG   MET   7           QG       MET   7   5.365   4.080   2.255
   66    QE   MET   7           QE       MET   7   4.543   1.549   4.240
   67    H    CYS   8           H        CYS   8   3.122   6.256  -1.008
   68    HA   CYS   8           HA       CYS   8   5.619   7.842  -0.692
   69   1HB   CYS   8          1HB       CYS   8   3.869   7.660  -3.179
   70   2HB   CYS   8          2HB       CYS   8   4.836   9.075  -2.826
   71    QB   CYS   8           QB       CYS   8   4.352   8.368  -3.002
   72    H    LYS   9           H        LYS   9   5.121  10.185  -0.701
   73    HA   LYS   9           HA       LYS   9   2.667  10.816   0.750
   74   1HB   LYS   9          1HB       LYS   9   4.956  12.565  -0.217
   75   2HB   LYS   9          2HB       LYS   9   3.619  13.074   0.834
   76   1HG   LYS   9          1HG       LYS   9   4.249  11.282   2.460
   77   2HG   LYS   9          2HG       LYS   9   5.669  10.900   1.459
   78   1HD   LYS   9          1HD       LYS   9   6.467  13.269   1.769
   79   2HD   LYS   9          2HD       LYS   9   5.035  13.588   2.761
   80   1HE   LYS   9          1HE       LYS   9   6.780  13.077   4.347
   81   2HE   LYS   9          2HE       LYS   9   5.749  11.650   4.277
   82   1HZ   LYS   9          3HZ       LYS   9   7.646  11.128   2.398
   83   2HZ   LYS   9          1HZ       LYS   9   8.485  11.940   3.573
   84   3HZ   LYS   9          2HZ       LYS   9   7.659  10.617   3.958
   85    QB   LYS   9           QB       LYS   9   4.287  12.819   0.309
   86    QG   LYS   9           QG       LYS   9   4.959  11.091   1.960
   87    QD   LYS   9           QD       LYS   9   5.751  13.429   2.265
   88    QE   LYS   9           QE       LYS   9   6.265  12.363   4.312
   89    QZ   LYS   9           QZ       LYS   9   7.930  11.228   3.310
   90    H    ASN  10           H        ASN  10   3.683  10.853  -2.596
   91    HA   ASN  10           HA       ASN  10   1.130  11.938  -3.480
   92   1HB   ASN  10          1HB       ASN  10   2.453  13.624  -4.969
   93   2HB   ASN  10          2HB       ASN  10   1.929  14.058  -3.355
   94   1HD2  ASN  10          2HD2      ASN  10   5.165  14.685  -2.153
   95   2HD2  ASN  10          1HD2      ASN  10   3.436  14.674  -1.862
   96    QB   ASN  10           QB       ASN  10   2.191  13.841  -4.162
   97    QD2  ASN  10           QD2      ASN  10   4.300  14.680  -2.007
   98    H    CYS  11           H        CYS  11   1.238  11.967  -5.926
   99    HA   CYS  11           HA       CYS  11   1.858   9.321  -6.775
  100   1HB   CYS  11          1HB       CYS  11   0.027  10.941  -7.530
  101   2HB   CYS  11          2HB       CYS  11   1.262  11.770  -8.467
  102    QB   CYS  11           QB       CYS  11   0.644  11.355  -7.998
  103    H    ASP  12           H        ASP  12   4.121  11.609  -6.237
  104    HA   ASP  12           HA       ASP  12   5.702  11.256  -8.715
  105   1HB   ASP  12          1HB       ASP  12   5.105  13.532  -7.992
  106   2HB   ASP  12          2HB       ASP  12   5.967  13.269  -6.469
  107    QB   ASP  12           QB       ASP  12   5.536  13.401  -7.230
  108    HA   PRO  13           HA       PRO  13   7.988   8.520  -5.753
  109   1HB   PRO  13          1HB       PRO  13   9.367   7.067  -7.663
  110   2HB   PRO  13          2HB       PRO  13   7.746   6.649  -7.068
  111   1HG   PRO  13          1HG       PRO  13   8.557   8.173  -9.560
  112   2HG   PRO  13          2HG       PRO  13   7.291   6.921  -9.435
  113   1HD   PRO  13          1HD       PRO  13   6.759   9.573  -9.514
  114   2HD   PRO  13          2HD       PRO  13   5.769   8.502  -8.495
  115    QB   PRO  13           QB       PRO  13   8.557   6.858  -7.366
  116    QG   PRO  13           QG       PRO  13   7.924   7.547  -9.498
  117    QD   PRO  13           QD       PRO  13   6.264   9.038  -9.004
  118    H    ASN  14           H        ASN  14   8.985  10.769  -8.217
  119    HA   ASN  14           HA       ASN  14  11.845  10.391  -7.918
  120   1HB   ASN  14          1HB       ASN  14  10.740  11.258 -10.000
  121   2HB   ASN  14          2HB       ASN  14  10.391  12.765  -9.133
  122   1HD2  ASN  14          2HD2      ASN  14  14.069  12.163 -10.701
  123   2HD2  ASN  14          1HD2      ASN  14  12.690  11.143 -11.022
  124    QB   ASN  14           QB       ASN  14  10.566  12.011  -9.566
  125    QD2  ASN  14           QD2      ASN  14  13.379  11.653 -10.861
  126    H    THR  15           H        THR  15   9.437  12.782  -6.835
  127    HA   THR  15           HA       THR  15  11.346  13.590  -4.660
  128    HB   THR  15           HB       THR  15  11.566  15.216  -6.343
  129    HG1  THR  15          1HG       THR  15  10.772  17.046  -5.264
  130   1HG2  THR  15          3HG2      THR  15   8.536  15.415  -6.454
  131   2HG2  THR  15          1HG2      THR  15   9.663  16.574  -7.187
  132   3HG2  THR  15          2HG2      THR  15   9.645  14.903  -7.747
  133    QG2  THR  15           QG2      THR  15   9.281  15.631  -7.130
  134    H    GLY  16           H        GLY  16   8.699  11.847  -4.796
  135   1HA   GLY  16          1HA       GLY  16   6.961  13.186  -2.983
  136   2HA   GLY  16          2HA       GLY  16   7.057  11.440  -3.163
  137    QA   GLY  16           QA       GLY  16   7.009  12.313  -3.073
  138    H    SER  17           H        SER  17  10.035  11.635  -2.389
  139    HA   SER  17           HA       SER  17  11.150  10.982  -0.552
  140   1HB   SER  17          1HB       SER  17   9.368  12.713   1.170
  141   2HB   SER  17          2HB       SER  17  10.977  12.092   1.529
  142    HG   SER  17           HG       SER  17  10.214  14.117  -0.320
  143    QB   SER  17           QB       SER  17  10.172  12.403   1.350
  144    H    CYS  18           H        CYS  18  10.521   8.913  -0.670
  145    HA   CYS  18           HA       CYS  18   7.808   8.053   0.228
  146   1HB   CYS  18          1HB       CYS  18   9.613   7.198  -2.092
  147   2HB   CYS  18          2HB       CYS  18   8.096   6.465  -1.645
  148    QB   CYS  18           QB       CYS  18   8.855   6.831  -1.868
  149    H    ASP  19           H        ASP  19   7.838   6.032   1.445
  150    HA   ASP  19           HA       ASP  19  10.549   5.327   2.322
  151   1HB   ASP  19          1HB       ASP  19   9.364   3.819   3.902
  152   2HB   ASP  19          2HB       ASP  19   9.301   5.571   4.097
  153    QB   ASP  19           QB       ASP  19   9.333   4.695   4.000
  154    H    TRP  20           H        TRP  20  11.592   4.338   0.832
  155    HA   TRP  20           HA       TRP  20  10.810   1.909  -0.593
  156   1HB   TRP  20          1HB       TRP  20  13.483   3.286  -0.179
  157   2HB   TRP  20          2HB       TRP  20  13.153   1.960  -1.287
  158    HD1  TRP  20           HD       TRP  20  12.515   5.708  -0.878
  159    HE1  TRP  20          1HE       TRP  20  11.891   6.749  -3.116
  160    HE3  TRP  20          3HE       TRP  20  12.218   1.438  -3.621
  161    HZ2  TRP  20          2HZ       TRP  20  11.319   5.812  -5.831
  162    HZ3  TRP  20          3HZ       TRP  20  11.926   1.560  -6.094
  163    HH2  TRP  20           HH       TRP  20  11.382   3.723  -7.184
  164    QB   TRP  20           QB       TRP  20  13.318   2.623  -0.733
  165    H    LYS  21           H        LYS  21  10.204   1.598   1.971
  166    HA   LYS  21           HA       LYS  21  12.310  -0.064   3.291
  167   1HB   LYS  21          1HB       LYS  21  10.166   1.736   4.215
  168   2HB   LYS  21          2HB       LYS  21   9.972   0.146   4.905
  169   1HG   LYS  21          1HG       LYS  21  11.312   1.540   6.362
  170   2HG   LYS  21          2HG       LYS  21  12.274   0.187   5.751
  171   1HD   LYS  21          1HD       LYS  21  13.340   1.707   4.058
  172   2HD   LYS  21          2HD       LYS  21  12.296   3.030   4.580
  173   1HE   LYS  21          1HE       LYS  21  14.668   3.077   5.428
  174   2HE   LYS  21          2HE       LYS  21  13.437   3.216   6.690
  175   1HZ   LYS  21          3HZ       LYS  21  14.673   0.589   6.069
  176   2HZ   LYS  21          1HZ       LYS  21  15.360   1.643   7.087
  177   3HZ   LYS  21          2HZ       LYS  21  13.875   1.067   7.420
  178    QB   LYS  21           QB       LYS  21  10.069   0.941   4.560
  179    QG   LYS  21           QG       LYS  21  11.793   0.863   6.057
  180    QD   LYS  21           QD       LYS  21  12.818   2.368   4.319
  181    QE   LYS  21           QE       LYS  21  14.052   3.146   6.059
  182    QZ   LYS  21           QZ       LYS  21  14.636   1.100   6.859
  183    H    GLN  22           H        GLN  22  11.167  -1.968   4.505
  184    HA   GLN  22           HA       GLN  22  10.126  -3.685   2.346
  185   1HB   GLN  22          1HB       GLN  22  11.937  -4.348   3.979
  186   2HB   GLN  22          2HB       GLN  22  10.677  -4.278   5.231
  187   1HG   GLN  22          1HG       GLN  22   9.749  -5.957   3.048
  188   2HG   GLN  22          2HG       GLN  22  11.363  -6.465   3.537
  189   1HE2  GLN  22          2HE2      GLN  22  10.415  -7.199   6.992
  190   2HE2  GLN  22          1HE2      GLN  22  11.681  -6.435   6.063
  191    QB   GLN  22           QB       GLN  22  11.307  -4.313   4.605
  192    QG   GLN  22           QG       GLN  22  10.556  -6.211   3.293
  193    QE2  GLN  22           QE2      GLN  22  11.048  -6.817   6.528
  194    H    ASN  23           H        ASN  23   8.063  -4.572   2.513
  195    HA   ASN  23           HA       ASN  23   6.211  -3.744   4.643
  196   1HB   ASN  23          1HB       ASN  23   4.638  -2.636   3.227
  197   2HB   ASN  23          2HB       ASN  23   6.171  -1.795   3.221
  198   1HD2  ASN  23          2HD2      ASN  23   6.249  -1.683  -0.311
  199   2HD2  ASN  23          1HD2      ASN  23   6.594  -0.932   1.237
  200    QB   ASN  23           QB       ASN  23   5.405  -2.215   3.224
  201    QD2  ASN  23           QD2      ASN  23   6.421  -1.307   0.463
  202    H    TRP  24           H        TRP  24   7.294  -6.319   3.712
  203    HA   TRP  24           HA       TRP  24   4.959  -7.630   2.439
  204   1HB   TRP  24          1HB       TRP  24   7.947  -8.080   2.657
  205   2HB   TRP  24          2HB       TRP  24   6.890  -9.468   2.569
  206    HD1  TRP  24           HD       TRP  24   8.777  -7.470   0.328
  207    HE1  TRP  24          1HE       TRP  24   7.988  -7.825  -2.108
  208    HE3  TRP  24          3HE       TRP  24   4.219  -9.587   1.252
  209    HZ2  TRP  24          2HZ       TRP  24   5.624  -8.791  -3.457
  210    HZ3  TRP  24          3HZ       TRP  24   2.718 -10.174  -0.577
  211    HH2  TRP  24           HH       TRP  24   3.453  -9.887  -2.965
  212    QB   TRP  24           QB       TRP  24   7.418  -8.774   2.613
  213    H    ASN  25           H        ASN  25   3.533  -8.475   3.915
  214    HA   ASN  25           HA       ASN  25   2.778  -9.486   5.866
  215   1HB   ASN  25          1HB       ASN  25   5.181 -11.120   4.988
  216   2HB   ASN  25          2HB       ASN  25   4.336 -11.532   6.472
  217   1HD2  ASN  25          2HD2      ASN  25   2.509 -12.433   2.982
  218   2HD2  ASN  25          1HD2      ASN  25   4.120 -11.717   3.000
  219    QB   ASN  25           QB       ASN  25   4.759 -11.326   5.730
  220    QD2  ASN  25           QD2      ASN  25   3.314 -12.075   2.991
  221    H    THR  26           H        THR  26   3.717  -7.134   6.651
  222    HA   THR  26           HA       THR  26   4.712  -7.771   9.314
  223    HB   THR  26           HB       THR  26   6.809  -7.351   8.386
  224    HG1  THR  26          1HG       THR  26   7.283  -5.237   9.322
  225   1HG2  THR  26          3HG2      THR  26   5.679  -4.911   6.950
  226   2HG2  THR  26          1HG2      THR  26   7.399  -5.318   7.062
  227   3HG2  THR  26          2HG2      THR  26   6.291  -6.391   6.207
  228    QG2  THR  26           QG2      THR  26   6.456  -5.540   6.740
  229    H    CYS  27           H        CYS  27   3.882  -6.471  10.768
  230    HA   CYS  27           HA       CYS  27   1.600  -4.827  10.178
  231   1HB   CYS  27          1HB       CYS  27   2.058  -6.242  12.256
  232   2HB   CYS  27          2HB       CYS  27   3.213  -5.012  12.758
  233    QB   CYS  27           QB       CYS  27   2.635  -5.627  12.507
  234    H    VAL  28           H        VAL  28   2.171  -2.936   8.962
  235    HA   VAL  28           HA       VAL  28   4.247  -1.138  10.145
  236    HB   VAL  28           HB       VAL  28   3.856  -1.873   7.236
  237   1HG1  VAL  28          2HG1      VAL  28   5.556   0.342   8.454
  238   2HG1  VAL  28          3HG1      VAL  28   5.699  -0.251   6.786
  239   3HG1  VAL  28          1HG1      VAL  28   4.211   0.539   7.305
  240   1HG2  VAL  28          2HG2      VAL  28   5.290  -3.407   8.608
  241   2HG2  VAL  28          3HG2      VAL  28   6.237  -2.529   7.394
  242   3HG2  VAL  28          1HG2      VAL  28   6.281  -2.026   9.097
  243    QG1  VAL  28           QG1      VAL  28   5.155   0.210   7.515
  244    QG2  VAL  28           QG2      VAL  28   5.936  -2.654   8.366
  245    QQG  VAL  28           QQG      VAL  28   5.546  -1.222   7.941
  246    H    GLY  29           H        GLY  29   3.274   0.547  10.872
  247   1HA   GLY  29          1HA       GLY  29   0.806   1.663  10.042
  248   2HA   GLY  29          2HA       GLY  29   2.055   2.423  11.031
  249    QA   GLY  29           QA       GLY  29   1.430   2.043  10.536
  250    H    ILE  30           H        ILE  30   0.373   3.166   8.582
  251    HA   ILE  30           HA       ILE  30   2.339   4.381   6.737
  252    HB   ILE  30           HB       ILE  30  -0.702   4.626   6.960
  253   1HG1  ILE  30          1HG1      ILE  30   0.711   2.929   4.872
  254   2HG1  ILE  30          2HG1      ILE  30   0.175   2.231   6.393
  255   1HG2  ILE  30          1HG2      ILE  30   1.258   5.350   4.772
  256   2HG2  ILE  30          2HG2      ILE  30  -0.499   5.357   4.529
  257   3HG2  ILE  30          3HG2      ILE  30   0.216   6.470   5.679
  258   1HD1  ILE  30          2HD1      ILE  30  -2.157   3.162   5.929
  259   2HD1  ILE  30          3HD1      ILE  30  -1.600   3.467   4.270
  260   3HD1  ILE  30          1HD1      ILE  30  -1.609   1.827   4.920
  261    QG1  ILE  30           QG1      ILE  30   0.443   2.580   5.632
  262    QG2  ILE  30           QG2      ILE  30   0.325   5.725   4.994
  263    QD1  ILE  30           QD1      ILE  30  -1.789   2.819   5.039
  264    H    GLY  31           H        GLY  31   2.356   6.833   6.640
  265   1HA   GLY  31          1HA       GLY  31   0.514   8.323   8.075
  266   2HA   GLY  31          2HA       GLY  31   1.975   8.238   9.096
  267    QA   GLY  31           QA       GLY  31   1.245   8.280   8.586
  268    H    ALA  32           H        ALA  32   1.012  10.543   8.249
  269    HA   ALA  32           HA       ALA  32   1.688  12.544   7.644
  270   1HB   ALA  32          3HB       ALA  32   3.687  11.768   8.891
  271   2HB   ALA  32          1HB       ALA  32   4.449  11.275   7.361
  272   3HB   ALA  32          2HB       ALA  32   4.098  12.984   7.681
  273    QB   ALA  32           QB       ALA  32   4.078  12.009   7.977
  274    H    ASN  33           H        ASN  33   0.311  12.412   5.890
  275    HA   ASN  33           HA       ASN  33  -0.329  13.018   3.845
  276   1HB   ASN  33          1HB       ASN  33   2.610  13.687   3.323
  277   2HB   ASN  33          2HB       ASN  33   1.360  13.794   2.105
  278   1HD2  ASN  33          2HD2      ASN  33   1.424  16.686   4.980
  279   2HD2  ASN  33          1HD2      ASN  33   2.459  15.267   5.178
  280    QB   ASN  33           QB       ASN  33   1.985  13.740   2.714
  281    QD2  ASN  33           QD2      ASN  33   1.941  15.976   5.079
  282    H    VAL  34           H        VAL  34   1.243  10.286   4.639
  283    HA   VAL  34           HA       VAL  34   1.672   9.271   1.929
  284    HB   VAL  34           HB       VAL  34   1.800   7.841   4.567
  285   1HG1  VAL  34          3HG1      VAL  34   1.284   6.259   2.661
  286   2HG1  VAL  34          1HG1      VAL  34   2.643   6.946   1.765
  287   3HG1  VAL  34          2HG1      VAL  34   2.939   6.067   3.272
  288   1HG2  VAL  34          2HG2      VAL  34   3.571   9.602   4.122
  289   2HG2  VAL  34          3HG2      VAL  34   4.218   7.955   4.144
  290   3HG2  VAL  34          1HG2      VAL  34   3.953   8.781   2.600
  291    QG1  VAL  34           QG1      VAL  34   2.289   6.424   2.566
  292    QG2  VAL  34           QG2      VAL  34   3.914   8.779   3.622
  293    QQG  VAL  34           QQG      VAL  34   3.101   7.602   3.094
  294    H    HIS  35           H        HIS  35  -0.108   9.351   0.767
  295    HA   HIS  35           HA       HIS  35  -2.060   7.147   1.134
  296   1HB   HIS  35          1HB       HIS  35  -3.921   8.625   0.488
  297   2HB   HIS  35          2HB       HIS  35  -3.291   9.097   2.073
  298    HD1  HIS  35          1HD       HIS  35  -3.789  10.263  -1.523
  299    HD2  HIS  35          2HD       HIS  35  -2.232  11.595   2.161
  300    HE1  HIS  35          1HE       HIS  35  -3.706  12.814  -1.637
  301    QB   HIS  35           QB       HIS  35  -3.606   8.861   1.280
  302    H    TRP  36           H        TRP  36   0.262   7.234  -0.367
  303    HA   TRP  36           HA       TRP  36  -1.043   6.839  -2.979
  304   1HB   TRP  36          1HB       TRP  36   1.551   8.369  -2.566
  305   2HB   TRP  36          2HB       TRP  36   0.963   7.754  -4.105
  306    HD1  TRP  36           HD       TRP  36  -0.075  10.267  -1.355
  307    HE1  TRP  36          1HE       TRP  36  -1.608  11.998  -2.339
  308    HE3  TRP  36          3HE       TRP  36  -0.648   8.205  -5.983
  309    HZ2  TRP  36          2HZ       TRP  36  -3.047  12.431  -4.842
  310    HZ3  TRP  36          3HZ       TRP  36  -2.358   9.170  -7.560
  311    HH2  TRP  36           HH       TRP  36  -3.424  11.327  -7.066
  312    QB   TRP  36           QB       TRP  36   1.257   8.062  -3.335
  313    H    MET  37           H        MET  37  -0.370   5.031  -3.927
  314    HA   MET  37           HA       MET  37   1.960   3.536  -2.799
  315   1HB   MET  37          1HB       MET  37  -0.288   2.335  -2.753
  316   2HB   MET  37          2HB       MET  37  -0.332   2.478  -4.517
  317   1HG   MET  37          1HG       MET  37   0.782   0.539  -4.598
  318   2HG   MET  37          2HG       MET  37   2.203   1.345  -3.927
  319   1HE   MET  37          1HE       MET  37   1.056   2.139  -0.983
  320   2HE   MET  37          2HE       MET  37   1.528   0.719  -0.052
  321   3HE   MET  37          3HE       MET  37   2.674   1.428  -1.196
  322    QB   MET  37           QB       MET  37  -0.310   2.406  -3.635
  323    QG   MET  37           QG       MET  37   1.493   0.942  -4.263
  324    QE   MET  37           QE       MET  37   1.753   1.429  -0.743
  325    H    VAL  38           H        VAL  38   3.611   3.289  -4.304
  326    HA   VAL  38           HA       VAL  38   2.955   3.846  -7.130
  327    HB   VAL  38           HB       VAL  38   5.549   4.883  -5.973
  328   1HG1  VAL  38          3HG1      VAL  38   3.840   5.519  -8.429
  329   2HG1  VAL  38          1HG1      VAL  38   5.399   6.255  -8.044
  330   3HG1  VAL  38          2HG1      VAL  38   5.310   4.522  -8.446
  331   1HG2  VAL  38          3HG2      VAL  38   2.925   6.422  -6.340
  332   2HG2  VAL  38          1HG2      VAL  38   3.755   6.134  -4.799
  333   3HG2  VAL  38          2HG2      VAL  38   4.506   7.158  -6.030
  334    QG1  VAL  38           QG1      VAL  38   4.850   5.432  -8.306
  335    QG2  VAL  38           QG2      VAL  38   3.729   6.571  -5.723
  336    QQG  VAL  38           QQG      VAL  38   4.289   6.002  -7.015
  337    H    THR  39           H        THR  39   3.386   2.115  -8.241
  338    HA   THR  39           HA       THR  39   4.814  -0.098  -6.888
  339    HB   THR  39           HB       THR  39   3.627  -1.488  -8.530
  340    HG1  THR  39          1HG       THR  39   2.254   0.881  -9.255
  341   1HG2  THR  39          2HG2      THR  39   2.574  -0.759  -6.306
  342   2HG2  THR  39          3HG2      THR  39   1.672   0.456  -7.210
  343   3HG2  THR  39          1HG2      THR  39   1.437  -1.273  -7.548
  344    QG2  THR  39           QG2      THR  39   1.894  -0.525  -7.021
  345    H    GLY  40           H        GLY  40   6.281  -1.396  -8.126
  346   1HA   GLY  40          1HA       GLY  40   7.681  -0.081 -10.467
  347   2HA   GLY  40          2HA       GLY  40   8.333  -0.774  -8.953
  348    QA   GLY  40           QA       GLY  40   8.007  -0.428  -9.710
  349    H    GLY  41           H        GLY  41   5.982  -2.416  -9.859
  350   1HA   GLY  41          1HA       GLY  41   7.334  -4.924  -9.751
  351   2HA   GLY  41          2HA       GLY  41   5.601  -4.717 -10.041
  352    QA   GLY  41           QA       GLY  41   6.468  -4.821  -9.896
  353    H    SER  42           H        SER  42   8.354  -3.584 -11.821
  354    HA   SER  42           HA       SER  42   8.976  -3.566 -13.980
  355   1HB   SER  42          1HB       SER  42   9.752  -5.772 -13.249
  356   2HB   SER  42          2HB       SER  42   8.213  -6.492 -13.724
  357    HG   SER  42           HG       SER  42   9.882  -5.033 -15.516
  358    QB   SER  42           QB       SER  42   8.982  -6.132 -13.487
  359    H    THR  43           H        THR  43   7.799  -5.313 -16.133
  360    HA   THR  43           HA       THR  43   5.096  -4.110 -16.532
  361    HB   THR  43           HB       THR  43   5.499  -5.556 -18.718
  362    HG1  THR  43          1HG       THR  43   7.615  -5.968 -19.127
  363   1HG2  THR  43          1HG2      THR  43   7.141  -3.047 -18.174
  364   2HG2  THR  43          2HG2      THR  43   6.750  -3.721 -19.767
  365   3HG2  THR  43          3HG2      THR  43   5.449  -3.093 -18.737
  366    QG2  THR  43           QG2      THR  43   6.447  -3.287 -18.893
  367    H    ASP  44           H        ASP  44   6.740  -7.227 -16.982
  368    HA   ASP  44           HA       ASP  44   4.381  -8.776 -16.335
  369   1HB   ASP  44          1HB       ASP  44   6.138 -10.658 -16.841
  370   2HB   ASP  44          2HB       ASP  44   5.604  -9.614 -18.148
  371    QB   ASP  44           QB       ASP  44   5.871 -10.136 -17.495
  372    H    GLY  45           H        GLY  45   5.003  -7.347 -14.039
  373   1HA   GLY  45          1HA       GLY  45   5.765  -9.578 -12.235
  374   2HA   GLY  45          2HA       GLY  45   6.364  -7.942 -11.937
  375    QA   GLY  45           QA       GLY  45   6.064  -8.760 -12.086
  376    H    LYS  46           H        LYS  46   3.274  -8.669 -13.317
  377    HA   LYS  46           HA       LYS  46   1.184  -8.224 -12.803
  378   1HB   LYS  46          1HB       LYS  46   2.079  -9.845 -10.391
  379   2HB   LYS  46          2HB       LYS  46   0.399  -9.428 -10.724
  380   1HG   LYS  46          1HG       LYS  46   0.869 -10.326 -13.130
  381   2HG   LYS  46          2HG       LYS  46   2.243 -11.163 -12.391
  382   1HD   LYS  46          1HD       LYS  46   0.816 -12.536 -11.098
  383   2HD   LYS  46          2HD       LYS  46  -0.499 -11.354 -11.111
  384   1HE   LYS  46          1HE       LYS  46  -0.789 -11.740 -13.604
  385   2HE   LYS  46          2HE       LYS  46   0.382 -13.056 -13.453
  386   1HZ   LYS  46          1HZ       LYS  46  -1.210 -14.000 -11.792
  387   2HZ   LYS  46          2HZ       LYS  46  -2.250 -12.777 -12.158
  388   3HZ   LYS  46          3HZ       LYS  46  -1.861 -13.903 -13.309
  389    QB   LYS  46           QB       LYS  46   1.239  -9.637 -10.558
  390    QG   LYS  46           QG       LYS  46   1.556 -10.744 -12.761
  391    QD   LYS  46           QD       LYS  46   0.159 -11.945 -11.104
  392    QE   LYS  46           QE       LYS  46  -0.204 -12.398 -13.529
  393    QZ   LYS  46           QZ       LYS  46  -1.774 -13.560 -12.420
  394    H    GLN  47           H        GLN  47  -0.556  -7.441 -11.589
  395    HA   GLN  47           HA       GLN  47  -0.048  -5.060 -10.015
  396   1HB   GLN  47          1HB       GLN  47  -2.449  -5.095  -9.612
  397   2HB   GLN  47          2HB       GLN  47  -2.171  -5.534 -11.315
  398   1HG   GLN  47          1HG       GLN  47  -2.392  -7.961 -10.627
  399   2HG   GLN  47          2HG       GLN  47  -2.934  -7.379  -9.036
  400   1HE2  GLN  47          2HE2      GLN  47  -5.488  -7.394 -12.193
  401   2HE2  GLN  47          1HE2      GLN  47  -3.855  -8.029 -12.278
  402    QB   GLN  47           QB       GLN  47  -2.310  -5.315 -10.464
  403    QG   GLN  47           QG       GLN  47  -2.663  -7.670  -9.832
  404    QE2  GLN  47           QE2      GLN  47  -4.671  -7.712 -12.236
  405    H    GLY  48           H        GLY  48  -0.152  -4.874  -7.790
  406   1HA   GLY  48          1HA       GLY  48   0.326  -7.422  -6.287
  407   2HA   GLY  48          2HA       GLY  48   1.187  -5.917  -5.953
  408    QA   GLY  48           QA       GLY  48   0.757  -6.670  -6.120
  409    H    CYS  49           H        CYS  49  -0.688  -7.342  -3.834
  410    HA   CYS  49           HA       CYS  49  -2.401  -4.938  -3.594
  411   1HB   CYS  49          1HB       CYS  49  -3.283  -7.816  -3.066
  412   2HB   CYS  49          2HB       CYS  49  -4.246  -6.371  -2.985
  413    QB   CYS  49           QB       CYS  49  -3.765  -7.093  -3.026
  414    H    ALA  50           H        ALA  50  -3.072  -4.502  -1.588
  415    HA   ALA  50           HA       ALA  50  -1.655  -5.896   0.610
  416   1HB   ALA  50          1HB       ALA  50  -1.964  -2.887   0.183
  417   2HB   ALA  50          2HB       ALA  50  -1.380  -3.628   1.687
  418   3HB   ALA  50          3HB       ALA  50  -0.430  -3.788   0.201
  419    QB   ALA  50           QB       ALA  50  -1.258  -3.434   0.690
  420    H    THR  51           H        THR  51  -2.806  -6.123   2.376
  421    HA   THR  51           HA       THR  51  -5.587  -4.982   2.411
  422    HB   THR  51           HB       THR  51  -4.447  -7.143   4.155
  423    HG1  THR  51          1HG       THR  51  -5.182  -7.601   1.992
  424   1HG2  THR  51          3HG2      THR  51  -7.171  -5.749   4.179
  425   2HG2  THR  51          1HG2      THR  51  -6.723  -7.190   5.120
  426   3HG2  THR  51          2HG2      THR  51  -5.943  -5.637   5.463
  427    QG2  THR  51           QG2      THR  51  -6.612  -6.192   4.921
  428    H    ILE  52           H        ILE  52  -5.811  -3.111   3.176
  429    HA   ILE  52           HA       ILE  52  -3.730  -1.832   4.828
  430    HB   ILE  52           HB       ILE  52  -6.080  -0.622   3.316
  431   1HG1  ILE  52          1HG1      ILE  52  -3.193  -1.077   2.455
  432   2HG1  ILE  52          2HG1      ILE  52  -4.668  -1.611   1.641
  433   1HG2  ILE  52          1HG2      ILE  52  -5.111   0.741   5.221
  434   2HG2  ILE  52          2HG2      ILE  52  -3.554   0.705   4.365
  435   3HG2  ILE  52          3HG2      ILE  52  -4.952   1.489   3.631
  436   1HD1  ILE  52          2HD1      ILE  52  -5.229   0.790   1.174
  437   2HD1  ILE  52          3HD1      ILE  52  -3.643   1.247   1.853
  438   3HD1  ILE  52          1HD1      ILE  52  -3.718   0.232   0.423
  439    QG1  ILE  52           QG1      ILE  52  -3.931  -1.344   2.048
  440    QG2  ILE  52           QG2      ILE  52  -4.539   0.978   4.406
  441    QD1  ILE  52           QD1      ILE  52  -4.197   0.756   1.150
  442    H    TRP  53           H        TRP  53  -4.461  -0.821   6.801
  443    HA   TRP  53           HA       TRP  53  -7.032  -1.801   7.926
  444   1HB   TRP  53          1HB       TRP  53  -4.193  -1.977   8.948
  445   2HB   TRP  53          2HB       TRP  53  -5.474  -1.729  10.118
  446    HD1  TRP  53           HD       TRP  53  -7.278  -3.642  10.458
  447    HE1  TRP  53          1HE       TRP  53  -7.196  -6.161  10.124
  448    HE3  TRP  53          3HE       TRP  53  -3.368  -3.860   7.207
  449    HZ2  TRP  53          2HZ       TRP  53  -5.621  -8.054   8.638
  450    HZ3  TRP  53          3HZ       TRP  53  -2.831  -6.016   6.108
  451    HH2  TRP  53           HH       TRP  53  -3.816  -8.133   6.915
  452    QB   TRP  53           QB       TRP  53  -4.833  -1.853   9.533
  453    H    GLU  54           H        GLU  54  -7.870  -0.620   9.640
  454    HA   GLU  54           HA       GLU  54  -7.409   2.255   9.404
  455   1HB   GLU  54          1HB       GLU  54  -9.663   1.043   9.241
  456   2HB   GLU  54          2HB       GLU  54  -9.510   0.736  10.975
  457   1HG   GLU  54          1HG       GLU  54  -9.193   3.250  11.290
  458   2HG   GLU  54          2HG       GLU  54  -9.376   3.418   9.526
  459    QB   GLU  54           QB       GLU  54  -9.586   0.889  10.108
  460    QG   GLU  54           QG       GLU  54  -9.284   3.334  10.408
  461    H    GLY  55           H        GLY  55  -7.018  -0.350  11.850
  462   1HA   GLY  55          1HA       GLY  55  -6.606   1.428  14.086
  463   2HA   GLY  55          2HA       GLY  55  -6.050  -0.231  13.979
  464    QA   GLY  55           QA       GLY  55  -6.328   0.599  14.032
  465    H    SER  56           H        SER  56  -4.728   2.418  14.791
  466    HA   SER  56           HA       SER  56  -2.556   2.901  12.940
  467   1HB   SER  56          1HB       SER  56  -2.765   3.549  15.881
  468   2HB   SER  56          2HB       SER  56  -1.724   4.340  14.693
  469    HG   SER  56           HG       SER  56  -3.757   5.387  15.340
  470    QB   SER  56           QB       SER  56  -2.245   3.944  15.287
  471    H    GLY  57           H        GLY  57  -1.994   0.616  12.629
  472   1HA   GLY  57          1HA       GLY  57   0.415  -0.168  13.711
  473   2HA   GLY  57          2HA       GLY  57  -0.823  -1.030  14.662
  474    QA   GLY  57           QA       GLY  57  -0.204  -0.599  14.187
  475    H    CYS  58           H        CYS  58  -2.664  -1.822  13.221
  476    HA   CYS  58           HA       CYS  58  -2.971  -2.603  10.744
  477   1HB   CYS  58          1HB       CYS  58  -1.962  -4.682  10.273
  478   2HB   CYS  58          2HB       CYS  58  -0.669  -3.540  10.514
  479    QB   CYS  58           QB       CYS  58  -1.315  -4.111  10.394
  480    H    VAL  59           H        VAL  59  -4.561  -2.284  13.038
  481    HA   VAL  59           HA       VAL  59  -5.877  -4.918  13.252
  482    HB   VAL  59           HB       VAL  59  -6.439  -4.257  15.524
  483   1HG1  VAL  59          1HG1      VAL  59  -4.575  -5.820  15.108
  484   2HG1  VAL  59          2HG1      VAL  59  -3.439  -4.451  15.105
  485   3HG1  VAL  59          3HG1      VAL  59  -4.319  -4.874  16.587
  486   1HG2  VAL  59          2HG2      VAL  59  -4.398  -2.029  15.264
  487   2HG2  VAL  59          3HG2      VAL  59  -6.162  -1.867  15.498
  488   3HG2  VAL  59          1HG2      VAL  59  -5.166  -2.576  16.768
  489    QG1  VAL  59           QG1      VAL  59  -4.111  -5.048  15.600
  490    QG2  VAL  59           QG2      VAL  59  -5.242  -2.157  15.843
  491    QQG  VAL  59           QQG      VAL  59  -4.676  -3.603  15.722
  492    H    GLY  60           H        GLY  60  -8.213  -4.344  14.154
  493   1HA   GLY  60          1HA       GLY  60 -10.143  -3.093  13.933
  494   2HA   GLY  60          2HA       GLY  60  -9.205  -1.760  13.265
  495    QA   GLY  60           QA       GLY  60  -9.674  -2.427  13.599
  496    H    ARG  61           H        ARG  61 -10.544  -1.346  11.578
  497    HA   ARG  61           HA       ARG  61 -11.688  -3.457   9.831
  498   1HB   ARG  61          1HB       ARG  61 -12.921  -1.370  10.728
  499   2HB   ARG  61          2HB       ARG  61 -11.834  -0.413   9.697
  500   1HG   ARG  61          1HG       ARG  61 -12.813  -1.636   7.719
  501   2HG   ARG  61          2HG       ARG  61 -13.943  -2.442   8.829
  502   1HD   ARG  61          1HD       ARG  61 -14.839  -0.291   9.573
  503   2HD   ARG  61          2HD       ARG  61 -13.601   0.575   8.640
  504    HE   ARG  61           HE       ARG  61 -15.210  -1.070   6.889
  505   1HH1  ARG  61          2HH2      ARG  61 -15.227   2.008   8.713
  506   2HH1  ARG  61          1HH2      ARG  61 -16.456   2.714   7.717
  507   1HH2  ARG  61          2HH1      ARG  61 -16.544  -0.024   5.450
  508   2HH2  ARG  61          1HH1      ARG  61 -16.911   1.703   5.653
  509    QB   ARG  61           QB       ARG  61 -12.377  -0.891  10.213
  510    QG   ARG  61           QG       ARG  61 -13.378  -2.039   8.274
  511    QD   ARG  61           QD       ARG  61 -14.220   0.142   9.107
  512    QH1  ARG  61           QH2      ARG  61 -15.841   2.361   8.215
  513    QH2  ARG  61           QH1      ARG  61 -16.728   0.840   5.551
  514    H    SER  62           H        SER  62 -11.377  -3.560   7.576
  515    HA   SER  62           HA       SER  62  -8.874  -2.420   6.759
  516   1HB   SER  62          1HB       SER  62  -8.156  -5.004   6.295
  517   2HB   SER  62          2HB       SER  62  -7.781  -4.113   7.747
  518    HG   SER  62           HG       SER  62  -8.725  -5.967   8.469
  519    QB   SER  62           QB       SER  62  -7.968  -4.559   7.021
  520    H    THR  63           H        THR  63  -8.289  -2.805   4.505
  521    HA   THR  63           HA       THR  63 -10.389  -4.075   2.862
  522    HB   THR  63           HB       THR  63 -11.055  -1.674   3.280
  523    HG1  THR  63          1HG       THR  63 -11.902  -1.557   1.337
  524   1HG2  THR  63          2HG2      THR  63  -8.806  -0.627   3.100
  525   2HG2  THR  63          3HG2      THR  63  -8.787  -1.013   1.362
  526   3HG2  THR  63          1HG2      THR  63 -10.006   0.090   2.008
  527    QG2  THR  63           QG2      THR  63  -9.200  -0.517   2.156
  528    H    THR  64           H        THR  64  -9.609  -4.958   0.996
  529    HA   THR  64           HA       THR  64  -6.710  -4.963   0.699
  530    HB   THR  64           HB       THR  64  -8.685  -6.531  -0.919
  531    HG1  THR  64          1HG       THR  64  -7.520  -7.116   1.615
  532   1HG2  THR  64          2HG2      THR  64  -5.739  -6.882  -0.145
  533   2HG2  THR  64          3HG2      THR  64  -6.687  -8.089  -1.015
  534   3HG2  THR  64          1HG2      THR  64  -6.377  -6.518  -1.758
  535    QG2  THR  64           QG2      THR  64  -6.268  -7.163  -0.973
  536    H    MET  65           H        MET  65  -5.899  -3.200  -0.244
  537    HA   MET  65           HA       MET  65  -7.206  -1.992  -2.627
  538   1HB   MET  65          1HB       MET  65  -6.427  -0.573  -0.741
  539   2HB   MET  65          2HB       MET  65  -4.778  -1.135  -1.015
  540   1HG   MET  65          1HG       MET  65  -6.513   0.329  -3.054
  541   2HG   MET  65          2HG       MET  65  -5.368   1.122  -1.984
  542   1HE   MET  65          3HE       MET  65  -2.715   0.678  -2.068
  543   2HE   MET  65          1HE       MET  65  -2.850  -1.094  -2.213
  544   3HE   MET  65          2HE       MET  65  -1.920  -0.175  -3.410
  545    QB   MET  65           QB       MET  65  -5.602  -0.854  -0.878
  546    QG   MET  65           QG       MET  65  -5.941   0.725  -2.519
  547    QE   MET  65           QE       MET  65  -2.495  -0.197  -2.564
  548    H    CYS  66           H        CYS  66  -6.508  -2.683  -4.594
  549    HA   CYS  66           HA       CYS  66  -3.877  -4.109  -4.836
  550   1HB   CYS  66          1HB       CYS  66  -6.376  -4.216  -6.508
  551   2HB   CYS  66          2HB       CYS  66  -4.859  -4.963  -6.981
  552    QB   CYS  66           QB       CYS  66  -5.617  -4.589  -6.745
  553    H    CYS  67           H        CYS  67  -2.418  -3.270  -6.306
  554    HA   CYS  67           HA       CYS  67  -3.274  -0.971  -7.992
  555   1HB   CYS  67          1HB       CYS  67  -2.102  -0.234  -5.917
  556   2HB   CYS  67          2HB       CYS  67  -0.663  -1.069  -6.498
  557    QB   CYS  67           QB       CYS  67  -1.383  -0.651  -6.207
  558    HA   PRO  68           HA       PRO  68  -1.270  -3.592 -11.052
  559   1HB   PRO  68          1HB       PRO  68  -0.791  -1.028 -12.528
  560   2HB   PRO  68          2HB       PRO  68  -1.464  -2.557 -13.144
  561   1HG   PRO  68          1HG       PRO  68  -3.126  -0.483 -12.574
  562   2HG   PRO  68          2HG       PRO  68  -3.562  -2.156 -12.121
  563   1HD   PRO  68          1HD       PRO  68  -2.449   0.015 -10.343
  564   2HD   PRO  68          2HD       PRO  68  -3.752  -1.175 -10.043
  565    QB   PRO  68           QB       PRO  68  -1.127  -1.793 -12.836
  566    QG   PRO  68           QG       PRO  68  -3.344  -1.319 -12.347
  567    QD   PRO  68           QD       PRO  68  -3.100  -0.580 -10.193
  568    H    ALA  69           H        ALA  69   0.698  -3.474 -12.552
  569    HA   ALA  69           HA       ALA  69   3.117  -2.945 -10.944
  570   1HB   ALA  69          1HB       ALA  69   2.968  -4.896 -12.515
  571   2HB   ALA  69          2HB       ALA  69   2.854  -3.745 -13.866
  572   3HB   ALA  69          3HB       ALA  69   4.302  -3.790 -12.845
  573    QB   ALA  69           QB       ALA  69   3.375  -4.144 -13.075
  574    H    ASN  70           H        ASN  70   4.700  -1.433 -11.575
  575    HA   ASN  70           HA       ASN  70   5.252   0.780 -11.864
  576   1HB   ASN  70          1HB       ASN  70   5.221  -0.697 -14.450
  577   2HB   ASN  70          2HB       ASN  70   5.473   1.044 -14.554
  578   1HD2  ASN  70          2HD2      ASN  70   8.467  -1.175 -12.991
  579   2HD2  ASN  70          1HD2      ASN  70   6.918  -1.934 -13.435
  580    QB   ASN  70           QB       ASN  70   5.347   0.173 -14.502
  581    QD2  ASN  70           QD2      ASN  70   7.693  -1.554 -13.213
  582    H    THR  71           H        THR  71   2.957   1.244 -10.945
  583    HA   THR  71           HA       THR  71   2.326   3.704 -12.343
  584    HB   THR  71           HB       THR  71   0.809   1.933 -13.321
  585    HG1  THR  71          1HG       THR  71  -0.982   3.336 -13.151
  586   1HG2  THR  71          2HG2      THR  71   0.384   0.658 -11.204
  587   2HG2  THR  71          3HG2      THR  71  -0.564   2.035 -10.596
  588   3HG2  THR  71          1HG2      THR  71  -1.096   1.168 -12.040
  589    QG2  THR  71           QG2      THR  71  -0.426   1.287 -11.280
  590    H    CYS  72           H        CYS  72   0.787   4.943 -11.129
  591    HA   CYS  72           HA       CYS  72   1.298   4.937  -8.200
  592   1HB   CYS  72          1HB       CYS  72   2.038   6.965  -8.890
  593   2HB   CYS  72          2HB       CYS  72   1.075   6.956 -10.356
  594    QB   CYS  72           QB       CYS  72   1.557   6.960  -9.623
  595    H    CYS  73           H        CYS  73  -0.458   4.856  -6.788
  596    HA   CYS  73           HA       CYS  73  -3.222   4.934  -7.872
  597   1HB   CYS  73          1HB       CYS  73  -1.979   2.930  -5.944
  598   2HB   CYS  73          2HB       CYS  73  -3.693   3.244  -6.096
  599    QB   CYS  73           QB       CYS  73  -2.836   3.087  -6.020
  600    H    ASN  74           H        ASN  74  -4.487   6.318  -6.573
  601    HA   ASN  74           HA       ASN  74  -3.231   7.639  -4.243
  602   1HB   ASN  74          1HB       ASN  74  -4.574   9.009  -5.748
  603   2HB   ASN  74          2HB       ASN  74  -5.972   7.967  -5.510
  604   1HD2  ASN  74          2HD2      ASN  74  -6.929   9.486  -2.455
  605   2HD2  ASN  74          1HD2      ASN  74  -7.319   8.353  -3.730
  606    QB   ASN  74           QB       ASN  74  -5.273   8.488  -5.629
  607    QD2  ASN  74           QD2      ASN  74  -7.124   8.919  -3.092
  608    H    ILE  75           H        ILE  75  -3.325   6.688  -2.265
  609    HA   ILE  75           HA       ILE  75  -5.297   4.581  -1.686
  610    HB   ILE  75           HB       ILE  75  -2.636   5.461  -0.593
  611   1HG1  ILE  75          1HG1      ILE  75  -2.109   3.121  -0.886
  612   2HG1  ILE  75          2HG1      ILE  75  -3.806   2.745  -1.286
  613   1HG2  ILE  75          1HG2      ILE  75  -4.634   3.873   1.004
  614   2HG2  ILE  75          2HG2      ILE  75  -2.884   3.605   1.149
  615   3HG2  ILE  75          3HG2      ILE  75  -3.519   5.194   1.505
  616   1HD1  ILE  75          2HD1      ILE  75  -2.079   4.699  -2.781
  617   2HD1  ILE  75          3HD1      ILE  75  -2.215   2.983  -3.247
  618   3HD1  ILE  75          1HD1      ILE  75  -3.626   4.008  -3.343
  619    QG1  ILE  75           QG1      ILE  75  -2.957   2.933  -1.086
  620    QG2  ILE  75           QG2      ILE  75  -3.679   4.224   1.219
  621    QD1  ILE  75           QD1      ILE  75  -2.640   3.896  -3.124
  622    H    ASN  76           H        ASN  76  -7.052   6.143  -1.858
  623    HA   ASN  76           HA       ASN  76  -7.652   6.980   0.932
  624   1HB   ASN  76          1HB       ASN  76  -7.836   8.902  -0.730
  625   2HB   ASN  76          2HB       ASN  76  -9.229   8.036  -1.427
  626   1HD2  ASN  76          2HD2      ASN  76 -10.367  10.473   1.248
  627   2HD2  ASN  76          1HD2      ASN  76  -9.685  10.548  -0.369
  628    QB   ASN  76           QB       ASN  76  -8.533   8.469  -1.078
  629    QD2  ASN  76           QD2      ASN  76 -10.026  10.511   0.440
  630    H    THR  77           H        THR  77  -9.874   6.187   1.563
  631    HA   THR  77           HA       THR  77 -10.993   4.077  -0.115
  632    HB   THR  77           HB       THR  77 -10.702   2.267   1.322
  633    HG1  THR  77          1HG       THR  77  -9.544   4.128   3.143
  634   1HG2  THR  77          3HG2      THR  77  -8.793   2.522  -0.129
  635   2HG2  THR  77          1HG2      THR  77  -7.939   3.487   1.096
  636   3HG2  THR  77          2HG2      THR  77  -8.337   1.797   1.416
  637    QG2  THR  77           QG2      THR  77  -8.356   2.602   0.794
  638    H    GLY  78           H        GLY  78 -12.515   2.889   2.072
  639   1HA   GLY  78          1HA       GLY  78 -14.587   4.903   2.340
  640   2HA   GLY  78          2HA       GLY  78 -14.581   3.246   2.959
  641    QA   GLY  78           QA       GLY  78 -14.584   4.074   2.650
  642    H    PHE  79           H        PHE  79 -11.744   4.049   4.273
  643    HA   PHE  79           HA       PHE  79 -12.619   5.907   6.360
  644   1HB   PHE  79          1HB       PHE  79 -11.364   4.335   7.927
  645   2HB   PHE  79          2HB       PHE  79 -13.003   3.876   7.547
  646    HD1  PHE  79          1HD       PHE  79  -9.371   3.210   6.869
  647    HD2  PHE  79          2HD       PHE  79 -13.392   1.743   6.412
  648    HE1  PHE  79          1HE       PHE  79  -8.488   1.015   6.178
  649    HE2  PHE  79          2HE       PHE  79 -12.492  -0.502   5.784
  650   1HZ   PHE  79           HZ       PHE  79 -10.042  -0.817   5.582
  651    QB   PHE  79           QB       PHE  79 -12.184   4.105   7.737
  652    QG   PHE  79           QD       PHE  79 -11.381   2.477   6.640
  653    QZ   PHE  79           QE       PHE  79 -10.490   0.256   5.981
  654    QZ   PHE  79           QR       PHE  79 -10.757   0.930   6.165
  655    H    TYR  80           H        TYR  80 -10.833   6.710   7.554
  656    HA   TYR  80           HA       TYR  80  -8.733   7.341   5.755
  657   1HB   TYR  80          1HB       TYR  80  -9.433   8.876   7.555
  658   2HB   TYR  80          2HB       TYR  80  -8.795   7.778   8.769
  659    HD1  TYR  80          2HD       TYR  80  -6.302   7.390   8.884
  660    HD2  TYR  80          1HD       TYR  80  -8.014  10.352   6.279
  661    HE1  TYR  80          2HE       TYR  80  -4.026   8.161   8.272
  662    HE2  TYR  80          1HE       TYR  80  -5.730  11.121   5.664
  663    HH   TYR  80           HH       TYR  80  -2.918   9.230   6.473
  664    QB   TYR  80           QB       TYR  80  -9.114   8.327   8.162
  665    QG   TYR  80           QD       TYR  80  -7.158   8.871   7.581
  666    QZ   TYR  80           QE       TYR  80  -4.878   9.641   6.968
  667    QR   TYR  80           QR       TYR  80  -6.018   9.256   7.275
  668    H    ILE  81           H        ILE  81  -6.659   6.427   5.635
  669    HA   ILE  81           HA       ILE  81  -6.642   3.672   6.600
  670    HB   ILE  81           HB       ILE  81  -4.846   3.551   4.716
  671   1HG1  ILE  81          1HG1      ILE  81  -5.071   6.140   4.400
  672   2HG1  ILE  81          2HG1      ILE  81  -5.017   5.080   3.016
  673   1HG2  ILE  81          2HG2      ILE  81  -7.868   3.654   4.388
  674   2HG2  ILE  81          3HG2      ILE  81  -6.752   2.983   3.172
  675   3HG2  ILE  81          1HG2      ILE  81  -6.887   2.249   4.776
  676   1HD1  ILE  81          2HD1      ILE  81  -7.718   5.938   4.073
  677   2HD1  ILE  81          3HD1      ILE  81  -6.758   6.890   2.951
  678   3HD1  ILE  81          1HD1      ILE  81  -7.281   5.233   2.529
  679    QG1  ILE  81           QG1      ILE  81  -5.044   5.610   3.708
  680    QG2  ILE  81           QG2      ILE  81  -7.169   2.962   4.112
  681    QD1  ILE  81           QD1      ILE  81  -7.252   6.020   3.184
  682    H    ARG  82           H        ARG  82  -5.009   2.862   7.890
  683    HA   ARG  82           HA       ARG  82  -2.970   4.863   8.817
  684   1HB   ARG  82          1HB       ARG  82  -5.078   3.229  10.166
  685   2HB   ARG  82          2HB       ARG  82  -3.550   3.446  11.031
  686   1HG   ARG  82          1HG       ARG  82  -3.642   5.800  10.888
  687   2HG   ARG  82          2HG       ARG  82  -5.025   5.765   9.766
  688   1HD   ARG  82          1HD       ARG  82  -6.550   5.099  11.469
  689   2HD   ARG  82          2HD       ARG  82  -5.240   4.553  12.528
  690    HE   ARG  82           HE       ARG  82  -4.791   6.643  13.272
  691   1HH1  ARG  82          2HH2      ARG  82  -7.650   6.770  11.067
  692   2HH1  ARG  82          1HH2      ARG  82  -7.752   8.499  11.172
  693   1HH2  ARG  82          2HH1      ARG  82  -5.337   8.769  13.762
  694   2HH2  ARG  82          1HH1      ARG  82  -6.588   9.624  12.900
  695    QB   ARG  82           QB       ARG  82  -4.314   3.338  10.598
  696    QG   ARG  82           QG       ARG  82  -4.333   5.783  10.327
  697    QD   ARG  82           QD       ARG  82  -5.895   4.826  11.999
  698    QH1  ARG  82           QH2      ARG  82  -7.701   7.635  11.119
  699    QH2  ARG  82           QH1      ARG  82  -5.962   9.196  13.331
  700    H    SER  83           H        SER  83  -3.475   1.444   8.081
  701    HA   SER  83           HA       SER  83  -0.511   1.160   8.198
  702   1HB   SER  83          1HB       SER  83  -2.094  -0.978   9.516
  703   2HB   SER  83          2HB       SER  83  -0.411  -0.512   9.724
  704    HG   SER  83           HG       SER  83  -2.731   0.514  10.929
  705    QB   SER  83           QB       SER  83  -1.253  -0.745   9.620
  706    H    TYR  84           H        TYR  84   0.177  -1.081   7.195
  707    HA   TYR  84           HA       TYR  84  -1.982  -2.558   5.994
  708   1HB   TYR  84          1HB       TYR  84  -1.526  -2.291   3.710
  709   2HB   TYR  84          2HB       TYR  84  -1.666  -0.661   4.322
  710    HD1  TYR  84          1HD       TYR  84   0.701  -3.279   3.182
  711    HD2  TYR  84          2HD       TYR  84   0.030   0.909   3.752
  712    HE1  TYR  84          1HE       TYR  84   2.793  -2.821   2.023
  713    HE2  TYR  84          2HE       TYR  84   1.989   1.395   2.371
  714    HH   TYR  84           HH       TYR  84   3.731   0.493   1.126
  715    QB   TYR  84           QB       TYR  84  -1.596  -1.476   4.016
  716    QG   TYR  84           QD       TYR  84   0.366  -1.185   3.467
  717    QZ   TYR  84           QE       TYR  84   2.391  -0.713   2.197
  718    QR   TYR  84           QR       TYR  84   1.378  -0.949   2.832
  719    H    ARG  85           H        ARG  85  -1.338  -4.471   4.856
  720    HA   ARG  85           HA       ARG  85   1.519  -5.322   5.046
  721   1HB   ARG  85          1HB       ARG  85  -0.997  -6.678   5.906
  722   2HB   ARG  85          2HB       ARG  85   0.009  -7.650   4.922
  723   1HG   ARG  85          1HG       ARG  85   1.835  -7.390   6.475
  724   2HG   ARG  85          2HG       ARG  85   0.933  -6.171   7.428
  725   1HD   ARG  85          1HD       ARG  85  -0.672  -7.724   8.116
  726   2HD   ARG  85          2HD       ARG  85  -0.244  -8.914   6.892
  727    HE   ARG  85           HE       ARG  85   1.577  -9.686   8.086
  728   1HH1  ARG  85          2HH2      ARG  85  -0.344  -7.547  10.154
  729   2HH1  ARG  85          1HH2      ARG  85   0.678  -7.856  11.525
  730   1HH2  ARG  85          2HH1      ARG  85   2.829 -10.016   9.783
  731   2HH2  ARG  85          1HH1      ARG  85   2.860  -8.918  11.162
  732    QB   ARG  85           QB       ARG  85  -0.494  -7.164   5.414
  733    QG   ARG  85           QG       ARG  85   1.384  -6.781   6.951
  734    QD   ARG  85           QD       ARG  85  -0.458  -8.319   7.504
  735    QH1  ARG  85           QH2      ARG  85   0.167  -7.702  10.840
  736    QH2  ARG  85           QH1      ARG  85   2.844  -9.467  10.472
  737    H    ARG  86           H        ARG  86   2.289  -5.683   2.934
  738    HA   ARG  86           HA       ARG  86   0.464  -5.940   0.697
  739   1HB   ARG  86          1HB       ARG  86   3.394  -6.574   1.154
  740   2HB   ARG  86          2HB       ARG  86   2.582  -7.365  -0.174
  741   1HG   ARG  86          1HG       ARG  86   2.666  -4.369   0.181
  742   2HG   ARG  86          2HG       ARG  86   3.795  -5.299  -0.793
  743   1HD   ARG  86          1HD       ARG  86   0.786  -4.967  -1.238
  744   2HD   ARG  86          2HD       ARG  86   2.031  -4.385  -2.279
  745    HE   ARG  86           HE       ARG  86   0.805  -6.961  -2.302
  746   1HH1  ARG  86          2HH2      ARG  86   3.977  -5.498  -2.720
  747   2HH1  ARG  86          1HH2      ARG  86   4.291  -6.233  -4.262
  748   1HH2  ARG  86          2HH1      ARG  86   1.342  -8.188  -4.327
  749   2HH2  ARG  86          1HH1      ARG  86   2.943  -8.009  -4.960
  750    QB   ARG  86           QB       ARG  86   2.988  -6.969   0.490
  751    QG   ARG  86           QG       ARG  86   3.230  -4.834  -0.306
  752    QD   ARG  86           QD       ARG  86   1.408  -4.676  -1.758
  753    QH1  ARG  86           QH2      ARG  86   4.134  -5.866  -3.491
  754    QH2  ARG  86           QH1      ARG  86   2.142  -8.098  -4.644
  755    H    VAL  87           H        VAL  87  -0.626  -7.745  -0.053
  756    HA   VAL  87           HA       VAL  87  -0.642  -9.992   1.799
  757    HB   VAL  87           HB       VAL  87  -2.415  -8.155   0.664
  758   1HG1  VAL  87          3HG1      VAL  87  -3.263 -10.841  -0.228
  759   2HG1  VAL  87          1HG1      VAL  87  -4.325  -9.430  -0.010
  760   3HG1  VAL  87          2HG1      VAL  87  -3.019  -9.358  -1.195
  761   1HG2  VAL  87          2HG2      VAL  87  -2.635 -10.228   2.674
  762   2HG2  VAL  87          3HG2      VAL  87  -2.217  -8.499   2.818
  763   3HG2  VAL  87          1HG2      VAL  87  -3.868  -8.970   2.322
  764    QG1  VAL  87           QG1      VAL  87  -3.536  -9.877  -0.477
  765    QG2  VAL  87           QG2      VAL  87  -2.907  -9.233   2.605
  766    QQG  VAL  87           QQG      VAL  87  -3.221  -9.555   1.064
  767    H    GLU  88           H        GLU  88  -0.992  -9.025  -1.562
  768    HA   GLU  88           HA       GLU  88   0.999  -9.312  -2.679
  769   1HB   GLU  88          1HB       GLU  88   1.596 -11.166  -3.779
  770   2HB   GLU  88          2HB       GLU  88   1.706 -11.382  -2.022
  771   1HG   GLU  88          1HG       GLU  88  -0.317 -12.880  -2.132
  772   2HG   GLU  88          2HG       GLU  88  -0.297 -12.714  -3.889
  773    QB   GLU  88           QB       GLU  88   1.651 -11.274  -2.901
  774    QG   GLU  88           QG       GLU  88  -0.307 -12.797  -3.011
   
  No H/Q in entry =         774
  Start of MODEL   14
    1   1HA   GLY   1          1HA       GLY   1  10.279  -9.115  -9.145
    2   2HA   GLY   1          2HA       GLY   1  10.287  -7.777  -7.988
    3    QA   GLY   1           QA       GLY   1  10.283  -8.446  -8.567
    4    H    ASP   2           H        ASP   2  12.866  -6.815  -8.718
    5    HA   ASP   2           HA       ASP   2  13.745  -5.220 -10.055
    6   1HB   ASP   2          1HB       ASP   2  12.649  -6.762 -12.161
    7   2HB   ASP   2          2HB       ASP   2  12.078  -5.128 -12.423
    8    QB   ASP   2           QB       ASP   2  12.364  -5.945 -12.292
    9    H    GLY   3           H        GLY   3  10.192  -5.187 -10.791
   10   1HA   GLY   3          1HA       GLY   3   9.784  -2.610  -9.616
   11   2HA   GLY   3          2HA       GLY   3   8.583  -3.900  -9.762
   12    QA   GLY   3           QA       GLY   3   9.184  -3.255  -9.689
   13    H    TYR   4           H        TYR   4   7.881  -3.089  -7.619
   14    HA   TYR   4           HA       TYR   4   8.933  -4.261  -5.229
   15   1HB   TYR   4          1HB       TYR   4   9.652  -1.945  -4.318
   16   2HB   TYR   4          2HB       TYR   4  10.743  -2.717  -5.423
   17    HD1  TYR   4          2HD       TYR   4   8.043  -0.095  -5.235
   18    HD2  TYR   4          1HD       TYR   4  11.385  -1.654  -7.492
   19    HE1  TYR   4          2HE       TYR   4   7.819   1.730  -6.845
   20    HE2  TYR   4          1HE       TYR   4  11.168   0.206  -9.082
   21    HH   TYR   4           HH       TYR   4   8.646   2.055  -9.516
   22    QB   TYR   4           QB       TYR   4  10.197  -2.331  -4.871
   23    QG   TYR   4           QD       TYR   4   9.714  -0.875  -6.363
   24    QZ   TYR   4           QE       TYR   4   9.494   0.968  -7.963
   25    QR   TYR   4           QR       TYR   4   9.604   0.047  -7.163
   26    H    LEU   5           H        LEU   5   7.903  -2.726  -3.415
   27    HA   LEU   5           HA       LEU   5   5.530  -1.277  -4.375
   28   1HB   LEU   5          1HB       LEU   5   4.899  -3.689  -3.901
   29   2HB   LEU   5          2HB       LEU   5   5.326  -3.419  -2.213
   30    HG   LEU   5           HG       LEU   5   3.370  -1.481  -3.422
   31   1HD1  LEU   5          2HD1      LEU   5   2.613  -3.633  -4.430
   32   2HD1  LEU   5          3HD1      LEU   5   2.599  -4.377  -2.825
   33   3HD1  LEU   5          1HD1      LEU   5   1.478  -3.062  -3.199
   34   1HD2  LEU   5          3HD2      LEU   5   3.431  -3.101  -0.849
   35   2HD2  LEU   5          1HD2      LEU   5   3.978  -1.415  -1.008
   36   3HD2  LEU   5          2HD2      LEU   5   2.266  -1.832  -1.216
   37    QB   LEU   5           QB       LEU   5   5.112  -3.554  -3.057
   38    QD1  LEU   5           QD1      LEU   5   2.230  -3.691  -3.484
   39    QD2  LEU   5           QD2      LEU   5   3.225  -2.116  -1.024
   40    QQD  LEU   5           QQD      LEU   5   2.727  -2.903  -2.254
   41    H    ILE   6           H        ILE   6   5.284   0.610  -3.253
   42    HA   ILE   6           HA       ILE   6   6.592   0.968  -0.665
   43    HB   ILE   6           HB       ILE   6   7.725   3.037  -1.471
   44   1HG1  ILE   6          1HG1      ILE   6   7.026   1.989  -4.246
   45   2HG1  ILE   6          2HG1      ILE   6   6.547   3.533  -3.522
   46   1HG2  ILE   6          2HG2      ILE   6   8.882   0.853  -1.132
   47   2HG2  ILE   6          3HG2      ILE   6   8.845   0.607  -2.895
   48   3HG2  ILE   6          1HG2      ILE   6   9.691   2.008  -2.215
   49   1HD1  ILE   6          3HD1      ILE   6   9.059   4.079  -3.396
   50   2HD1  ILE   6          1HD1      ILE   6   9.290   2.666  -4.438
   51   3HD1  ILE   6          2HD1      ILE   6   8.328   4.037  -5.009
   52    QG1  ILE   6           QG1      ILE   6   6.786   2.761  -3.884
   53    QG2  ILE   6           QG2      ILE   6   9.139   1.156  -2.081
   54    QD1  ILE   6           QD1      ILE   6   8.892   3.594  -4.281
   55    H    MET   7           H        MET   7   5.698   2.649   0.504
   56    HA   MET   7           HA       MET   7   3.386   4.052  -0.723
   57   1HB   MET   7          1HB       MET   7   2.629   4.551   1.455
   58   2HB   MET   7          2HB       MET   7   3.115   2.850   1.448
   59   1HG   MET   7          1HG       MET   7   5.228   3.411   2.542
   60   2HG   MET   7          2HG       MET   7   4.763   5.105   2.664
   61   1HE   MET   7          3HE       MET   7   5.324   2.206   4.705
   62   2HE   MET   7          1HE       MET   7   5.667   3.837   5.323
   63   3HE   MET   7          2HE       MET   7   4.505   2.800   6.162
   64    QB   MET   7           QB       MET   7   2.872   3.700   1.451
   65    QG   MET   7           QG       MET   7   4.996   4.258   2.603
   66    QE   MET   7           QE       MET   7   5.165   2.948   5.397
   67    H    CYS   8           H        CYS   8   3.293   6.287  -0.857
   68    HA   CYS   8           HA       CYS   8   5.820   7.773  -0.434
   69   1HB   CYS   8          1HB       CYS   8   4.038   7.766  -2.889
   70   2HB   CYS   8          2HB       CYS   8   5.459   8.769  -2.689
   71    QB   CYS   8           QB       CYS   8   4.748   8.268  -2.789
   72    H    LYS   9           H        LYS   9   5.515  10.030  -0.184
   73    HA   LYS   9           HA       LYS   9   2.983  10.596   1.089
   74   1HB   LYS   9          1HB       LYS   9   5.149  12.580   0.489
   75   2HB   LYS   9          2HB       LYS   9   3.903  12.566   1.729
   76   1HG   LYS   9          1HG       LYS   9   5.205  10.155   2.285
   77   2HG   LYS   9          2HG       LYS   9   6.503  11.086   1.564
   78   1HD   LYS   9          1HD       LYS   9   5.701  12.927   3.252
   79   2HD   LYS   9          2HD       LYS   9   4.916  11.578   4.084
   80   1HE   LYS   9          1HE       LYS   9   7.102  10.374   4.260
   81   2HE   LYS   9          2HE       LYS   9   7.889  11.663   3.328
   82   1HZ   LYS   9          1HZ       LYS   9   7.258  13.183   5.128
   83   2HZ   LYS   9          2HZ       LYS   9   6.930  11.821   6.078
   84   3HZ   LYS   9          3HZ       LYS   9   8.414  12.094   5.495
   85    QB   LYS   9           QB       LYS   9   4.526  12.573   1.109
   86    QG   LYS   9           QG       LYS   9   5.854  10.620   1.924
   87    QD   LYS   9           QD       LYS   9   5.309  12.252   3.668
   88    QE   LYS   9           QE       LYS   9   7.495  11.018   3.794
   89    QZ   LYS   9           QZ       LYS   9   7.534  12.366   5.567
   90    H    ASN  10           H        ASN  10   4.023  10.943  -2.126
   91    HA   ASN  10           HA       ASN  10   1.439  12.065  -2.829
   92   1HB   ASN  10          1HB       ASN  10   2.037  13.893  -4.094
   93   2HB   ASN  10          2HB       ASN  10   3.009  14.085  -2.660
   94   1HD2  ASN  10          2HD2      ASN  10   5.226  14.741  -5.599
   95   2HD2  ASN  10          1HD2      ASN  10   3.758  15.472  -4.979
   96    QB   ASN  10           QB       ASN  10   2.523  13.989  -3.377
   97    QD2  ASN  10           QD2      ASN  10   4.492  15.107  -5.289
   98    H    CYS  11           H        CYS  11   1.892  12.355  -5.581
   99    HA   CYS  11           HA       CYS  11   1.997   9.478  -6.266
  100   1HB   CYS  11          1HB       CYS  11   0.113  11.009  -6.835
  101   2HB   CYS  11          2HB       CYS  11   1.190  11.907  -7.903
  102    QB   CYS  11           QB       CYS  11   0.652  11.458  -7.369
  103    H    ASP  12           H        ASP  12   4.355  11.717  -6.062
  104    HA   ASP  12           HA       ASP  12   5.644  11.103  -8.682
  105   1HB   ASP  12          1HB       ASP  12   5.346  13.486  -8.147
  106   2HB   ASP  12          2HB       ASP  12   6.355  13.277  -6.701
  107    QB   ASP  12           QB       ASP  12   5.850  13.381  -7.424
  108    HA   PRO  13           HA       PRO  13   7.933   8.454  -5.762
  109   1HB   PRO  13          1HB       PRO  13   9.513   7.092  -7.582
  110   2HB   PRO  13          2HB       PRO  13   7.861   6.617  -7.124
  111   1HG   PRO  13          1HG       PRO  13   8.810   8.192  -9.503
  112   2HG   PRO  13          2HG       PRO  13   7.551   6.917  -9.484
  113   1HD   PRO  13          1HD       PRO  13   6.989   9.607  -9.529
  114   2HD   PRO  13          2HD       PRO  13   5.916   8.468  -8.686
  115    QB   PRO  13           QB       PRO  13   8.687   6.855  -7.353
  116    QG   PRO  13           QG       PRO  13   8.180   7.554  -9.494
  117    QD   PRO  13           QD       PRO  13   6.452   9.037  -9.108
  118    H    ASN  14           H        ASN  14   9.075  10.778  -8.136
  119    HA   ASN  14           HA       ASN  14  11.872  10.506  -7.482
  120   1HB   ASN  14          1HB       ASN  14  10.932  11.324  -9.675
  121   2HB   ASN  14          2HB       ASN  14  10.525  12.839  -8.873
  122   1HD2  ASN  14          2HD2      ASN  14  14.411  11.938  -9.835
  123   2HD2  ASN  14          1HD2      ASN  14  13.231  10.639  -9.719
  124    QB   ASN  14           QB       ASN  14  10.728  12.081  -9.274
  125    QD2  ASN  14           QD2      ASN  14  13.821  11.288  -9.777
  126    H    THR  15           H        THR  15   9.568  13.193  -6.944
  127    HA   THR  15           HA       THR  15  11.266  14.014  -4.610
  128    HB   THR  15           HB       THR  15  10.295  16.273  -5.046
  129    HG1  THR  15          1HG       THR  15   8.368  15.880  -5.929
  130   1HG2  THR  15          3HG2      THR  15  12.369  15.553  -6.324
  131   2HG2  THR  15          1HG2      THR  15  11.297  15.058  -7.654
  132   3HG2  THR  15          2HG2      THR  15  11.361  16.752  -7.186
  133    QG2  THR  15           QG2      THR  15  11.675  15.788  -7.055
  134    H    GLY  16           H        GLY  16   8.664  12.197  -4.863
  135   1HA   GLY  16          1HA       GLY  16   6.796  13.515  -3.142
  136   2HA   GLY  16          2HA       GLY  16   6.882  11.759  -3.472
  137    QA   GLY  16           QA       GLY  16   6.839  12.637  -3.307
  138    H    SER  17           H        SER  17   9.596  11.524  -2.584
  139    HA   SER  17           HA       SER  17  10.626  10.704  -0.772
  140   1HB   SER  17          1HB       SER  17   8.599  11.826   1.156
  141   2HB   SER  17          2HB       SER  17  10.272  11.354   1.437
  142    HG   SER  17           HG       SER  17  10.563  13.158  -0.338
  143    QB   SER  17           QB       SER  17   9.436  11.590   1.297
  144    H    CYS  18           H        CYS  18  10.346   8.557  -0.979
  145    HA   CYS  18           HA       CYS  18   7.767   7.283  -0.290
  146   1HB   CYS  18          1HB       CYS  18   9.926   6.600  -2.295
  147   2HB   CYS  18          2HB       CYS  18   8.580   5.565  -1.869
  148    QB   CYS  18           QB       CYS  18   9.253   6.083  -2.082
  149    H    ASP  19           H        ASP  19   8.041   5.430   1.111
  150    HA   ASP  19           HA       ASP  19  10.839   5.005   2.011
  151   1HB   ASP  19          1HB       ASP  19   9.946   3.814   3.828
  152   2HB   ASP  19          2HB       ASP  19   9.555   5.544   3.768
  153    QB   ASP  19           QB       ASP  19   9.750   4.679   3.798
  154    H    TRP  20           H        TRP  20  11.893   3.713   0.874
  155    HA   TRP  20           HA       TRP  20  10.874   1.357  -0.578
  156   1HB   TRP  20          1HB       TRP  20  13.612   2.609  -0.329
  157   2HB   TRP  20          2HB       TRP  20  13.124   1.314  -1.416
  158    HD1  TRP  20           HD       TRP  20  12.480   5.097  -0.871
  159    HE1  TRP  20          1HE       TRP  20  11.875   6.173  -3.095
  160    HE3  TRP  20          3HE       TRP  20  12.123   0.878  -3.676
  161    HZ2  TRP  20          2HZ       TRP  20  11.249   5.300  -5.803
  162    HZ3  TRP  20          3HZ       TRP  20  11.851   1.050  -6.147
  163    HH2  TRP  20           HH       TRP  20  11.301   3.242  -7.196
  164    QB   TRP  20           QB       TRP  20  13.368   1.962  -0.872
  165    H    LYS  21           H        LYS  21  10.262   1.137   2.031
  166    HA   LYS  21           HA       LYS  21  12.412  -0.462   3.306
  167   1HB   LYS  21          1HB       LYS  21  10.169   1.119   4.385
  168   2HB   LYS  21          2HB       LYS  21  10.328  -0.508   5.063
  169   1HG   LYS  21          1HG       LYS  21  11.689   1.024   6.355
  170   2HG   LYS  21          2HG       LYS  21  12.700  -0.181   5.549
  171   1HD   LYS  21          1HD       LYS  21  13.045   1.633   3.677
  172   2HD   LYS  21          2HD       LYS  21  12.195   2.701   4.748
  173   1HE   LYS  21          1HE       LYS  21  14.458   3.120   5.236
  174   2HE   LYS  21          2HE       LYS  21  14.056   1.969   6.519
  175   1HZ   LYS  21          1HZ       LYS  21  15.232   1.139   3.944
  176   2HZ   LYS  21          2HZ       LYS  21  16.134   1.589   5.231
  177   3HZ   LYS  21          3HZ       LYS  21  15.149   0.255   5.330
  178    QB   LYS  21           QB       LYS  21  10.248   0.306   4.724
  179    QG   LYS  21           QG       LYS  21  12.194   0.421   5.952
  180    QD   LYS  21           QD       LYS  21  12.620   2.167   4.212
  181    QE   LYS  21           QE       LYS  21  14.257   2.544   5.877
  182    QZ   LYS  21           QZ       LYS  21  15.505   0.994   4.835
  183    H    GLN  22           H        GLN  22  11.883  -2.620   4.013
  184    HA   GLN  22           HA       GLN  22  10.296  -4.054   2.054
  185   1HB   GLN  22          1HB       GLN  22  12.365  -4.811   3.342
  186   2HB   GLN  22          2HB       GLN  22  11.306  -5.052   4.736
  187   1HG   GLN  22          1HG       GLN  22  10.541  -6.390   2.147
  188   2HG   GLN  22          2HG       GLN  22  12.008  -6.960   2.945
  189   1HE2  GLN  22          2HE2      GLN  22  10.226  -8.954   5.228
  190   2HE2  GLN  22          1HE2      GLN  22  11.777  -8.509   4.525
  191    QB   GLN  22           QB       GLN  22  11.835  -4.932   4.039
  192    QG   GLN  22           QG       GLN  22  11.274  -6.675   2.546
  193    QE2  GLN  22           QE2      GLN  22  11.001  -8.731   4.876
  194    H    ASN  23           H        ASN  23   8.302  -4.952   2.446
  195    HA   ASN  23           HA       ASN  23   6.652  -4.087   4.735
  196   1HB   ASN  23          1HB       ASN  23   5.012  -2.930   3.252
  197   2HB   ASN  23          2HB       ASN  23   6.561  -2.101   3.356
  198   1HD2  ASN  23          2HD2      ASN  23   7.222  -2.268  -0.085
  199   2HD2  ASN  23          1HD2      ASN  23   7.895  -1.946   1.491
  200    QB   ASN  23           QB       ASN  23   5.787  -2.516   3.304
  201    QD2  ASN  23           QD2      ASN  23   7.558  -2.107   0.703
  202    H    TRP  24           H        TRP  24   7.487  -6.742   3.555
  203    HA   TRP  24           HA       TRP  24   5.134  -7.658   2.068
  204   1HB   TRP  24          1HB       TRP  24   7.136  -7.952   0.885
  205   2HB   TRP  24          2HB       TRP  24   8.064  -8.327   2.341
  206    HD1  TRP  24           HD       TRP  24   8.021 -10.589   3.316
  207    HE1  TRP  24          1HE       TRP  24   7.102 -12.947   2.572
  208    HE3  TRP  24          3HE       TRP  24   5.091  -9.070  -0.505
  209    HZ2  TRP  24          2HZ       TRP  24   5.180 -13.914   0.605
  210    HZ3  TRP  24          3HZ       TRP  24   3.636 -10.628  -1.710
  211    HH2  TRP  24           HH       TRP  24   3.744 -13.063  -1.269
  212    QB   TRP  24           QB       TRP  24   7.600  -8.139   1.613
  213    H    ASN  25           H        ASN  25   3.732  -8.933   3.121
  214    HA   ASN  25           HA       ASN  25   2.793 -10.271   4.734
  215   1HB   ASN  25          1HB       ASN  25   4.525 -11.700   3.576
  216   2HB   ASN  25          2HB       ASN  25   5.586 -11.476   4.964
  217   1HD2  ASN  25          2HD2      ASN  25   3.607 -13.691   7.077
  218   2HD2  ASN  25          1HD2      ASN  25   4.607 -12.250   7.152
  219    QB   ASN  25           QB       ASN  25   5.056 -11.588   4.270
  220    QD2  ASN  25           QD2      ASN  25   4.107 -12.971   7.114
  221    H    THR  26           H        THR  26   3.378  -7.768   5.805
  222    HA   THR  26           HA       THR  26   3.955  -8.373   8.578
  223    HB   THR  26           HB       THR  26   6.223  -8.257   7.336
  224    HG1  THR  26          1HG       THR  26   6.022  -8.101   9.547
  225   1HG2  THR  26          3HG2      THR  26   5.555  -6.213   5.986
  226   2HG2  THR  26          1HG2      THR  26   5.832  -5.263   7.466
  227   3HG2  THR  26          2HG2      THR  26   7.153  -6.195   6.740
  228    QG2  THR  26           QG2      THR  26   6.180  -5.891   6.731
  229    H    CYS  27           H        CYS  27   4.008  -6.391   9.878
  230    HA   CYS  27           HA       CYS  27   1.505  -5.067   9.322
  231   1HB   CYS  27          1HB       CYS  27   1.932  -6.352  11.401
  232   2HB   CYS  27          2HB       CYS  27   3.282  -5.278  11.774
  233    QB   CYS  27           QB       CYS  27   2.607  -5.815  11.588
  234    H    VAL  28           H        VAL  28   1.981  -3.145   7.983
  235    HA   VAL  28           HA       VAL  28   4.204  -1.383   8.938
  236    HB   VAL  28           HB       VAL  28   2.954  -1.622   6.196
  237   1HG1  VAL  28          1HG1      VAL  28   5.342  -0.058   7.250
  238   2HG1  VAL  28          2HG1      VAL  28   4.964  -0.282   5.530
  239   3HG1  VAL  28          3HG1      VAL  28   3.842   0.600   6.570
  240   1HG2  VAL  28          2HG2      VAL  28   5.568  -2.730   7.310
  241   2HG2  VAL  28          3HG2      VAL  28   4.193  -3.664   6.659
  242   3HG2  VAL  28          1HG2      VAL  28   5.147  -2.634   5.589
  243    QG1  VAL  28           QG1      VAL  28   4.716   0.087   6.450
  244    QG2  VAL  28           QG2      VAL  28   4.969  -3.009   6.520
  245    QQG  VAL  28           QQG      VAL  28   4.843  -1.461   6.485
  246    H    GLY  29           H        GLY  29   3.223   0.049  10.330
  247   1HA   GLY  29          1HA       GLY  29   0.808   1.478   9.819
  248   2HA   GLY  29          2HA       GLY  29   2.137   2.037  10.822
  249    QA   GLY  29           QA       GLY  29   1.473   1.757  10.321
  250    H    ILE  30           H        ILE  30   0.430   3.036   8.474
  251    HA   ILE  30           HA       ILE  30   2.398   4.393   6.719
  252    HB   ILE  30           HB       ILE  30  -0.654   4.520   6.861
  253   1HG1  ILE  30          1HG1      ILE  30   0.918   3.097   4.682
  254   2HG1  ILE  30          2HG1      ILE  30   0.289   2.244   6.086
  255   1HG2  ILE  30          3HG2      ILE  30   1.298   5.572   4.819
  256   2HG2  ILE  30          1HG2      ILE  30  -0.469   5.589   4.607
  257   3HG2  ILE  30          2HG2      ILE  30   0.252   6.530   5.893
  258   1HD1  ILE  30          2HD1      ILE  30  -2.019   3.080   5.500
  259   2HD1  ILE  30          3HD1      ILE  30  -1.345   3.696   3.978
  260   3HD1  ILE  30          1HD1      ILE  30  -1.283   1.971   4.327
  261    QG1  ILE  30           QG1      ILE  30   0.603   2.671   5.384
  262    QG2  ILE  30           QG2      ILE  30   0.360   5.897   5.106
  263    QD1  ILE  30           QD1      ILE  30  -1.549   2.916   4.602
  264    H    GLY  31           H        GLY  31   2.365   6.833   6.871
  265   1HA   GLY  31          1HA       GLY  31   0.691   8.092   8.823
  266   2HA   GLY  31          2HA       GLY  31   2.365   7.990   9.405
  267    QA   GLY  31           QA       GLY  31   1.528   8.041   9.114
  268    H    ALA  32           H        ALA  32   2.198  10.349   9.262
  269    HA   ALA  32           HA       ALA  32   1.905  12.296   8.182
  270   1HB   ALA  32          1HB       ALA  32   4.365  11.876   8.753
  271   2HB   ALA  32          2HB       ALA  32   4.587  11.415   7.052
  272   3HB   ALA  32          3HB       ALA  32   4.122  13.070   7.462
  273    QB   ALA  32           QB       ALA  32   4.358  12.121   7.756
  274    H    ASN  33           H        ASN  33   0.153  12.221   7.066
  275    HA   ASN  33           HA       ASN  33  -1.125  12.413   5.222
  276   1HB   ASN  33          1HB       ASN  33  -0.596  14.265   3.808
  277   2HB   ASN  33          2HB       ASN  33  -0.101  14.640   5.455
  278   1HD2  ASN  33          2HD2      ASN  33   2.749  14.306   2.481
  279   2HD2  ASN  33          1HD2      ASN  33   1.204  13.470   2.282
  280    QB   ASN  33           QB       ASN  33  -0.348  14.452   4.632
  281    QD2  ASN  33           QD2      ASN  33   1.977  13.888   2.381
  282    H    VAL  34           H        VAL  34   0.987  10.215   5.131
  283    HA   VAL  34           HA       VAL  34   1.302   9.809   2.241
  284    HB   VAL  34           HB       VAL  34   1.439   7.869   4.530
  285   1HG1  VAL  34          2HG1      VAL  34   1.883   7.320   1.567
  286   2HG1  VAL  34          3HG1      VAL  34   2.441   6.284   2.886
  287   3HG1  VAL  34          1HG1      VAL  34   0.709   6.521   2.621
  288   1HG2  VAL  34          3HG2      VAL  34   3.302   9.616   4.119
  289   2HG2  VAL  34          1HG2      VAL  34   3.810   7.917   4.092
  290   3HG2  VAL  34          2HG2      VAL  34   3.565   8.781   2.573
  291    QG1  VAL  34           QG1      VAL  34   1.678   6.708   2.358
  292    QG2  VAL  34           QG2      VAL  34   3.559   8.771   3.594
  293    QQG  VAL  34           QQG      VAL  34   2.618   7.740   2.976
  294    H    HIS  35           H        HIS  35  -0.280   9.592   0.852
  295    HA   HIS  35           HA       HIS  35  -2.313   7.525   1.300
  296   1HB   HIS  35          1HB       HIS  35  -4.131   8.845   0.648
  297   2HB   HIS  35          2HB       HIS  35  -3.456   9.582   2.106
  298    HD1  HIS  35          1HD       HIS  35  -5.348  10.754  -0.403
  299    HD2  HIS  35          2HD       HIS  35  -1.363  11.620   0.624
  300    HE1  HIS  35          1HE       HIS  35  -4.780  13.015  -1.479
  301    QB   HIS  35           QB       HIS  35  -3.793   9.214   1.377
  302    H    TRP  36           H        TRP  36   0.066   7.542  -0.192
  303    HA   TRP  36           HA       TRP  36  -1.134   6.940  -2.805
  304   1HB   TRP  36          1HB       TRP  36   1.316   8.687  -2.405
  305   2HB   TRP  36          2HB       TRP  36   0.799   7.990  -3.938
  306    HD1  TRP  36           HD       TRP  36  -0.365  10.561  -1.318
  307    HE1  TRP  36          1HE       TRP  36  -2.035  12.157  -2.351
  308    HE3  TRP  36          3HE       TRP  36  -0.998   8.170  -5.741
  309    HZ2  TRP  36          2HZ       TRP  36  -3.605  12.305  -4.815
  310    HZ3  TRP  36          3HZ       TRP  36  -2.590   9.061  -7.458
  311    HH2  TRP  36           HH       TRP  36  -3.915  11.104  -6.979
  312    QB   TRP  36           QB       TRP  36   1.058   8.338  -3.171
  313    H    MET  37           H        MET  37  -0.413   5.037  -3.518
  314    HA   MET  37           HA       MET  37   2.170   3.915  -2.487
  315   1HB   MET  37          1HB       MET  37   0.135   2.580  -1.855
  316   2HB   MET  37          2HB       MET  37  -0.206   2.390  -3.597
  317   1HG   MET  37          1HG       MET  37   2.073   1.338  -3.823
  318   2HG   MET  37          2HG       MET  37   2.153   1.289  -2.057
  319   1HE   MET  37          3HE       MET  37   0.599  -0.199  -0.553
  320   2HE   MET  37          1HE       MET  37  -0.850   0.589  -1.213
  321   3HE   MET  37          2HE       MET  37  -0.741  -1.183  -1.183
  322    QB   MET  37           QB       MET  37  -0.035   2.485  -2.726
  323    QG   MET  37           QG       MET  37   2.113   1.313  -2.940
  324    QE   MET  37           QE       MET  37  -0.331  -0.264  -0.983
  325    H    VAL  38           H        VAL  38   3.683   3.789  -4.076
  326    HA   VAL  38           HA       VAL  38   2.732   4.057  -6.935
  327    HB   VAL  38           HB       VAL  38   5.223   5.405  -5.865
  328   1HG1  VAL  38          3HG1      VAL  38   5.017   4.807  -8.327
  329   2HG1  VAL  38          1HG1      VAL  38   3.563   5.804  -8.392
  330   3HG1  VAL  38          2HG1      VAL  38   5.125   6.545  -8.001
  331   1HG2  VAL  38          1HG2      VAL  38   2.451   6.610  -6.332
  332   2HG2  VAL  38          2HG2      VAL  38   3.290   6.511  -4.774
  333   3HG2  VAL  38          3HG2      VAL  38   3.940   7.536  -6.057
  334    QG1  VAL  38           QG1      VAL  38   4.569   5.719  -8.240
  335    QG2  VAL  38           QG2      VAL  38   3.227   6.886  -5.721
  336    QQG  VAL  38           QQG      VAL  38   3.898   6.302  -6.981
  337    H    THR  39           H        THR  39   2.956   1.953  -7.588
  338    HA   THR  39           HA       THR  39   5.231   0.480  -6.337
  339    HB   THR  39           HB       THR  39   2.925   0.019  -5.531
  340    HG1  THR  39          1HG       THR  39   3.180  -2.301  -5.835
  341   1HG2  THR  39          2HG2      THR  39   1.841   0.156  -7.838
  342   2HG2  THR  39          3HG2      THR  39   2.535  -1.461  -8.121
  343   3HG2  THR  39          1HG2      THR  39   1.379  -1.235  -6.818
  344    QG2  THR  39           QG2      THR  39   1.918  -0.847  -7.593
  345    H    GLY  40           H        GLY  40   6.077  -1.290  -7.446
  346   1HA   GLY  40          1HA       GLY  40   7.485  -1.925  -9.132
  347   2HA   GLY  40          2HA       GLY  40   5.988  -2.089 -10.047
  348    QA   GLY  40           QA       GLY  40   6.736  -2.007  -9.589
  349    H    GLY  41           H        GLY  41   7.064  -1.591 -11.991
  350   1HA   GLY  41          1HA       GLY  41   6.996   0.788 -13.199
  351   2HA   GLY  41          2HA       GLY  41   8.377   1.084 -12.162
  352    QA   GLY  41           QA       GLY  41   7.686   0.936 -12.681
  353    H    SER  42           H        SER  42   8.180  -2.278 -13.131
  354    HA   SER  42           HA       SER  42  10.292  -1.792 -15.206
  355   1HB   SER  42          1HB       SER  42  10.824  -1.917 -12.579
  356   2HB   SER  42          2HB       SER  42  10.559  -3.608 -12.821
  357    HG   SER  42           HG       SER  42  12.755  -3.357 -13.379
  358    QB   SER  42           QB       SER  42  10.692  -2.763 -12.700
  359    H    THR  43           H        THR  43   8.626  -2.697 -16.545
  360    HA   THR  43           HA       THR  43   7.784  -4.265 -17.876
  361    HB   THR  43           HB       THR  43  10.299  -5.374 -16.982
  362    HG1  THR  43          1HG       THR  43   8.756  -6.108 -19.256
  363   1HG2  THR  43          3HG2      THR  43   8.977  -7.264 -15.985
  364   2HG2  THR  43          1HG2      THR  43   8.293  -7.583 -17.599
  365   3HG2  THR  43          2HG2      THR  43  10.026  -7.738 -17.322
  366    QG2  THR  43           QG2      THR  43   9.099  -7.528 -16.969
  367    H    ASP  44           H        ASP  44   7.356  -4.378 -14.515
  368    HA   ASP  44           HA       ASP  44   5.862  -6.820 -14.363
  369   1HB   ASP  44          1HB       ASP  44   5.384  -5.547 -12.011
  370   2HB   ASP  44          2HB       ASP  44   6.620  -6.712 -12.346
  371    QB   ASP  44           QB       ASP  44   6.002  -6.129 -12.179
  372    H    GLY  45           H        GLY  45   4.419  -6.338 -16.045
  373   1HA   GLY  45          1HA       GLY  45   2.133  -4.664 -15.244
  374   2HA   GLY  45          2HA       GLY  45   2.135  -5.891 -16.511
  375    QA   GLY  45           QA       GLY  45   2.134  -5.277 -15.877
  376    H    LYS  46           H        LYS  46   3.538  -7.387 -13.882
  377    HA   LYS  46           HA       LYS  46   1.031  -8.658 -12.975
  378   1HB   LYS  46          1HB       LYS  46   3.892  -9.120 -12.104
  379   2HB   LYS  46          2HB       LYS  46   2.446 -10.063 -11.661
  380   1HG   LYS  46          1HG       LYS  46   2.081 -10.415 -14.172
  381   2HG   LYS  46          2HG       LYS  46   3.714  -9.807 -14.434
  382   1HD   LYS  46          1HD       LYS  46   2.890 -12.250 -12.792
  383   2HD   LYS  46          2HD       LYS  46   3.664 -12.268 -14.386
  384   1HE   LYS  46          1HE       LYS  46   5.649 -11.070 -13.392
  385   2HE   LYS  46          2HE       LYS  46   4.888 -11.182 -11.797
  386   1HZ   LYS  46          2HZ       LYS  46   4.872 -13.626 -12.172
  387   2HZ   LYS  46          3HZ       LYS  46   5.939 -13.440 -13.383
  388   3HZ   LYS  46          1HZ       LYS  46   6.318 -12.909 -11.868
  389    QB   LYS  46           QB       LYS  46   3.169  -9.592 -11.883
  390    QG   LYS  46           QG       LYS  46   2.897 -10.111 -14.303
  391    QD   LYS  46           QD       LYS  46   3.277 -12.259 -13.589
  392    QE   LYS  46           QE       LYS  46   5.268 -11.126 -12.595
  393    QZ   LYS  46           QZ       LYS  46   5.710 -13.325 -12.474
  394    H    GLN  47           H        GLN  47  -0.076  -7.301 -11.774
  395    HA   GLN  47           HA       GLN  47   0.810  -5.213 -10.198
  396   1HB   GLN  47          1HB       GLN  47  -1.469  -5.157  -9.288
  397   2HB   GLN  47          2HB       GLN  47  -1.467  -5.505 -11.028
  398   1HG   GLN  47          1HG       GLN  47  -1.794  -7.936 -10.487
  399   2HG   GLN  47          2HG       GLN  47  -1.956  -7.487  -8.780
  400   1HE2  GLN  47          2HE2      GLN  47  -5.427  -7.687 -10.011
  401   2HE2  GLN  47          1HE2      GLN  47  -4.140  -8.658  -9.331
  402    QB   GLN  47           QB       GLN  47  -1.468  -5.331 -10.158
  403    QG   GLN  47           QG       GLN  47  -1.875  -7.712  -9.633
  404    QE2  GLN  47           QE2      GLN  47  -4.783  -8.172  -9.671
  405    H    GLY  48           H        GLY  48   0.286  -4.928  -7.785
  406   1HA   GLY  48          1HA       GLY  48   0.961  -7.303  -6.148
  407   2HA   GLY  48          2HA       GLY  48   1.856  -5.780  -5.885
  408    QA   GLY  48           QA       GLY  48   1.409  -6.542  -6.016
  409    H    CYS  49           H        CYS  49   0.098  -7.019  -3.913
  410    HA   CYS  49           HA       CYS  49  -2.018  -4.975  -3.754
  411   1HB   CYS  49          1HB       CYS  49  -2.369  -7.984  -3.406
  412   2HB   CYS  49          2HB       CYS  49  -3.614  -6.788  -3.194
  413    QB   CYS  49           QB       CYS  49  -2.991  -7.386  -3.300
  414    H    ALA  50           H        ALA  50  -2.938  -4.784  -1.705
  415    HA   ALA  50           HA       ALA  50  -1.410  -6.012   0.498
  416   1HB   ALA  50          3HB       ALA  50  -1.758  -3.018  -0.003
  417   2HB   ALA  50          1HB       ALA  50  -1.198  -3.711   1.526
  418   3HB   ALA  50          2HB       ALA  50  -0.217  -3.890   0.050
  419    QB   ALA  50           QB       ALA  50  -1.058  -3.540   0.524
  420    H    THR  51           H        THR  51  -2.452  -6.046   2.415
  421    HA   THR  51           HA       THR  51  -5.356  -5.440   2.396
  422    HB   THR  51           HB       THR  51  -3.575  -6.523   4.642
  423    HG1  THR  51          1HG       THR  51  -5.032  -8.059   2.741
  424   1HG2  THR  51          1HG2      THR  51  -5.777  -5.700   5.396
  425   2HG2  THR  51          2HG2      THR  51  -6.581  -6.767   4.224
  426   3HG2  THR  51          3HG2      THR  51  -5.638  -7.449   5.573
  427    QG2  THR  51           QG2      THR  51  -5.999  -6.639   5.064
  428    H    ILE  52           H        ILE  52  -6.074  -3.713   3.830
  429    HA   ILE  52           HA       ILE  52  -3.925  -1.860   4.698
  430    HB   ILE  52           HB       ILE  52  -6.570  -1.018   3.510
  431   1HG1  ILE  52          1HG1      ILE  52  -5.577  -2.390   1.715
  432   2HG1  ILE  52          2HG1      ILE  52  -5.675  -0.678   1.329
  433   1HG2  ILE  52          2HG2      ILE  52  -5.228   0.621   4.729
  434   2HG2  ILE  52          3HG2      ILE  52  -3.836   0.343   3.684
  435   3HG2  ILE  52          1HG2      ILE  52  -5.315   1.046   3.002
  436   1HD1  ILE  52          2HD1      ILE  52  -3.130  -2.026   2.251
  437   2HD1  ILE  52          3HD1      ILE  52  -3.572  -1.748   0.571
  438   3HD1  ILE  52          1HD1      ILE  52  -3.291  -0.368   1.634
  439    QG1  ILE  52           QG1      ILE  52  -5.626  -1.534   1.522
  440    QG2  ILE  52           QG2      ILE  52  -4.793   0.670   3.805
  441    QD1  ILE  52           QD1      ILE  52  -3.331  -1.381   1.485
  442    H    TRP  53           H        TRP  53  -4.657  -0.471   6.583
  443    HA   TRP  53           HA       TRP  53  -7.125  -1.407   7.992
  444   1HB   TRP  53          1HB       TRP  53  -4.354  -1.171   9.137
  445   2HB   TRP  53          2HB       TRP  53  -5.795  -1.178  10.115
  446    HD1  TRP  53           HD       TRP  53  -6.893  -3.438  10.713
  447    HE1  TRP  53          1HE       TRP  53  -6.230  -5.891  10.421
  448    HE3  TRP  53          3HE       TRP  53  -3.255  -2.822   7.179
  449    HZ2  TRP  53          2HZ       TRP  53  -4.423  -7.403   8.755
  450    HZ3  TRP  53          3HZ       TRP  53  -2.169  -4.771   6.207
  451    HH2  TRP  53           HH       TRP  53  -2.691  -7.083   6.998
  452    QB   TRP  53           QB       TRP  53  -5.074  -1.175   9.626
  453    H    GLU  54           H        GLU  54  -8.135   0.012   9.325
  454    HA   GLU  54           HA       GLU  54  -7.644   2.863   9.149
  455   1HB   GLU  54          1HB       GLU  54  -9.871   2.168   9.485
  456   2HB   GLU  54          2HB       GLU  54  -9.455   1.010  10.736
  457   1HG   GLU  54          1HG       GLU  54  -9.064   3.990  11.195
  458   2HG   GLU  54          2HG       GLU  54 -10.628   3.201  11.424
  459    QB   GLU  54           QB       GLU  54  -9.663   1.589  10.110
  460    QG   GLU  54           QG       GLU  54  -9.846   3.596  11.310
  461    H    GLY  55           H        GLY  55  -7.189   0.327  11.721
  462   1HA   GLY  55          1HA       GLY  55  -6.221   2.231  13.574
  463   2HA   GLY  55          2HA       GLY  55  -6.134   0.518  13.763
  464    QA   GLY  55           QA       GLY  55  -6.177   1.375  13.669
  465    H    SER  56           H        SER  56  -4.386   3.045  13.908
  466    HA   SER  56           HA       SER  56  -2.478   3.196  11.891
  467   1HB   SER  56          1HB       SER  56  -1.468   4.704  13.915
  468   2HB   SER  56          2HB       SER  56  -2.818   5.152  12.890
  469    HG   SER  56           HG       SER  56  -3.335   5.382  15.122
  470    QB   SER  56           QB       SER  56  -2.143   4.928  13.402
  471    H    GLY  57           H        GLY  57  -1.886   0.782  12.085
  472   1HA   GLY  57          1HA       GLY  57   0.813   0.498  12.667
  473   2HA   GLY  57          2HA       GLY  57  -0.060  -0.305  13.996
  474    QA   GLY  57           QA       GLY  57   0.377   0.096  13.332
  475    H    CYS  58           H        CYS  58  -2.148  -1.350  12.969
  476    HA   CYS  58           HA       CYS  58  -2.826  -2.153  10.623
  477   1HB   CYS  58          1HB       CYS  58  -2.104  -4.315  10.044
  478   2HB   CYS  58          2HB       CYS  58  -0.688  -3.291  10.077
  479    QB   CYS  58           QB       CYS  58  -1.396  -3.803  10.061
  480    H    VAL  59           H        VAL  59  -4.162  -1.538  12.760
  481    HA   VAL  59           HA       VAL  59  -5.496  -3.995  13.708
  482    HB   VAL  59           HB       VAL  59  -5.777  -2.691  15.862
  483   1HG1  VAL  59          1HG1      VAL  59  -3.026  -3.737  15.104
  484   2HG1  VAL  59          2HG1      VAL  59  -3.602  -3.520  16.768
  485   3HG1  VAL  59          3HG1      VAL  59  -4.390  -4.699  15.712
  486   1HG2  VAL  59          2HG2      VAL  59  -3.338  -1.154  14.889
  487   2HG2  VAL  59          3HG2      VAL  59  -4.962  -0.513  15.200
  488   3HG2  VAL  59          1HG2      VAL  59  -3.997  -1.159  16.531
  489    QG1  VAL  59           QG1      VAL  59  -3.672  -3.985  15.861
  490    QG2  VAL  59           QG2      VAL  59  -4.099  -0.942  15.540
  491    QQG  VAL  59           QQG      VAL  59  -3.886  -2.464  15.701
  492    H    GLY  60           H        GLY  60  -7.700  -3.182  14.722
  493   1HA   GLY  60          1HA       GLY  60  -9.683  -1.975  14.376
  494   2HA   GLY  60          2HA       GLY  60  -8.731  -0.759  13.517
  495    QA   GLY  60           QA       GLY  60  -9.207  -1.367  13.947
  496    H    ARG  61           H        ARG  61 -10.322  -0.624  11.820
  497    HA   ARG  61           HA       ARG  61 -11.326  -3.164  10.658
  498   1HB   ARG  61          1HB       ARG  61 -12.774  -1.194  11.332
  499   2HB   ARG  61          2HB       ARG  61 -12.123  -0.307   9.953
  500   1HG   ARG  61          1HG       ARG  61 -13.420  -3.063   9.644
  501   2HG   ARG  61          2HG       ARG  61 -14.390  -1.598   9.812
  502   1HD   ARG  61          1HD       ARG  61 -13.228  -0.586   7.867
  503   2HD   ARG  61          2HD       ARG  61 -12.402  -2.101   7.545
  504    HE   ARG  61           HE       ARG  61 -15.208  -1.410   7.108
  505   1HH1  ARG  61          2HH2      ARG  61 -12.854  -4.134   7.119
  506   2HH1  ARG  61          1HH2      ARG  61 -14.099  -5.278   6.670
  507   1HH2  ARG  61          2HH1      ARG  61 -16.704  -3.036   6.248
  508   2HH2  ARG  61          1HH1      ARG  61 -16.080  -4.671   6.071
  509    QB   ARG  61           QB       ARG  61 -12.448  -0.751  10.643
  510    QG   ARG  61           QG       ARG  61 -13.905  -2.330   9.728
  511    QD   ARG  61           QD       ARG  61 -12.815  -1.343   7.706
  512    QH1  ARG  61           QH2      ARG  61 -13.476  -4.706   6.895
  513    QH2  ARG  61           QH1      ARG  61 -16.392  -3.854   6.159
  514    H    SER  62           H        SER  62 -10.825  -4.041   8.735
  515    HA   SER  62           HA       SER  62  -8.767  -2.504   7.282
  516   1HB   SER  62          1HB       SER  62  -7.884  -4.792   6.563
  517   2HB   SER  62          2HB       SER  62  -7.660  -4.314   8.215
  518    HG   SER  62           HG       SER  62  -9.210  -5.657   8.900
  519    QB   SER  62           QB       SER  62  -7.772  -4.553   7.389
  520    H    THR  63           H        THR  63  -8.489  -2.849   5.083
  521    HA   THR  63           HA       THR  63 -10.767  -3.873   3.492
  522    HB   THR  63           HB       THR  63 -10.001  -1.698   2.017
  523    HG1  THR  63          1HG       THR  63  -9.866   0.038   3.645
  524   1HG2  THR  63          3HG2      THR  63 -12.017  -1.749   4.302
  525   2HG2  THR  63          1HG2      THR  63 -11.975  -0.533   2.998
  526   3HG2  THR  63          2HG2      THR  63 -12.298  -2.234   2.625
  527    QG2  THR  63           QG2      THR  63 -12.096  -1.505   3.308
  528    H    THR  64           H        THR  64  -9.731  -3.655   1.017
  529    HA   THR  64           HA       THR  64  -6.987  -4.748   1.119
  530    HB   THR  64           HB       THR  64  -8.326  -6.712   1.283
  531    HG1  THR  64          1HG       THR  64  -7.716  -7.707  -0.561
  532   1HG2  THR  64          2HG2      THR  64 -10.035  -5.618  -0.996
  533   2HG2  THR  64          3HG2      THR  64 -10.124  -7.269  -0.355
  534   3HG2  THR  64          1HG2      THR  64 -10.549  -5.904   0.677
  535    QG2  THR  64           QG2      THR  64 -10.236  -6.264  -0.225
  536    H    MET  65           H        MET  65  -5.804  -4.085  -0.564
  537    HA   MET  65           HA       MET  65  -7.162  -2.592  -2.770
  538   1HB   MET  65          1HB       MET  65  -6.670  -1.111  -0.799
  539   2HB   MET  65          2HB       MET  65  -4.953  -1.362  -1.108
  540   1HG   MET  65          1HG       MET  65  -6.966  -0.220  -3.094
  541   2HG   MET  65          2HG       MET  65  -5.960   0.751  -2.030
  542   1HE   MET  65          3HE       MET  65  -3.380   0.872  -2.116
  543   2HE   MET  65          1HE       MET  65  -3.065  -0.874  -2.291
  544   3HE   MET  65          2HE       MET  65  -2.387   0.277  -3.460
  545    QB   MET  65           QB       MET  65  -5.811  -1.236  -0.953
  546    QG   MET  65           QG       MET  65  -6.463   0.265  -2.562
  547    QE   MET  65           QE       MET  65  -2.944   0.091  -2.622
  548    H    CYS  66           H        CYS  66  -6.464  -3.487  -4.563
  549    HA   CYS  66           HA       CYS  66  -3.676  -4.471  -4.876
  550   1HB   CYS  66          1HB       CYS  66  -6.164  -4.737  -6.533
  551   2HB   CYS  66          2HB       CYS  66  -4.569  -5.175  -7.132
  552    QB   CYS  66           QB       CYS  66  -5.367  -4.956  -6.832
  553    H    CYS  67           H        CYS  67  -2.274  -3.544  -6.287
  554    HA   CYS  67           HA       CYS  67  -3.083  -1.128  -7.814
  555   1HB   CYS  67          1HB       CYS  67  -2.193  -0.540  -5.607
  556   2HB   CYS  67          2HB       CYS  67  -0.704  -1.403  -5.971
  557    QB   CYS  67           QB       CYS  67  -1.448  -0.971  -5.789
  558    HA   PRO  68           HA       PRO  68  -0.600  -3.493 -10.818
  559   1HB   PRO  68          1HB       PRO  68  -0.536  -0.862 -12.234
  560   2HB   PRO  68          2HB       PRO  68  -0.913  -2.464 -12.882
  561   1HG   PRO  68          1HG       PRO  68  -2.890  -0.691 -12.387
  562   2HG   PRO  68          2HG       PRO  68  -3.085  -2.437 -12.014
  563   1HD   PRO  68          1HD       PRO  68  -2.483  -0.188 -10.091
  564   2HD   PRO  68          2HD       PRO  68  -3.574  -1.601  -9.917
  565    QB   PRO  68           QB       PRO  68  -0.724  -1.663 -12.558
  566    QG   PRO  68           QG       PRO  68  -2.987  -1.564 -12.200
  567    QD   PRO  68           QD       PRO  68  -3.028  -0.895 -10.004
  568    H    ALA  69           H        ALA  69   1.575  -3.572 -11.318
  569    HA   ALA  69           HA       ALA  69   3.496  -1.685 -10.057
  570   1HB   ALA  69          1HB       ALA  69   3.614  -4.327 -11.479
  571   2HB   ALA  69          2HB       ALA  69   4.940  -3.190 -11.765
  572   3HB   ALA  69          3HB       ALA  69   4.598  -3.763 -10.132
  573    QB   ALA  69           QB       ALA  69   4.384  -3.760 -11.126
  574    H    ASN  70           H        ASN  70   4.352  -0.064 -11.271
  575    HA   ASN  70           HA       ASN  70   4.702   1.393 -13.006
  576   1HB   ASN  70          1HB       ASN  70   3.241  -0.429 -14.979
  577   2HB   ASN  70          2HB       ASN  70   4.194   0.995 -15.301
  578   1HD2  ASN  70          2HD2      ASN  70   6.211  -2.495 -14.311
  579   2HD2  ASN  70          1HD2      ASN  70   4.503  -2.370 -14.026
  580    QB   ASN  70           QB       ASN  70   3.717   0.283 -15.140
  581    QD2  ASN  70           QD2      ASN  70   5.357  -2.432 -14.168
  582    H    THR  71           H        THR  71   2.749   1.588 -11.032
  583    HA   THR  71           HA       THR  71   1.018   3.463 -12.383
  584    HB   THR  71           HB       THR  71  -0.121   1.002 -11.034
  585    HG1  THR  71          1HG       THR  71   0.165   1.480 -13.451
  586   1HG2  THR  71          1HG2      THR  71  -1.627   3.592 -11.506
  587   2HG2  THR  71          2HG2      THR  71  -2.323   2.028 -10.995
  588   3HG2  THR  71          3HG2      THR  71  -1.223   2.862  -9.932
  589    QG2  THR  71           QG2      THR  71  -1.724   2.828 -10.811
  590    H    CYS  72           H        CYS  72   0.428   5.064 -11.062
  591    HA   CYS  72           HA       CYS  72   1.295   5.121  -8.213
  592   1HB   CYS  72          1HB       CYS  72   1.977   7.104  -9.396
  593   2HB   CYS  72          2HB       CYS  72   0.423   7.193 -10.238
  594    QB   CYS  72           QB       CYS  72   1.200   7.148  -9.817
  595    H    CYS  73           H        CYS  73  -0.252   4.710  -6.694
  596    HA   CYS  73           HA       CYS  73  -3.102   4.624  -7.522
  597   1HB   CYS  73          1HB       CYS  73  -1.517   2.833  -5.657
  598   2HB   CYS  73          2HB       CYS  73  -3.276   2.930  -5.641
  599    QB   CYS  73           QB       CYS  73  -2.397   2.882  -5.649
  600    H    ASN  74           H        ASN  74  -4.571   5.596  -6.230
  601    HA   ASN  74           HA       ASN  74  -3.446   7.450  -4.192
  602   1HB   ASN  74          1HB       ASN  74  -4.729   8.461  -6.054
  603   2HB   ASN  74          2HB       ASN  74  -6.115   7.464  -5.647
  604   1HD2  ASN  74          2HD2      ASN  74  -5.266  10.099  -2.596
  605   2HD2  ASN  74          1HD2      ASN  74  -4.000   9.013  -3.080
  606    QB   ASN  74           QB       ASN  74  -5.422   7.963  -5.851
  607    QD2  ASN  74           QD2      ASN  74  -4.633   9.556  -2.838
  608    H    ILE  75           H        ILE  75  -3.608   6.737  -2.146
  609    HA   ILE  75           HA       ILE  75  -5.317   4.448  -1.539
  610    HB   ILE  75           HB       ILE  75  -2.948   5.803  -0.296
  611   1HG1  ILE  75          1HG1      ILE  75  -2.044   3.567  -0.349
  612   2HG1  ILE  75          2HG1      ILE  75  -3.620   2.870  -0.771
  613   1HG2  ILE  75          3HG2      ILE  75  -4.734   3.861   1.130
  614   2HG2  ILE  75          1HG2      ILE  75  -3.060   4.242   1.606
  615   3HG2  ILE  75          2HG2      ILE  75  -4.285   5.509   1.686
  616   1HD1  ILE  75          2HD1      ILE  75  -2.128   4.859  -2.475
  617   2HD1  ILE  75          3HD1      ILE  75  -1.999   3.094  -2.663
  618   3HD1  ILE  75          1HD1      ILE  75  -3.536   3.887  -2.976
  619    QG1  ILE  75           QG1      ILE  75  -2.832   3.219  -0.560
  620    QG2  ILE  75           QG2      ILE  75  -4.027   4.537   1.474
  621    QD1  ILE  75           QD1      ILE  75  -2.554   3.947  -2.705
  622    H    ASN  76           H        ASN  76  -7.376   5.082  -1.523
  623    HA   ASN  76           HA       ASN  76  -8.203   6.168   1.049
  624   1HB   ASN  76          1HB       ASN  76 -10.299   7.106  -0.448
  625   2HB   ASN  76          2HB       ASN  76  -9.037   8.087   0.273
  626   1HD2  ASN  76          2HD2      ASN  76  -7.762   9.246  -2.779
  627   2HD2  ASN  76          1HD2      ASN  76  -7.689   9.285  -1.028
  628    QB   ASN  76           QB       ASN  76  -9.668   7.597  -0.087
  629    QD2  ASN  76           QD2      ASN  76  -7.725   9.266  -1.904
  630    H    THR  77           H        THR  77 -10.362   5.331   1.548
  631    HA   THR  77           HA       THR  77 -11.471   3.348  -0.311
  632    HB   THR  77           HB       THR  77 -11.765   1.668   1.360
  633    HG1  THR  77          1HG       THR  77 -10.540   3.482   3.194
  634   1HG2  THR  77          2HG2      THR  77  -9.511   1.744   0.253
  635   2HG2  THR  77          3HG2      THR  77  -8.866   2.527   1.702
  636   3HG2  THR  77          1HG2      THR  77  -9.543   0.899   1.801
  637    QG2  THR  77           QG2      THR  77  -9.307   1.723   1.252
  638    H    GLY  78           H        GLY  78 -13.479   2.760   1.854
  639   1HA   GLY  78          1HA       GLY  78 -15.203   5.086   1.724
  640   2HA   GLY  78          2HA       GLY  78 -15.366   3.681   2.795
  641    QA   GLY  78           QA       GLY  78 -15.284   4.384   2.260
  642    H    PHE  79           H        PHE  79 -12.497   3.998   3.831
  643    HA   PHE  79           HA       PHE  79 -12.745   6.482   5.433
  644   1HB   PHE  79          1HB       PHE  79 -11.845   5.081   7.288
  645   2HB   PHE  79          2HB       PHE  79 -13.499   4.678   6.870
  646    HD1  PHE  79          1HD       PHE  79 -13.911   2.542   5.478
  647    HD2  PHE  79          2HD       PHE  79 -10.101   3.455   7.293
  648    HE1  PHE  79          1HE       PHE  79 -13.188   0.193   5.172
  649    HE2  PHE  79          2HE       PHE  79  -9.436   1.087   7.077
  650   1HZ   PHE  79           HZ       PHE  79 -10.941  -0.540   6.004
  651    QB   PHE  79           QB       PHE  79 -12.672   4.879   7.079
  652    QG   PHE  79           QD       PHE  79 -12.006   2.999   6.386
  653    QZ   PHE  79           QE       PHE  79 -11.312   0.640   6.124
  654    QZ   PHE  79           QR       PHE  79 -11.515   1.348   6.205
  655    H    TYR  80           H        TYR  80 -10.803   6.975   6.534
  656    HA   TYR  80           HA       TYR  80  -8.685   7.023   4.566
  657   1HB   TYR  80          1HB       TYR  80  -9.231   9.068   5.710
  658   2HB   TYR  80          2HB       TYR  80  -8.941   8.340   7.292
  659    HD1  TYR  80          1HD       TYR  80  -6.603   7.885   8.039
  660    HD2  TYR  80          2HD       TYR  80  -7.436   9.839   4.290
  661    HE1  TYR  80          1HE       TYR  80  -4.254   8.660   7.919
  662    HE2  TYR  80          2HE       TYR  80  -5.081  10.635   4.186
  663    HH   TYR  80           HH       TYR  80  -2.641   9.358   6.263
  664    QB   TYR  80           QB       TYR  80  -9.086   8.704   6.501
  665    QG   TYR  80           QD       TYR  80  -7.019   8.862   6.164
  666    QZ   TYR  80           QE       TYR  80  -4.668   9.648   6.053
  667    QR   TYR  80           QR       TYR  80  -5.843   9.255   6.109
  668    H    ILE  81           H        ILE  81  -6.683   5.863   4.902
  669    HA   ILE  81           HA       ILE  81  -6.849   3.761   6.940
  670    HB   ILE  81           HB       ILE  81  -5.234   2.716   5.206
  671   1HG1  ILE  81          1HG1      ILE  81  -5.273   4.793   3.765
  672   2HG1  ILE  81          2HG1      ILE  81  -5.606   3.257   3.021
  673   1HG2  ILE  81          1HG2      ILE  81  -8.268   2.765   5.242
  674   2HG2  ILE  81          2HG2      ILE  81  -7.374   1.706   4.132
  675   3HG2  ILE  81          3HG2      ILE  81  -7.166   1.553   5.883
  676   1HD1  ILE  81          2HD1      ILE  81  -8.167   3.988   3.491
  677   2HD1  ILE  81          3HD1      ILE  81  -7.410   5.564   3.217
  678   3HD1  ILE  81          1HD1      ILE  81  -7.256   4.283   2.007
  679    QG1  ILE  81           QG1      ILE  81  -5.440   4.025   3.393
  680    QG2  ILE  81           QG2      ILE  81  -7.603   2.008   5.086
  681    QD1  ILE  81           QD1      ILE  81  -7.611   4.612   2.905
  682    H    ARG  82           H        ARG  82  -4.920   3.137   7.979
  683    HA   ARG  82           HA       ARG  82  -2.653   5.107   7.951
  684   1HB   ARG  82          1HB       ARG  82  -3.929   3.861  10.395
  685   2HB   ARG  82          2HB       ARG  82  -2.710   5.151  10.302
  686   1HG   ARG  82          1HG       ARG  82  -4.389   6.461   8.947
  687   2HG   ARG  82          2HG       ARG  82  -5.641   5.252   9.407
  688   1HD   ARG  82          1HD       ARG  82  -3.887   6.595  11.394
  689   2HD   ARG  82          2HD       ARG  82  -5.361   7.401  10.741
  690    HE   ARG  82           HE       ARG  82  -6.203   4.885  11.549
  691   1HH1  ARG  82          2HH2      ARG  82  -4.667   7.610  13.194
  692   2HH1  ARG  82          1HH2      ARG  82  -4.841   6.934  14.778
  693   1HH2  ARG  82          2HH1      ARG  82  -7.134   4.383  13.556
  694   2HH2  ARG  82          1HH1      ARG  82  -6.453   5.007  15.004
  695    QB   ARG  82           QB       ARG  82  -3.320   4.506  10.348
  696    QG   ARG  82           QG       ARG  82  -5.015   5.856   9.177
  697    QD   ARG  82           QD       ARG  82  -4.624   6.998  11.067
  698    QH1  ARG  82           QH2      ARG  82  -4.754   7.272  13.986
  699    QH2  ARG  82           QH1      ARG  82  -6.793   4.695  14.280
  700    H    SER  83           H        SER  83  -3.584   1.903   7.910
  701    HA   SER  83           HA       SER  83  -0.635   1.311   7.856
  702   1HB   SER  83          1HB       SER  83  -2.244  -0.932   8.891
  703   2HB   SER  83          2HB       SER  83  -0.598  -0.444   9.226
  704    HG   SER  83           HG       SER  83  -2.991   0.481  10.405
  705    QB   SER  83           QB       SER  83  -1.421  -0.688   9.059
  706    H    TYR  84           H        TYR  84   0.053  -0.681   6.769
  707    HA   TYR  84           HA       TYR  84  -1.953  -2.119   5.305
  708   1HB   TYR  84          1HB       TYR  84  -1.161  -1.876   3.147
  709   2HB   TYR  84          2HB       TYR  84  -1.175  -0.242   3.753
  710    HD1  TYR  84          2HD       TYR  84   1.202   0.691   4.584
  711    HD2  TYR  84          1HD       TYR  84   0.771  -2.910   2.264
  712    HE1  TYR  84          2HE       TYR  84   3.470   1.014   3.619
  713    HE2  TYR  84          1HE       TYR  84   3.039  -2.607   1.370
  714    HH   TYR  84           HH       TYR  84   5.079   0.262   1.997
  715    QB   TYR  84           QB       TYR  84  -1.168  -1.059   3.450
  716    QG   TYR  84           QD       TYR  84   0.987  -1.110   3.424
  717    QZ   TYR  84           QE       TYR  84   3.255  -0.796   2.495
  718    QR   TYR  84           QR       TYR  84   2.121  -0.953   2.959
  719    H    ARG  85           H        ARG  85  -1.061  -3.946   4.168
  720    HA   ARG  85           HA       ARG  85   1.619  -4.956   4.957
  721   1HB   ARG  85          1HB       ARG  85   0.150  -5.970   6.676
  722   2HB   ARG  85          2HB       ARG  85  -1.032  -6.393   5.424
  723   1HG   ARG  85          1HG       ARG  85   1.520  -7.602   4.815
  724   2HG   ARG  85          2HG       ARG  85   0.958  -8.042   6.439
  725   1HD   ARG  85          1HD       ARG  85  -1.137  -8.836   5.668
  726   2HD   ARG  85          2HD       ARG  85  -0.936  -8.123   4.059
  727    HE   ARG  85           HE       ARG  85   0.953  -9.564   3.667
  728   1HH1  ARG  85          2HH2      ARG  85  -1.948 -10.711   5.381
  729   2HH1  ARG  85          1HH2      ARG  85  -1.381 -12.344   5.537
  730   1HH2  ARG  85          2HH1      ARG  85   1.446 -11.918   3.536
  731   2HH2  ARG  85          1HH1      ARG  85   0.586 -12.986   4.621
  732    QB   ARG  85           QB       ARG  85  -0.441  -6.181   6.050
  733    QG   ARG  85           QG       ARG  85   1.239  -7.822   5.627
  734    QD   ARG  85           QD       ARG  85  -1.036  -8.479   4.864
  735    QH1  ARG  85           QH2      ARG  85  -1.665 -11.527   5.459
  736    QH2  ARG  85           QH1      ARG  85   1.016 -12.452   4.078
  737    H    ARG  86           H        ARG  86   2.511  -5.614   2.958
  738    HA   ARG  86           HA       ARG  86   0.763  -5.941   0.660
  739   1HB   ARG  86          1HB       ARG  86   2.973  -5.066   0.357
  740   2HB   ARG  86          2HB       ARG  86   3.689  -6.497   1.090
  741   1HG   ARG  86          1HG       ARG  86   2.814  -7.898  -0.785
  742   2HG   ARG  86          2HG       ARG  86   2.142  -6.442  -1.540
  743   1HD   ARG  86          1HD       ARG  86   4.362  -5.498  -1.819
  744   2HD   ARG  86          2HD       ARG  86   5.071  -6.755  -0.791
  745    HE   ARG  86           HE       ARG  86   3.681  -7.893  -3.084
  746   1HH1  ARG  86          2HH2      ARG  86   6.699  -6.288  -2.154
  747   2HH1  ARG  86          1HH2      ARG  86   7.687  -7.171  -3.265
  748   1HH2  ARG  86          2HH1      ARG  86   4.933  -9.238  -4.294
  749   2HH2  ARG  86          1HH1      ARG  86   6.691  -9.034  -4.426
  750    QB   ARG  86           QB       ARG  86   3.331  -5.782   0.723
  751    QG   ARG  86           QG       ARG  86   2.478  -7.170  -1.162
  752    QD   ARG  86           QD       ARG  86   4.716  -6.127  -1.305
  753    QH1  ARG  86           QH2      ARG  86   7.193  -6.730  -2.710
  754    QH2  ARG  86           QH1      ARG  86   5.812  -9.136  -4.360
  755    H    VAL  87           H        VAL  87   0.049  -7.815  -0.259
  756    HA   VAL  87           HA       VAL  87   0.346 -10.342   1.294
  757    HB   VAL  87           HB       VAL  87  -1.758 -11.057   0.292
  758   1HG1  VAL  87          2HG1      VAL  87  -1.735 -10.017   2.523
  759   2HG1  VAL  87          3HG1      VAL  87  -2.007  -8.419   1.795
  760   3HG1  VAL  87          1HG1      VAL  87  -3.243  -9.689   1.662
  761   1HG2  VAL  87          1HG2      VAL  87  -1.839  -9.604  -1.743
  762   2HG2  VAL  87          2HG2      VAL  87  -3.313  -9.550  -0.773
  763   3HG2  VAL  87          3HG2      VAL  87  -2.168  -8.213  -0.678
  764    QG1  VAL  87           QG1      VAL  87  -2.329  -9.375   1.994
  765    QG2  VAL  87           QG2      VAL  87  -2.440  -9.122  -1.065
  766    QQG  VAL  87           QQG      VAL  87  -2.384  -9.249   0.464
  767    H    GLU  88           H        GLU  88   0.455  -8.878  -1.993
  768    HA   GLU  88           HA       GLU  88   1.984 -11.195  -2.941
  769   1HB   GLU  88          1HB       GLU  88  -0.611 -11.357  -3.467
  770   2HB   GLU  88          2HB       GLU  88  -0.243 -10.068  -4.625
  771   1HG   GLU  88          1HG       GLU  88   0.222 -11.869  -5.984
  772   2HG   GLU  88          2HG       GLU  88   1.795 -11.731  -5.217
  773    QB   GLU  88           QB       GLU  88  -0.427 -10.713  -4.046
  774    QG   GLU  88           QG       GLU  88   1.008 -11.800  -5.601
   
  No H/Q in entry =         774
  Start of MODEL   15
    1   1HA   GLY   1          1HA       GLY   1  13.883  -0.830 -14.686
    2   2HA   GLY   1          2HA       GLY   1  14.530   0.555 -13.769
    3    QA   GLY   1           QA       GLY   1  14.206  -0.138 -14.227
    4    H    ASP   2           H        ASP   2  12.539   0.596 -11.803
    5    HA   ASP   2           HA       ASP   2  13.168  -1.874 -10.213
    6   1HB   ASP   2          1HB       ASP   2  12.925   1.036  -9.372
    7   2HB   ASP   2          2HB       ASP   2  13.176  -0.347  -8.287
    8    QB   ASP   2           QB       ASP   2  13.050   0.344  -8.830
    9    H    GLY   3           H        GLY   3  11.085  -2.752 -11.128
   10   1HA   GLY   3          1HA       GLY   3   8.638  -1.752 -10.083
   11   2HA   GLY   3          2HA       GLY   3   8.931  -3.453 -10.313
   12    QA   GLY   3           QA       GLY   3   8.785  -2.602 -10.198
   13    H    TYR   4           H        TYR   4   7.697  -2.050  -8.109
   14    HA   TYR   4           HA       TYR   4   8.659  -3.539  -5.869
   15   1HB   TYR   4          1HB       TYR   4   9.320  -1.518  -4.441
   16   2HB   TYR   4          2HB       TYR   4  10.473  -2.090  -5.613
   17    HD1  TYR   4          1HD       TYR   4   7.552   0.358  -5.783
   18    HD2  TYR   4          2HD       TYR   4  11.757  -0.360  -6.431
   19    HE1  TYR   4          1HE       TYR   4   7.770   2.566  -6.820
   20    HE2  TYR   4          2HE       TYR   4  11.965   1.877  -7.459
   21    HH   TYR   4           HH       TYR   4   9.172   4.056  -7.847
   22    QB   TYR   4           QB       TYR   4   9.896  -1.804  -5.027
   23    QG   TYR   4           QD       TYR   4   9.655  -0.001  -6.107
   24    QZ   TYR   4           QE       TYR   4   9.868   2.222  -7.140
   25    QR   TYR   4           QR       TYR   4   9.761   1.111  -6.623
   26    H    LEU   5           H        LEU   5   7.552  -2.290  -3.786
   27    HA   LEU   5           HA       LEU   5   4.984  -1.140  -4.644
   28   1HB   LEU   5          1HB       LEU   5   4.935  -3.750  -4.414
   29   2HB   LEU   5          2HB       LEU   5   4.952  -3.453  -2.677
   30    HG   LEU   5           HG       LEU   5   2.975  -2.240  -4.669
   31   1HD1  LEU   5          3HD1      LEU   5   2.863  -4.769  -4.477
   32   2HD1  LEU   5          1HD1      LEU   5   2.415  -4.523  -2.784
   33   3HD1  LEU   5          2HD1      LEU   5   1.386  -3.876  -4.050
   34   1HD2  LEU   5          1HD2      LEU   5   3.085  -2.310  -1.620
   35   2HD2  LEU   5          2HD2      LEU   5   3.023  -0.878  -2.680
   36   3HD2  LEU   5          3HD2      LEU   5   1.612  -1.937  -2.522
   37    QB   LEU   5           QB       LEU   5   4.944  -3.602  -3.546
   38    QD1  LEU   5           QD1      LEU   5   2.221  -4.389  -3.770
   39    QD2  LEU   5           QD2      LEU   5   2.573  -1.708  -2.274
   40    QQD  LEU   5           QQD      LEU   5   2.397  -3.049  -3.022
   41    H    ILE   6           H        ILE   6   5.271   0.784  -3.708
   42    HA   ILE   6           HA       ILE   6   5.758   0.965  -0.811
   43    HB   ILE   6           HB       ILE   6   7.132   3.001  -1.248
   44   1HG1  ILE   6          1HG1      ILE   6   7.210   1.948  -4.113
   45   2HG1  ILE   6          2HG1      ILE   6   6.549   3.480  -3.567
   46   1HG2  ILE   6          1HG2      ILE   6   8.141   0.784  -0.624
   47   2HG2  ILE   6          2HG2      ILE   6   8.558   0.556  -2.335
   48   3HG2  ILE   6          3HG2      ILE   6   9.213   1.937  -1.427
   49   1HD1  ILE   6          3HD1      ILE   6   8.931   4.073  -2.804
   50   2HD1  ILE   6          1HD1      ILE   6   9.459   2.615  -3.676
   51   3HD1  ILE   6          2HD1      ILE   6   8.673   3.935  -4.556
   52    QG1  ILE   6           QG1      ILE   6   6.880   2.714  -3.840
   53    QG2  ILE   6           QG2      ILE   6   8.637   1.092  -1.462
   54    QD1  ILE   6           QD1      ILE   6   9.021   3.541  -3.679
   55    H    MET   7           H        MET   7   4.834   3.140  -0.047
   56    HA   MET   7           HA       MET   7   3.194   4.451  -2.060
   57   1HB   MET   7          1HB       MET   7   1.434   4.762  -0.444
   58   2HB   MET   7          2HB       MET   7   1.681   3.045  -0.783
   59   1HG   MET   7          1HG       MET   7   2.702   2.703   1.369
   60   2HG   MET   7          2HG       MET   7   2.765   4.432   1.685
   61   1HE   MET   7          3HE       MET   7   0.311   1.399   1.122
   62   2HE   MET   7          1HE       MET   7  -1.248   2.131   1.554
   63   3HE   MET   7          2HE       MET   7  -0.417   2.640   0.074
   64    QB   MET   7           QB       MET   7   1.557   3.904  -0.614
   65    QG   MET   7           QG       MET   7   2.734   3.567   1.527
   66    QE   MET   7           QE       MET   7  -0.451   2.057   0.917
   67    H    CYS   8           H        CYS   8   2.580   6.536  -1.475
   68    HA   CYS   8           HA       CYS   8   4.836   7.991  -0.252
   69   1HB   CYS   8          1HB       CYS   8   3.901   7.969  -3.173
   70   2HB   CYS   8          2HB       CYS   8   4.473   9.464  -2.514
   71    QB   CYS   8           QB       CYS   8   4.187   8.717  -2.843
   72    H    LYS   9           H        LYS   9   4.427  10.195  -0.262
   73    HA   LYS   9           HA       LYS   9   1.561  10.983   0.122
   74   1HB   LYS   9          1HB       LYS   9   2.417  13.083   0.768
   75   2HB   LYS   9          2HB       LYS   9   3.264  11.747   1.622
   76   1HG   LYS   9          1HG       LYS   9   5.091  13.027   1.149
   77   2HG   LYS   9          2HG       LYS   9   5.031  12.083  -0.331
   78   1HD   LYS   9          1HD       LYS   9   5.170  14.234  -1.174
   79   2HD   LYS   9          2HD       LYS   9   3.425  13.981  -1.196
   80   1HE   LYS   9          1HE       LYS   9   3.330  15.134   1.109
   81   2HE   LYS   9          2HE       LYS   9   5.011  15.594   0.841
   82   1HZ   LYS   9          2HZ       LYS   9   4.167  16.596  -1.287
   83   2HZ   LYS   9          3HZ       LYS   9   2.625  16.356  -0.673
   84   3HZ   LYS   9          1HZ       LYS   9   3.678  17.339   0.099
   85    QB   LYS   9           QB       LYS   9   2.840  12.415   1.195
   86    QG   LYS   9           QG       LYS   9   5.061  12.555   0.409
   87    QD   LYS   9           QD       LYS   9   4.297  14.108  -1.185
   88    QE   LYS   9           QE       LYS   9   4.171  15.364   0.975
   89    QZ   LYS   9           QZ       LYS   9   3.490  16.764  -0.620
   90    H    ASN  10           H        ASN  10   3.662  11.155  -2.454
   91    HA   ASN  10           HA       ASN  10   1.334  12.070  -4.009
   92   1HB   ASN  10          1HB       ASN  10   2.141  13.940  -5.027
   93   2HB   ASN  10          2HB       ASN  10   2.783  14.109  -3.430
   94   1HD2  ASN  10          2HD2      ASN  10   5.558  15.145  -5.468
   95   2HD2  ASN  10          1HD2      ASN  10   3.959  15.702  -4.994
   96    QB   ASN  10           QB       ASN  10   2.462  14.024  -4.229
   97    QD2  ASN  10           QD2      ASN  10   4.759  15.423  -5.231
   98    H    CYS  11           H        CYS  11   2.190  12.331  -6.473
   99    HA   CYS  11           HA       CYS  11   2.329   9.463  -7.046
  100   1HB   CYS  11          1HB       CYS  11   0.713  11.152  -8.027
  101   2HB   CYS  11          2HB       CYS  11   2.077  11.845  -8.920
  102    QB   CYS  11           QB       CYS  11   1.395  11.499  -8.474
  103    H    ASP  12           H        ASP  12   4.740  11.580  -6.437
  104    HA   ASP  12           HA       ASP  12   6.506  10.660  -8.675
  105   1HB   ASP  12          1HB       ASP  12   6.084  13.064  -8.567
  106   2HB   ASP  12          2HB       ASP  12   6.747  13.119  -6.924
  107    QB   ASP  12           QB       ASP  12   6.415  13.091  -7.746
  108    HA   PRO  13           HA       PRO  13   8.304   8.468  -5.048
  109   1HB   PRO  13          1HB       PRO  13  10.291   7.084  -6.320
  110   2HB   PRO  13          2HB       PRO  13   8.584   6.589  -6.370
  111   1HG   PRO  13          1HG       PRO  13  10.124   8.219  -8.421
  112   2HG   PRO  13          2HG       PRO  13   9.108   6.805  -8.747
  113   1HD   PRO  13          1HD       PRO  13   8.216   9.351  -9.048
  114   2HD   PRO  13          2HD       PRO  13   7.106   8.090  -8.431
  115    QB   PRO  13           QB       PRO  13   9.438   6.836  -6.345
  116    QG   PRO  13           QG       PRO  13   9.616   7.512  -8.584
  117    QD   PRO  13           QD       PRO  13   7.661   8.721  -8.739
  118    H    ASN  14           H        ASN  14   9.930  10.394  -7.531
  119    HA   ASN  14           HA       ASN  14  12.583  10.184  -6.426
  120   1HB   ASN  14          1HB       ASN  14  11.933  10.331  -8.878
  121   2HB   ASN  14          2HB       ASN  14  11.499  12.011  -8.597
  122   1HD2  ASN  14          2HD2      ASN  14  15.299  11.144  -9.399
  123   2HD2  ASN  14          1HD2      ASN  14  14.014   9.965  -9.513
  124    QB   ASN  14           QB       ASN  14  11.716  11.171  -8.738
  125    QD2  ASN  14           QD2      ASN  14  14.656  10.554  -9.456
  126    H    THR  15           H        THR  15   9.955  12.576  -6.450
  127    HA   THR  15           HA       THR  15  11.359  13.955  -4.213
  128    HB   THR  15           HB       THR  15  11.881  15.207  -6.228
  129    HG1  THR  15          1HG       THR  15  11.498  16.330  -4.281
  130   1HG2  THR  15          3HG2      THR  15   8.884  15.466  -6.651
  131   2HG2  THR  15          1HG2      THR  15  10.136  16.398  -7.503
  132   3HG2  THR  15          2HG2      THR  15  10.067  14.646  -7.685
  133    QG2  THR  15           QG2      THR  15   9.696  15.503  -7.279
  134    H    GLY  16           H        GLY  16   8.812  12.119  -4.654
  135   1HA   GLY  16          1HA       GLY  16   6.865  13.711  -3.123
  136   2HA   GLY  16          2HA       GLY  16   6.776  11.996  -3.514
  137    QA   GLY  16           QA       GLY  16   6.821  12.854  -3.319
  138    H    SER  17           H        SER  17   9.043  10.959  -2.632
  139    HA   SER  17           HA       SER  17  10.085  10.132  -0.793
  140   1HB   SER  17          1HB       SER  17   9.742  12.462   0.387
  141   2HB   SER  17          2HB       SER  17   8.389  11.641   1.199
  142    HG   SER  17           HG       SER  17  10.150  11.260   2.436
  143    QB   SER  17           QB       SER  17   9.065  12.051   0.793
  144    H    CYS  18           H        CYS  18   9.525   8.145  -0.160
  145    HA   CYS  18           HA       CYS  18   6.676   7.413   0.103
  146   1HB   CYS  18          1HB       CYS  18   8.803   6.359  -1.738
  147   2HB   CYS  18          2HB       CYS  18   7.877   5.105  -0.954
  148    QB   CYS  18           QB       CYS  18   8.340   5.732  -1.346
  149    H    ASP  19           H        ASP  19   6.502   5.118   1.113
  150    HA   ASP  19           HA       ASP  19   8.612   4.664   3.156
  151   1HB   ASP  19          1HB       ASP  19   7.143   2.921   3.991
  152   2HB   ASP  19          2HB       ASP  19   6.587   4.571   4.116
  153    QB   ASP  19           QB       ASP  19   6.865   3.746   4.053
  154    H    TRP  20           H        TRP  20  10.263   3.936   2.022
  155    HA   TRP  20           HA       TRP  20  10.207   1.395   0.460
  156   1HB   TRP  20          1HB       TRP  20  12.475   3.168   1.399
  157   2HB   TRP  20          2HB       TRP  20  12.612   1.790   0.309
  158    HD1  TRP  20           HD       TRP  20  11.257   5.365   0.490
  159    HE1  TRP  20          1HE       TRP  20  11.331   6.426  -1.779
  160    HE3  TRP  20          3HE       TRP  20  12.234   1.181  -2.227
  161    HZ2  TRP  20          2HZ       TRP  20  11.822   5.563  -4.553
  162    HZ3  TRP  20          3HZ       TRP  20  12.703   1.347  -4.667
  163    HH2  TRP  20           HH       TRP  20  12.508   3.546  -5.830
  164    QB   TRP  20           QB       TRP  20  12.543   2.479   0.854
  165    H    LYS  21           H        LYS  21   9.012   1.038   2.843
  166    HA   LYS  21           HA       LYS  21  10.902   0.179   4.951
  167   1HB   LYS  21          1HB       LYS  21   8.078   1.003   4.737
  168   2HB   LYS  21          2HB       LYS  21   8.255  -0.451   5.692
  169   1HG   LYS  21          1HG       LYS  21   9.976   2.016   6.177
  170   2HG   LYS  21          2HG       LYS  21   8.406   1.787   6.934
  171   1HD   LYS  21          1HD       LYS  21   9.131  -0.402   7.873
  172   2HD   LYS  21          2HD       LYS  21  10.725  -0.187   7.139
  173   1HE   LYS  21          1HE       LYS  21  11.009   1.936   8.413
  174   2HE   LYS  21          2HE       LYS  21   9.519   1.584   9.309
  175   1HZ   LYS  21          1HZ       LYS  21  11.824  -0.258   9.217
  176   2HZ   LYS  21          2HZ       LYS  21  11.653   0.888  10.378
  177   3HZ   LYS  21          3HZ       LYS  21  10.563  -0.347  10.237
  178    QB   LYS  21           QB       LYS  21   8.166   0.276   5.215
  179    QG   LYS  21           QG       LYS  21   9.191   1.901   6.555
  180    QD   LYS  21           QD       LYS  21   9.928  -0.295   7.506
  181    QE   LYS  21           QE       LYS  21  10.264   1.760   8.861
  182    QZ   LYS  21           QZ       LYS  21  11.346   0.094   9.944
  183    H    GLN  22           H        GLN  22  10.498  -2.019   5.940
  184    HA   GLN  22           HA       GLN  22  10.035  -4.109   3.925
  185   1HB   GLN  22          1HB       GLN  22  11.560  -4.409   5.984
  186   2HB   GLN  22          2HB       GLN  22  10.062  -4.393   6.941
  187   1HG   GLN  22          1HG       GLN  22   9.234  -6.359   5.655
  188   2HG   GLN  22          2HG       GLN  22  10.732  -6.365   4.718
  189   1HE2  GLN  22          2HE2      GLN  22  10.746  -7.574   8.700
  190   2HE2  GLN  22          1HE2      GLN  22   9.488  -6.532   8.098
  191    QB   GLN  22           QB       GLN  22  10.811  -4.401   6.463
  192    QG   GLN  22           QG       GLN  22   9.983  -6.362   5.186
  193    QE2  GLN  22           QE2      GLN  22  10.117  -7.053   8.399
  194    H    ASN  23           H        ASN  23   8.081  -5.155   3.828
  195    HA   ASN  23           HA       ASN  23   5.704  -3.927   5.218
  196   1HB   ASN  23          1HB       ASN  23   6.035  -4.504   2.247
  197   2HB   ASN  23          2HB       ASN  23   4.595  -3.849   3.033
  198   1HD2  ASN  23          2HD2      ASN  23   6.471  -1.034   1.445
  199   2HD2  ASN  23          1HD2      ASN  23   5.941  -2.592   0.861
  200    QB   ASN  23           QB       ASN  23   5.315  -4.177   2.640
  201    QD2  ASN  23           QD2      ASN  23   6.206  -1.813   1.153
  202    H    TRP  24           H        TRP  24   7.039  -6.574   3.239
  203    HA   TRP  24           HA       TRP  24   5.001  -8.424   3.251
  204   1HB   TRP  24          1HB       TRP  24   8.033  -8.437   3.172
  205   2HB   TRP  24          2HB       TRP  24   7.198  -9.941   3.456
  206    HD1  TRP  24           HD       TRP  24   8.366  -7.967   0.634
  207    HE1  TRP  24          1HE       TRP  24   7.358  -8.771  -1.550
  208    HE3  TRP  24          3HE       TRP  24   4.636 -10.886   2.549
  209    HZ2  TRP  24          2HZ       TRP  24   5.056 -10.397  -2.382
  210    HZ3  TRP  24          3HZ       TRP  24   2.959 -11.929   1.043
  211    HH2  TRP  24           HH       TRP  24   3.221 -11.748  -1.415
  212    QB   TRP  24           QB       TRP  24   7.616  -9.189   3.314
  213    H    ASN  25           H        ASN  25   3.903  -9.135   4.908
  214    HA   ASN  25           HA       ASN  25   3.277  -9.953   6.940
  215   1HB   ASN  25          1HB       ASN  25   6.092 -11.138   6.885
  216   2HB   ASN  25          2HB       ASN  25   4.772 -11.642   7.938
  217   1HD2  ASN  25          2HD2      ASN  25   4.828 -13.060   4.140
  218   2HD2  ASN  25          1HD2      ASN  25   6.157 -12.142   4.800
  219    QB   ASN  25           QB       ASN  25   5.432 -11.390   7.411
  220    QD2  ASN  25           QD2      ASN  25   5.492 -12.601   4.470
  221    H    THR  26           H        THR  26   4.585  -7.240   7.005
  222    HA   THR  26           HA       THR  26   5.653  -7.236   9.824
  223    HB   THR  26           HB       THR  26   6.792  -6.232   7.285
  224    HG1  THR  26          1HG       THR  26   7.797  -7.674   8.858
  225   1HG2  THR  26          1HG2      THR  26   6.917  -4.313   9.607
  226   2HG2  THR  26          2HG2      THR  26   7.902  -4.295   8.162
  227   3HG2  THR  26          3HG2      THR  26   6.158  -4.061   8.012
  228    QG2  THR  26           QG2      THR  26   6.992  -4.223   8.593
  229    H    CYS  27           H        CYS  27   5.234  -4.656  10.477
  230    HA   CYS  27           HA       CYS  27   2.519  -4.040   9.674
  231   1HB   CYS  27          1HB       CYS  27   2.408  -5.916  11.367
  232   2HB   CYS  27          2HB       CYS  27   3.226  -4.851  12.504
  233    QB   CYS  27           QB       CYS  27   2.817  -5.383  11.935
  234    H    VAL  28           H        VAL  28   3.501  -2.153   8.906
  235    HA   VAL  28           HA       VAL  28   5.198  -0.567  10.705
  236    HB   VAL  28           HB       VAL  28   4.248   0.069   7.886
  237   1HG1  VAL  28          2HG1      VAL  28   5.498   1.921   9.016
  238   2HG1  VAL  28          3HG1      VAL  28   6.840   0.791   9.326
  239   3HG1  VAL  28          1HG1      VAL  28   6.378   1.236   7.666
  240   1HG2  VAL  28          3HG2      VAL  28   6.562  -1.713   8.682
  241   2HG2  VAL  28          1HG2      VAL  28   5.144  -2.136   7.675
  242   3HG2  VAL  28          2HG2      VAL  28   6.337  -1.004   7.066
  243    QG1  VAL  28           QG1      VAL  28   6.239   1.316   8.669
  244    QG2  VAL  28           QG2      VAL  28   6.014  -1.618   7.808
  245    QQG  VAL  28           QQG      VAL  28   6.127  -0.151   8.238
  246    H    GLY  29           H        GLY  29   4.723   1.835  10.970
  247   1HA   GLY  29          1HA       GLY  29   1.900   2.478  10.869
  248   2HA   GLY  29          2HA       GLY  29   2.996   3.358  11.868
  249    QA   GLY  29           QA       GLY  29   2.448   2.918  11.369
  250    H    ILE  30           H        ILE  30   1.377   3.557   9.239
  251    HA   ILE  30           HA       ILE  30   3.302   4.906   7.401
  252    HB   ILE  30           HB       ILE  30   0.408   3.979   7.222
  253   1HG1  ILE  30          1HG1      ILE  30   1.104   2.473   5.576
  254   2HG1  ILE  30          2HG1      ILE  30   2.674   3.257   5.353
  255   1HG2  ILE  30          1HG2      ILE  30   1.938   5.598   5.184
  256   2HG2  ILE  30          2HG2      ILE  30   0.447   4.693   4.834
  257   3HG2  ILE  30          3HG2      ILE  30   0.400   6.036   5.972
  258   1HD1  ILE  30          2HD1      ILE  30   2.003   1.803   7.927
  259   2HD1  ILE  30          3HD1      ILE  30   2.673   1.004   6.515
  260   3HD1  ILE  30          1HD1      ILE  30   3.589   2.303   7.294
  261    QG1  ILE  30           QG1      ILE  30   1.889   2.865   5.464
  262    QG2  ILE  30           QG2      ILE  30   0.928   5.442   5.330
  263    QD1  ILE  30           QD1      ILE  30   2.755   1.703   7.245
  264    H    GLY  31           H        GLY  31   2.970   7.202   6.749
  265   1HA   GLY  31          1HA       GLY  31   0.687   8.600   7.155
  266   2HA   GLY  31          2HA       GLY  31   1.582   8.845   8.658
  267    QA   GLY  31           QA       GLY  31   1.134   8.723   7.906
  268    H    ALA  32           H        ALA  32   1.531  11.021   8.010
  269    HA   ALA  32           HA       ALA  32   2.247  12.926   7.270
  270   1HB   ALA  32          3HB       ALA  32   4.466  12.164   8.046
  271   2HB   ALA  32          1HB       ALA  32   4.767  11.415   6.470
  272   3HB   ALA  32          2HB       ALA  32   4.645  13.173   6.598
  273    QB   ALA  32           QB       ALA  32   4.626  12.251   7.038
  274    H    ASN  33           H        ASN  33   0.514  12.872   5.960
  275    HA   ASN  33           HA       ASN  33  -0.568  13.431   4.060
  276   1HB   ASN  33          1HB       ASN  33   2.120  14.060   2.805
  277   2HB   ASN  33          2HB       ASN  33   0.536  14.602   2.261
  278   1HD2  ASN  33          2HD2      ASN  33   2.547  16.948   4.791
  279   2HD2  ASN  33          1HD2      ASN  33   3.261  15.624   3.863
  280    QB   ASN  33           QB       ASN  33   1.328  14.331   2.533
  281    QD2  ASN  33           QD2      ASN  33   2.904  16.286   4.327
  282    H    VAL  34           H        VAL  34   1.053  10.718   4.421
  283    HA   VAL  34           HA       VAL  34   1.518   9.820   1.694
  284    HB   VAL  34           HB       VAL  34   1.343   8.380   4.321
  285   1HG1  VAL  34          2HG1      VAL  34   1.844   7.158   1.560
  286   2HG1  VAL  34          3HG1      VAL  34   2.152   6.371   3.110
  287   3HG1  VAL  34          1HG1      VAL  34   0.506   6.749   2.657
  288   1HG2  VAL  34          1HG2      VAL  34   3.319   9.874   3.624
  289   2HG2  VAL  34          2HG2      VAL  34   3.727   8.186   3.945
  290   3HG2  VAL  34          3HG2      VAL  34   3.592   8.763   2.276
  291    QG1  VAL  34           QG1      VAL  34   1.501   6.760   2.442
  292    QG2  VAL  34           QG2      VAL  34   3.546   8.941   3.282
  293    QQG  VAL  34           QQG      VAL  34   2.523   7.850   2.862
  294    H    HIS  35           H        HIS  35  -0.130   9.749   0.229
  295    HA   HIS  35           HA       HIS  35  -2.187   7.782   0.743
  296   1HB   HIS  35          1HB       HIS  35  -4.105   9.017   0.400
  297   2HB   HIS  35          2HB       HIS  35  -3.233   9.942   1.606
  298    HD1  HIS  35          1HD       HIS  35  -5.241  10.360  -1.318
  299    HD2  HIS  35          2HD       HIS  35  -1.731  12.129   0.153
  300    HE1  HIS  35          1HE       HIS  35  -5.112  12.690  -2.366
  301    QB   HIS  35           QB       HIS  35  -3.669   9.480   1.003
  302    H    TRP  36           H        TRP  36   0.129   7.942  -1.025
  303    HA   TRP  36           HA       TRP  36  -1.414   7.291  -3.541
  304   1HB   TRP  36          1HB       TRP  36   1.114   8.886  -3.318
  305   2HB   TRP  36          2HB       TRP  36   0.475   8.250  -4.821
  306    HD1  TRP  36           HD       TRP  36  -0.680  10.710  -2.067
  307    HE1  TRP  36          1HE       TRP  36  -2.440  12.237  -3.008
  308    HE3  TRP  36          3HE       TRP  36  -1.028   8.690  -6.702
  309    HZ2  TRP  36          2HZ       TRP  36  -3.646  12.776  -5.641
  310    HZ3  TRP  36          3HZ       TRP  36  -2.465   9.725  -8.449
  311    HH2  TRP  36           HH       TRP  36  -3.779  11.778  -7.920
  312    QB   TRP  36           QB       TRP  36   0.794   8.568  -4.069
  313    H    MET  37           H        MET  37  -1.040   5.236  -3.974
  314    HA   MET  37           HA       MET  37   1.427   3.890  -2.989
  315   1HB   MET  37          1HB       MET  37  -0.691   2.756  -2.610
  316   2HB   MET  37          2HB       MET  37  -0.956   2.697  -4.379
  317   1HG   MET  37          1HG       MET  37   1.062   1.284  -4.578
  318   2HG   MET  37          2HG       MET  37   1.408   1.494  -2.859
  319   1HE   MET  37          2HE       MET  37  -1.126   0.149  -5.430
  320   2HE   MET  37          3HE       MET  37  -2.208  -0.875  -4.451
  321   3HE   MET  37          1HE       MET  37  -2.270   0.890  -4.286
  322    QB   MET  37           QB       MET  37  -0.823   2.726  -3.495
  323    QG   MET  37           QG       MET  37   1.235   1.389  -3.719
  324    QE   MET  37           QE       MET  37  -1.868   0.055  -4.722
  325    H    VAL  38           H        VAL  38   3.070   3.231  -4.415
  326    HA   VAL  38           HA       VAL  38   2.677   3.861  -7.296
  327    HB   VAL  38           HB       VAL  38   5.304   4.547  -6.009
  328   1HG1  VAL  38          1HG1      VAL  38   4.876   4.637  -8.476
  329   2HG1  VAL  38          2HG1      VAL  38   3.569   5.804  -8.191
  330   3HG1  VAL  38          3HG1      VAL  38   5.233   6.256  -7.819
  331   1HG2  VAL  38          1HG2      VAL  38   2.864   6.375  -5.854
  332   2HG2  VAL  38          2HG2      VAL  38   3.810   5.743  -4.482
  333   3HG2  VAL  38          3HG2      VAL  38   4.546   6.882  -5.610
  334    QG1  VAL  38           QG1      VAL  38   4.559   5.566  -8.162
  335    QG2  VAL  38           QG2      VAL  38   3.740   6.333  -5.315
  336    QQG  VAL  38           QQG      VAL  38   4.150   5.949  -6.739
  337    H    THR  39           H        THR  39   2.662   1.841  -8.117
  338    HA   THR  39           HA       THR  39   4.018  -0.246  -6.553
  339    HB   THR  39           HB       THR  39   2.641  -1.714  -8.075
  340    HG1  THR  39          1HG       THR  39   1.184  -0.603  -9.409
  341   1HG2  THR  39          2HG2      THR  39   1.777  -0.735  -5.881
  342   2HG2  THR  39          3HG2      THR  39   1.008   0.544  -6.845
  343   3HG2  THR  39          1HG2      THR  39   0.553  -1.160  -7.080
  344    QG2  THR  39           QG2      THR  39   1.112  -0.450  -6.602
  345    H    GLY  40           H        GLY  40   6.088   1.115  -7.671
  346   1HA   GLY  40          1HA       GLY  40   8.043   0.155  -8.810
  347   2HA   GLY  40          2HA       GLY  40   6.933  -0.528 -10.017
  348    QA   GLY  40           QA       GLY  40   7.488  -0.186  -9.414
  349    H    GLY  41           H        GLY  41   8.020   0.512 -11.690
  350   1HA   GLY  41          1HA       GLY  41   7.118   3.191 -12.311
  351   2HA   GLY  41          2HA       GLY  41   8.858   3.127 -11.962
  352    QA   GLY  41           QA       GLY  41   7.988   3.159 -12.136
  353    H    SER  42           H        SER  42   9.346   0.506 -13.070
  354    HA   SER  42           HA       SER  42  10.235   0.639 -15.466
  355   1HB   SER  42          1HB       SER  42   8.576  -1.639 -14.361
  356   2HB   SER  42          2HB       SER  42   9.789  -1.780 -15.642
  357    HG   SER  42           HG       SER  42  10.525  -2.141 -13.378
  358    QB   SER  42           QB       SER  42   9.183  -1.709 -15.002
  359    H    THR  43           H        THR  43   7.151  -1.111 -15.801
  360    HA   THR  43           HA       THR  43   6.187   0.730 -17.823
  361    HB   THR  43           HB       THR  43   8.071  -0.259 -18.962
  362    HG1  THR  43          1HG       THR  43   5.615  -1.125 -20.046
  363   1HG2  THR  43          3HG2      THR  43   7.926  -2.584 -17.753
  364   2HG2  THR  43          1HG2      THR  43   6.904  -3.001 -19.157
  365   3HG2  THR  43          2HG2      THR  43   8.541  -2.404 -19.391
  366    QG2  THR  43           QG2      THR  43   7.790  -2.663 -18.767
  367    H    ASP  44           H        ASP  44   5.643  -2.886 -17.778
  368    HA   ASP  44           HA       ASP  44   3.372  -2.590 -15.953
  369   1HB   ASP  44          1HB       ASP  44   2.747  -4.756 -17.189
  370   2HB   ASP  44          2HB       ASP  44   2.318  -3.267 -18.023
  371    QB   ASP  44           QB       ASP  44   2.532  -4.012 -17.606
  372    H    GLY  45           H        GLY  45   3.341  -5.078 -15.084
  373   1HA   GLY  45          1HA       GLY  45   5.510  -6.731 -15.905
  374   2HA   GLY  45          2HA       GLY  45   5.713  -6.235 -14.207
  375    QA   GLY  45           QA       GLY  45   5.611  -6.483 -15.056
  376    H    LYS  46           H        LYS  46   3.806  -6.372 -12.905
  377    HA   LYS  46           HA       LYS  46   1.583  -8.082 -13.407
  378   1HB   LYS  46          1HB       LYS  46   2.537  -9.560 -11.333
  379   2HB   LYS  46          2HB       LYS  46   2.469 -10.037 -13.030
  380   1HG   LYS  46          1HG       LYS  46   4.828  -9.425 -13.360
  381   2HG   LYS  46          2HG       LYS  46   4.854  -8.662 -11.756
  382   1HD   LYS  46          1HD       LYS  46   5.978 -10.648 -11.475
  383   2HD   LYS  46          2HD       LYS  46   4.384 -10.964 -10.782
  384   1HE   LYS  46          1HE       LYS  46   5.379 -11.825 -13.575
  385   2HE   LYS  46          2HE       LYS  46   5.311 -12.856 -12.154
  386   1HZ   LYS  46          3HZ       LYS  46   2.840 -12.273 -12.163
  387   2HZ   LYS  46          1HZ       LYS  46   3.111 -11.837 -13.748
  388   3HZ   LYS  46          2HZ       LYS  46   3.400 -13.366 -13.246
  389    QB   LYS  46           QB       LYS  46   2.503  -9.799 -12.182
  390    QG   LYS  46           QG       LYS  46   4.841  -9.043 -12.558
  391    QD   LYS  46           QD       LYS  46   5.181 -10.806 -11.128
  392    QE   LYS  46           QE       LYS  46   5.345 -12.341 -12.864
  393    QZ   LYS  46           QZ       LYS  46   3.117 -12.492 -13.052
  394    H    GLN  47           H        GLN  47   0.074  -7.836 -11.616
  395    HA   GLN  47           HA       GLN  47   0.249  -5.285 -10.486
  396   1HB   GLN  47          1HB       GLN  47  -1.834  -5.925  -9.259
  397   2HB   GLN  47          2HB       GLN  47  -1.920  -6.295 -10.977
  398   1HG   GLN  47          1HG       GLN  47  -1.018  -8.407  -9.020
  399   2HG   GLN  47          2HG       GLN  47  -2.737  -8.026  -9.172
  400   1HE2  GLN  47          2HE2      GLN  47  -1.086 -10.588 -11.755
  401   2HE2  GLN  47          1HE2      GLN  47  -0.343 -10.051 -10.260
  402    QB   GLN  47           QB       GLN  47  -1.877  -6.110 -10.118
  403    QG   GLN  47           QG       GLN  47  -1.877  -8.216  -9.096
  404    QE2  GLN  47           QE2      GLN  47  -0.714 -10.319 -11.007
  405    H    GLY  48           H        GLY  48  -0.163  -4.730  -8.195
  406   1HA   GLY  48          1HA       GLY  48   1.405  -6.372  -6.258
  407   2HA   GLY  48          2HA       GLY  48   1.528  -4.612  -6.320
  408    QA   GLY  48           QA       GLY  48   1.466  -5.492  -6.289
  409    H    CYS  49           H        CYS  49   0.189  -6.745  -4.383
  410    HA   CYS  49           HA       CYS  49  -2.345  -5.250  -4.036
  411   1HB   CYS  49          1HB       CYS  49  -1.916  -8.197  -3.908
  412   2HB   CYS  49          2HB       CYS  49  -3.354  -7.425  -3.296
  413    QB   CYS  49           QB       CYS  49  -2.635  -7.811  -3.602
  414    H    ALA  50           H        ALA  50  -2.929  -5.211  -1.996
  415    HA   ALA  50           HA       ALA  50  -1.280  -6.264   0.192
  416   1HB   ALA  50          2HB       ALA  50  -1.396  -3.278  -0.419
  417   2HB   ALA  50          3HB       ALA  50  -0.726  -3.982   1.068
  418   3HB   ALA  50          1HB       ALA  50   0.058  -4.291  -0.495
  419    QB   ALA  50           QB       ALA  50  -0.688  -3.850   0.051
  420    H    THR  51           H        THR  51  -2.339  -6.200   2.088
  421    HA   THR  51           HA       THR  51  -5.180  -5.280   2.092
  422    HB   THR  51           HB       THR  51  -3.730  -7.009   4.111
  423    HG1  THR  51          1HG       THR  51  -4.117  -7.927   1.989
  424   1HG2  THR  51          1HG2      THR  51  -5.691  -5.680   4.994
  425   2HG2  THR  51          2HG2      THR  51  -6.700  -6.361   3.700
  426   3HG2  THR  51          3HG2      THR  51  -6.019  -7.418   4.953
  427    QG2  THR  51           QG2      THR  51  -6.137  -6.486   4.549
  428    H    ILE  52           H        ILE  52  -5.407  -3.263   2.791
  429    HA   ILE  52           HA       ILE  52  -3.294  -2.017   4.452
  430    HB   ILE  52           HB       ILE  52  -5.623  -0.609   3.119
  431   1HG1  ILE  52          1HG1      ILE  52  -4.637  -1.785   1.261
  432   2HG1  ILE  52          2HG1      ILE  52  -4.283  -0.060   1.174
  433   1HG2  ILE  52          2HG2      ILE  52  -4.329   0.665   4.766
  434   2HG2  ILE  52          3HG2      ILE  52  -2.833   0.354   3.887
  435   3HG2  ILE  52          1HG2      ILE  52  -4.099   1.324   3.132
  436   1HD1  ILE  52          2HD1      ILE  52  -1.972  -0.483   1.966
  437   2HD1  ILE  52          3HD1      ILE  52  -2.340  -2.229   2.036
  438   3HD1  ILE  52          1HD1      ILE  52  -2.374  -1.366   0.492
  439    QG1  ILE  52           QG1      ILE  52  -4.460  -0.922   1.218
  440    QG2  ILE  52           QG2      ILE  52  -3.753   0.781   3.928
  441    QD1  ILE  52           QD1      ILE  52  -2.228  -1.359   1.498
  442    H    TRP  53           H        TRP  53  -4.036  -0.928   6.398
  443    HA   TRP  53           HA       TRP  53  -6.713  -1.692   7.364
  444   1HB   TRP  53          1HB       TRP  53  -3.986  -2.142   8.557
  445   2HB   TRP  53          2HB       TRP  53  -5.303  -1.821   9.666
  446    HD1  TRP  53           HD       TRP  53  -7.217  -3.615   9.952
  447    HE1  TRP  53          1HE       TRP  53  -7.214  -6.148   9.683
  448    HE3  TRP  53          3HE       TRP  53  -3.206  -4.037   6.847
  449    HZ2  TRP  53          2HZ       TRP  53  -5.661  -8.137   8.243
  450    HZ3  TRP  53          3HZ       TRP  53  -2.539  -6.241   5.962
  451    HH2  TRP  53           HH       TRP  53  -3.740  -8.302   6.655
  452    QB   TRP  53           QB       TRP  53  -4.645  -1.982   9.112
  453    H    GLU  54           H        GLU  54  -7.474  -0.476   9.173
  454    HA   GLU  54           HA       GLU  54  -6.916   2.357   9.025
  455   1HB   GLU  54          1HB       GLU  54  -9.195   1.292   8.947
  456   2HB   GLU  54          2HB       GLU  54  -8.820   0.495  10.476
  457   1HG   GLU  54          1HG       GLU  54  -8.811   2.687  11.630
  458   2HG   GLU  54          2HG       GLU  54  -9.280   3.468  10.119
  459    QB   GLU  54           QB       GLU  54  -9.007   0.894   9.711
  460    QG   GLU  54           QG       GLU  54  -9.045   3.077  10.874
  461    H    GLY  55           H        GLY  55  -6.513  -0.337  11.345
  462   1HA   GLY  55          1HA       GLY  55  -6.052   1.336  13.648
  463   2HA   GLY  55          2HA       GLY  55  -5.638  -0.356  13.498
  464    QA   GLY  55           QA       GLY  55  -5.845   0.490  13.573
  465    H    SER  56           H        SER  56  -4.070   2.107  14.445
  466    HA   SER  56           HA       SER  56  -1.724   2.071  12.714
  467   1HB   SER  56          1HB       SER  56  -1.787   2.929  15.633
  468   2HB   SER  56          2HB       SER  56  -0.796   3.561  14.312
  469    HG   SER  56           HG       SER  56  -2.717   4.830  14.997
  470    QB   SER  56           QB       SER  56  -1.291   3.245  14.973
  471    H    GLY  57           H        GLY  57  -2.013  -0.405  12.719
  472   1HA   GLY  57          1HA       GLY  57   0.060  -1.807  13.919
  473   2HA   GLY  57          2HA       GLY  57  -1.272  -1.848  15.092
  474    QA   GLY  57           QA       GLY  57  -0.606  -1.828  14.505
  475    H    CYS  58           H        CYS  58  -1.767  -1.767  11.574
  476    HA   CYS  58           HA       CYS  58  -3.052  -3.038  10.304
  477   1HB   CYS  58          1HB       CYS  58  -2.118  -5.197   9.721
  478   2HB   CYS  58          2HB       CYS  58  -0.923  -3.907   9.765
  479    QB   CYS  58           QB       CYS  58  -1.520  -4.552   9.743
  480    H    VAL  59           H        VAL  59  -4.477  -2.595  12.538
  481    HA   VAL  59           HA       VAL  59  -6.141  -4.993  12.737
  482    HB   VAL  59           HB       VAL  59  -6.691  -4.168  15.027
  483   1HG1  VAL  59          1HG1      VAL  59  -3.906  -5.258  14.496
  484   2HG1  VAL  59          2HG1      VAL  59  -4.684  -5.251  16.076
  485   3HG1  VAL  59          3HG1      VAL  59  -5.401  -6.174  14.738
  486   1HG2  VAL  59          3HG2      VAL  59  -4.143  -2.525  14.824
  487   2HG2  VAL  59          1HG2      VAL  59  -5.809  -1.933  15.052
  488   3HG2  VAL  59          2HG2      VAL  59  -5.033  -2.892  16.309
  489    QG1  VAL  59           QG1      VAL  59  -4.664  -5.561  15.103
  490    QG2  VAL  59           QG2      VAL  59  -4.995  -2.450  15.395
  491    QQG  VAL  59           QQG      VAL  59  -4.829  -4.006  15.249
  492    H    GLY  60           H        GLY  60  -8.429  -4.140  13.438
  493   1HA   GLY  60          1HA       GLY  60 -10.085  -2.441  13.371
  494   2HA   GLY  60          2HA       GLY  60  -8.894  -1.302  12.746
  495    QA   GLY  60           QA       GLY  60  -9.489  -1.872  13.059
  496    H    ARG  61           H        ARG  61 -10.313  -0.647  11.018
  497    HA   ARG  61           HA       ARG  61 -11.556  -2.704   9.319
  498   1HB   ARG  61          1HB       ARG  61 -12.603  -0.446   9.915
  499   2HB   ARG  61          2HB       ARG  61 -11.384   0.318   8.876
  500   1HG   ARG  61          1HG       ARG  61 -12.185  -0.844   6.934
  501   2HG   ARG  61          2HG       ARG  61 -13.152  -1.958   7.913
  502   1HD   ARG  61          1HD       ARG  61 -14.634  -0.166   8.596
  503   2HD   ARG  61          2HD       ARG  61 -13.718   1.011   7.633
  504    HE   ARG  61           HE       ARG  61 -14.125  -0.751   5.718
  505   1HH1  ARG  61          2HH2      ARG  61 -16.603  -0.010   8.103
  506   2HH1  ARG  61          1HH2      ARG  61 -17.832  -0.931   7.285
  507   1HH2  ARG  61          2HH1      ARG  61 -15.536  -1.902   4.732
  508   2HH2  ARG  61          1HH1      ARG  61 -17.221  -2.030   5.173
  509    QB   ARG  61           QB       ARG  61 -11.993  -0.064   9.396
  510    QG   ARG  61           QG       ARG  61 -12.668  -1.401   7.424
  511    QD   ARG  61           QD       ARG  61 -14.176   0.422   8.115
  512    QH1  ARG  61           QH2      ARG  61 -17.217  -0.470   7.694
  513    QH2  ARG  61           QH1      ARG  61 -16.379  -1.966   4.953
  514    H    SER  62           H        SER  62 -11.185  -3.042   7.100
  515    HA   SER  62           HA       SER  62  -8.648  -2.055   6.228
  516   1HB   SER  62          1HB       SER  62  -8.117  -4.734   5.723
  517   2HB   SER  62          2HB       SER  62  -7.513  -3.813   7.066
  518    HG   SER  62           HG       SER  62  -9.130  -4.539   8.369
  519    QB   SER  62           QB       SER  62  -7.815  -4.273   6.395
  520    H    THR  63           H        THR  63  -8.025  -2.950   4.046
  521    HA   THR  63           HA       THR  63 -10.178  -4.127   2.475
  522    HB   THR  63           HB       THR  63 -10.471  -1.473   2.629
  523    HG1  THR  63          1HG       THR  63 -10.774  -2.945   0.265
  524   1HG2  THR  63          1HG2      THR  63  -8.191  -0.927   1.765
  525   2HG2  THR  63          2HG2      THR  63  -8.646  -1.656   0.208
  526   3HG2  THR  63          3HG2      THR  63  -9.519  -0.242   0.812
  527    QG2  THR  63           QG2      THR  63  -8.786  -0.941   0.928
  528    H    THR  64           H        THR  64  -9.328  -4.944   0.393
  529    HA   THR  64           HA       THR  64  -6.375  -5.167   0.346
  530    HB   THR  64           HB       THR  64  -7.194  -6.706  -1.697
  531    HG1  THR  64          1HG       THR  64  -9.113  -7.317   0.281
  532   1HG2  THR  64          3HG2      THR  64  -5.679  -7.328   0.123
  533   2HG2  THR  64          1HG2      THR  64  -7.066  -7.583   1.207
  534   3HG2  THR  64          2HG2      THR  64  -6.841  -8.596  -0.239
  535    QG2  THR  64           QG2      THR  64  -6.529  -7.836   0.364
  536    H    MET  65           H        MET  65  -5.458  -3.477  -0.607
  537    HA   MET  65           HA       MET  65  -6.866  -2.000  -2.779
  538   1HB   MET  65          1HB       MET  65  -5.935  -0.748  -0.869
  539   2HB   MET  65          2HB       MET  65  -4.334  -1.413  -1.197
  540   1HG   MET  65          1HG       MET  65  -3.915   0.167  -2.692
  541   2HG   MET  65          2HG       MET  65  -5.346  -0.218  -3.641
  542   1HE   MET  65          1HE       MET  65  -7.634   0.955  -3.430
  543   2HE   MET  65          2HE       MET  65  -7.755   0.506  -1.710
  544   3HE   MET  65          3HE       MET  65  -8.024   2.190  -2.209
  545    QB   MET  65           QB       MET  65  -5.135  -1.081  -1.033
  546    QG   MET  65           QG       MET  65  -4.630  -0.026  -3.167
  547    QE   MET  65           QE       MET  65  -7.804   1.217  -2.450
  548    H    CYS  66           H        CYS  66  -6.631  -3.748  -4.375
  549    HA   CYS  66           HA       CYS  66  -3.875  -4.498  -5.157
  550   1HB   CYS  66          1HB       CYS  66  -6.559  -5.140  -6.328
  551   2HB   CYS  66          2HB       CYS  66  -5.067  -5.566  -7.131
  552    QB   CYS  66           QB       CYS  66  -5.813  -5.353  -6.729
  553    H    CYS  67           H        CYS  67  -2.815  -3.591  -6.825
  554    HA   CYS  67           HA       CYS  67  -4.180  -1.781  -8.749
  555   1HB   CYS  67          1HB       CYS  67  -3.248  -0.539  -6.732
  556   2HB   CYS  67          2HB       CYS  67  -1.646  -1.048  -7.260
  557    QB   CYS  67           QB       CYS  67  -2.447  -0.794  -6.996
  558    HA   PRO  68           HA       PRO  68  -1.400  -4.153 -11.406
  559   1HB   PRO  68          1HB       PRO  68  -1.196  -2.484 -13.591
  560   2HB   PRO  68          2HB       PRO  68  -2.512  -3.634 -13.273
  561   1HG   PRO  68          1HG       PRO  68  -2.456  -0.661 -12.873
  562   2HG   PRO  68          2HG       PRO  68  -3.822  -1.700 -13.357
  563   1HD   PRO  68          1HD       PRO  68  -3.475  -0.673 -10.831
  564   2HD   PRO  68          2HD       PRO  68  -4.355  -2.167 -11.165
  565    QB   PRO  68           QB       PRO  68  -1.854  -3.059 -13.432
  566    QG   PRO  68           QG       PRO  68  -3.139  -1.180 -13.115
  567    QD   PRO  68           QD       PRO  68  -3.915  -1.420 -10.998
  568    H    ALA  69           H        ALA  69   0.611  -3.731 -12.779
  569    HA   ALA  69           HA       ALA  69   2.579  -2.890 -10.858
  570   1HB   ALA  69          1HB       ALA  69   2.767  -4.693 -12.718
  571   2HB   ALA  69          2HB       ALA  69   3.085  -3.350 -13.809
  572   3HB   ALA  69          3HB       ALA  69   4.197  -3.656 -12.457
  573    QB   ALA  69           QB       ALA  69   3.350  -3.899 -12.995
  574    H    ASN  70           H        ASN  70   3.998  -1.181 -10.928
  575    HA   ASN  70           HA       ASN  70   4.810   0.903 -11.317
  576   1HB   ASN  70          1HB       ASN  70   4.336   0.280 -14.237
  577   2HB   ASN  70          2HB       ASN  70   5.582   1.318 -13.561
  578   1HD2  ASN  70          2HD2      ASN  70   6.339  -2.612 -14.147
  579   2HD2  ASN  70          1HD2      ASN  70   4.946  -1.725 -14.795
  580    QB   ASN  70           QB       ASN  70   4.959   0.799 -13.899
  581    QD2  ASN  70           QD2      ASN  70   5.643  -2.169 -14.471
  582    H    THR  71           H        THR  71   2.113   0.897 -10.693
  583    HA   THR  71           HA       THR  71   0.896   3.002 -12.428
  584    HB   THR  71           HB       THR  71  -0.368   0.768 -10.791
  585    HG1  THR  71          1HG       THR  71   0.568   0.212 -12.863
  586   1HG2  THR  71          3HG2      THR  71  -1.683   2.906 -12.529
  587   2HG2  THR  71          1HG2      THR  71  -2.499   1.515 -11.797
  588   3HG2  THR  71          2HG2      THR  71  -1.804   2.764 -10.757
  589    QG2  THR  71           QG2      THR  71  -1.995   2.395 -11.694
  590    H    CYS  72           H        CYS  72   0.340   4.832 -11.378
  591    HA   CYS  72           HA       CYS  72   1.017   5.111  -8.487
  592   1HB   CYS  72          1HB       CYS  72   2.080   6.798  -9.720
  593   2HB   CYS  72          2HB       CYS  72   0.720   6.955 -10.844
  594    QB   CYS  72           QB       CYS  72   1.400   6.877 -10.282
  595    H    CYS  73           H        CYS  73  -0.682   4.832  -7.173
  596    HA   CYS  73           HA       CYS  73  -3.492   5.087  -8.116
  597   1HB   CYS  73          1HB       CYS  73  -2.971   3.160  -5.995
  598   2HB   CYS  73          2HB       CYS  73  -3.820   2.971  -7.524
  599    QB   CYS  73           QB       CYS  73  -3.396   3.066  -6.759
  600    H    ASN  74           H        ASN  74  -4.274   6.964  -7.193
  601    HA   ASN  74           HA       ASN  74  -3.465   7.879  -4.569
  602   1HB   ASN  74          1HB       ASN  74  -4.582   9.356  -6.230
  603   2HB   ASN  74          2HB       ASN  74  -6.064   8.389  -6.091
  604   1HD2  ASN  74          2HD2      ASN  74  -6.986   9.867  -2.973
  605   2HD2  ASN  74          1HD2      ASN  74  -7.389   8.655  -4.186
  606    QB   ASN  74           QB       ASN  74  -5.323   8.873  -6.161
  607    QD2  ASN  74           QD2      ASN  74  -7.188   9.261  -3.580
  608    H    ILE  75           H        ILE  75  -4.184   7.562  -2.666
  609    HA   ILE  75           HA       ILE  75  -5.954   5.242  -2.141
  610    HB   ILE  75           HB       ILE  75  -4.029   6.721  -0.375
  611   1HG1  ILE  75          1HG1      ILE  75  -2.616   6.021  -2.103
  612   2HG1  ILE  75          2HG1      ILE  75  -2.341   4.962  -0.734
  613   1HG2  ILE  75          1HG2      ILE  75  -5.746   5.213   0.693
  614   2HG2  ILE  75          2HG2      ILE  75  -5.095   3.851  -0.226
  615   3HG2  ILE  75          3HG2      ILE  75  -4.087   4.657   0.993
  616   1HD1  ILE  75          1HD1      ILE  75  -4.100   4.233  -3.119
  617   2HD1  ILE  75          2HD1      ILE  75  -2.377   3.995  -3.062
  618   3HD1  ILE  75          3HD1      ILE  75  -3.368   3.152  -1.880
  619    QG1  ILE  75           QG1      ILE  75  -2.479   5.492  -1.418
  620    QG2  ILE  75           QG2      ILE  75  -4.976   4.573   0.487
  621    QD1  ILE  75           QD1      ILE  75  -3.281   3.793  -2.687
  622    H    ASN  76           H        ASN  76  -8.048   5.961  -1.718
  623    HA   ASN  76           HA       ASN  76  -8.330   8.008   0.395
  624   1HB   ASN  76          1HB       ASN  76  -8.457   9.261  -1.795
  625   2HB   ASN  76          2HB       ASN  76  -9.916   8.355  -2.192
  626   1HD2  ASN  76          2HD2      ASN  76 -11.822  10.072   0.434
  627   2HD2  ASN  76          1HD2      ASN  76 -11.651   8.483  -0.310
  628    QB   ASN  76           QB       ASN  76  -9.186   8.808  -1.993
  629    QD2  ASN  76           QD2      ASN  76 -11.736   9.278   0.062
  630    H    THR  77           H        THR  77  -8.586   5.722   1.236
  631    HA   THR  77           HA       THR  77 -10.977   4.278   0.534
  632    HB   THR  77           HB       THR  77 -10.179   3.032   2.707
  633    HG1  THR  77          1HG       THR  77  -8.928   4.666   3.604
  634   1HG2  THR  77          2HG2      THR  77  -8.231   3.367   0.366
  635   2HG2  THR  77          3HG2      THR  77  -8.265   2.022   1.522
  636   3HG2  THR  77          1HG2      THR  77  -9.621   2.265   0.401
  637    QG2  THR  77           QG2      THR  77  -8.705   2.551   0.763
  638    H    GLY  78           H        GLY  78 -12.671   3.826   2.136
  639   1HA   GLY  78          1HA       GLY  78 -13.964   6.104   3.177
  640   2HA   GLY  78          2HA       GLY  78 -14.266   4.436   3.699
  641    QA   GLY  78           QA       GLY  78 -14.115   5.270   3.438
  642    H    PHE  79           H        PHE  79 -11.935   3.687   4.900
  643    HA   PHE  79           HA       PHE  79 -11.854   5.364   7.353
  644   1HB   PHE  79          1HB       PHE  79 -10.419   3.513   8.203
  645   2HB   PHE  79          2HB       PHE  79 -12.029   3.013   7.814
  646    HD1  PHE  79          2HD       PHE  79 -12.396   1.583   5.705
  647    HD2  PHE  79          1HD       PHE  79  -8.447   2.776   6.968
  648    HE1  PHE  79          2HE       PHE  79 -11.408  -0.049   4.151
  649    HE2  PHE  79          1HE       PHE  79  -7.456   1.124   5.429
  650   1HZ   PHE  79           HZ       PHE  79  -8.909  -0.266   3.988
  651    QB   PHE  79           QB       PHE  79 -11.224   3.263   8.008
  652    QG   PHE  79           QD       PHE  79 -10.422   2.179   6.337
  653    QZ   PHE  79           QE       PHE  79  -9.432   0.538   4.790
  654    QZ   PHE  79           QR       PHE  79  -9.723   1.033   5.248
  655    H    TYR  80           H        TYR  80  -9.935   5.866   8.324
  656    HA   TYR  80           HA       TYR  80  -8.187   7.155   6.426
  657   1HB   TYR  80          1HB       TYR  80  -8.778   8.371   8.431
  658   2HB   TYR  80          2HB       TYR  80  -8.204   7.057   9.465
  659    HD1  TYR  80          2HD       TYR  80  -6.874   9.229   6.676
  660    HD2  TYR  80          1HD       TYR  80  -6.081   7.291  10.437
  661    HE1  TYR  80          2HE       TYR  80  -4.590  10.184   6.691
  662    HE2  TYR  80          1HE       TYR  80  -3.767   8.141  10.384
  663    HH   TYR  80           HH       TYR  80  -2.549  10.193   7.715
  664    QB   TYR  80           QB       TYR  80  -8.491   7.714   8.948
  665    QG   TYR  80           QD       TYR  80  -6.478   8.260   8.557
  666    QZ   TYR  80           QE       TYR  80  -4.179   9.163   8.537
  667    QR   TYR  80           QR       TYR  80  -5.328   8.711   8.547
  668    H    ILE  81           H        ILE  81  -6.023   6.431   5.994
  669    HA   ILE  81           HA       ILE  81  -5.711   3.589   6.517
  670    HB   ILE  81           HB       ILE  81  -3.770   4.017   4.804
  671   1HG1  ILE  81          1HG1      ILE  81  -4.358   6.584   4.852
  672   2HG1  ILE  81          2HG1      ILE  81  -4.057   5.791   3.326
  673   1HG2  ILE  81          3HG2      ILE  81  -6.742   3.767   4.286
  674   2HG2  ILE  81          1HG2      ILE  81  -5.500   3.476   3.035
  675   3HG2  ILE  81          2HG2      ILE  81  -5.582   2.477   4.496
  676   1HD1  ILE  81          3HD1      ILE  81  -6.921   6.157   4.329
  677   2HD1  ILE  81          1HD1      ILE  81  -6.047   7.293   3.290
  678   3HD1  ILE  81          2HD1      ILE  81  -6.353   5.633   2.760
  679    QG1  ILE  81           QG1      ILE  81  -4.208   6.187   4.089
  680    QG2  ILE  81           QG2      ILE  81  -5.941   3.240   3.939
  681    QD1  ILE  81           QD1      ILE  81  -6.440   6.361   3.460
  682    H    ARG  82           H        ARG  82  -4.049   2.756   7.802
  683    HA   ARG  82           HA       ARG  82  -1.952   4.658   8.844
  684   1HB   ARG  82          1HB       ARG  82  -4.009   3.027  10.308
  685   2HB   ARG  82          2HB       ARG  82  -2.451   3.364  11.073
  686   1HG   ARG  82          1HG       ARG  82  -2.668   5.651  11.013
  687   2HG   ARG  82          2HG       ARG  82  -4.011   5.619   9.840
  688   1HD   ARG  82          1HD       ARG  82  -5.599   5.067  11.364
  689   2HD   ARG  82          2HD       ARG  82  -4.454   4.231  12.456
  690    HE   ARG  82           HE       ARG  82  -3.608   6.736  12.784
  691   1HH1  ARG  82          2HH2      ARG  82  -6.696   5.045  13.155
  692   2HH1  ARG  82          1HH2      ARG  82  -7.265   6.076  14.417
  693   1HH2  ARG  82          2HH1      ARG  82  -4.424   8.245  14.280
  694   2HH2  ARG  82          1HH1      ARG  82  -5.913   7.925  15.124
  695    QB   ARG  82           QB       ARG  82  -3.230   3.195  10.691
  696    QG   ARG  82           QG       ARG  82  -3.339   5.635  10.427
  697    QD   ARG  82           QD       ARG  82  -5.026   4.649  11.910
  698    QH1  ARG  82           QH2      ARG  82  -6.981   5.560  13.786
  699    QH2  ARG  82           QH1      ARG  82  -5.169   8.085  14.702
  700    H    SER  83           H        SER  83  -2.787   1.313   8.058
  701    HA   SER  83           HA       SER  83   0.117   0.821   7.961
  702   1HB   SER  83          1HB       SER  83  -0.042  -1.200   9.449
  703   2HB   SER  83          2HB       SER  83  -0.241   0.356  10.277
  704    HG   SER  83           HG       SER  83  -2.436   0.071  10.357
  705    QB   SER  83           QB       SER  83  -0.142  -0.422   9.863
  706    H    TYR  84           H        TYR  84   0.566  -1.565   7.150
  707    HA   TYR  84           HA       TYR  84  -1.678  -2.795   5.766
  708   1HB   TYR  84          1HB       TYR  84  -0.622  -2.616   3.491
  709   2HB   TYR  84          2HB       TYR  84  -1.180  -1.091   4.136
  710    HD1  TYR  84          2HD       TYR  84   2.102  -3.059   4.230
  711    HD2  TYR  84          1HD       TYR  84   0.128   0.724   3.578
  712    HE1  TYR  84          2HE       TYR  84   4.193  -1.858   4.727
  713    HE2  TYR  84          1HE       TYR  84   2.341   1.822   3.526
  714    HH   TYR  84           HH       TYR  84   4.507   1.664   4.150
  715    QB   TYR  84           QB       TYR  84  -0.901  -1.853   3.813
  716    QG   TYR  84           QD       TYR  84   1.115  -1.168   3.904
  717    QZ   TYR  84           QE       TYR  84   3.267  -0.018   4.126
  718    QR   TYR  84           QR       TYR  84   2.191  -0.593   4.015
  719    H    ARG  85           H        ARG  85  -1.032  -4.782   4.611
  720    HA   ARG  85           HA       ARG  85   1.779  -5.607   4.811
  721   1HB   ARG  85          1HB       ARG  85  -0.588  -6.918   6.070
  722   2HB   ARG  85          2HB       ARG  85   0.320  -7.966   5.016
  723   1HG   ARG  85          1HG       ARG  85   2.280  -7.746   6.330
  724   2HG   ARG  85          2HG       ARG  85   1.687  -6.183   6.955
  725   1HD   ARG  85          1HD       ARG  85   0.111  -7.114   8.354
  726   2HD   ARG  85          2HD       ARG  85   0.219  -8.733   7.611
  727    HE   ARG  85           HE       ARG  85   2.672  -7.726   8.824
  728   1HH1  ARG  85          2HH2      ARG  85  -0.442  -8.856   9.882
  729   2HH1  ARG  85          1HH2      ARG  85   0.140  -9.883  11.168
  730   1HH2  ARG  85          2HH1      ARG  85   3.575  -9.239  10.458
  731   2HH2  ARG  85          1HH1      ARG  85   2.449  -9.750  11.707
  732    QB   ARG  85           QB       ARG  85  -0.134  -7.442   5.543
  733    QG   ARG  85           QG       ARG  85   1.984  -6.964   6.643
  734    QD   ARG  85           QD       ARG  85   0.165  -7.923   7.982
  735    QH1  ARG  85           QH2      ARG  85  -0.151  -9.369  10.525
  736    QH2  ARG  85           QH1      ARG  85   3.012  -9.494  11.082
  737    H    ARG  86           H        ARG  86   2.409  -6.820   3.040
  738    HA   ARG  86           HA       ARG  86   0.997  -6.448   0.564
  739   1HB   ARG  86          1HB       ARG  86   3.277  -8.292   1.466
  740   2HB   ARG  86          2HB       ARG  86   2.782  -8.199  -0.217
  741   1HG   ARG  86          1HG       ARG  86   3.627  -5.689   1.284
  742   2HG   ARG  86          2HG       ARG  86   4.835  -6.785   0.597
  743   1HD   ARG  86          1HD       ARG  86   2.506  -5.651  -0.985
  744   2HD   ARG  86          2HD       ARG  86   4.072  -4.852  -0.916
  745    HE   ARG  86           HE       ARG  86   3.346  -7.257  -2.474
  746   1HH1  ARG  86          2HH2      ARG  86   6.156  -5.421  -1.132
  747   2HH1  ARG  86          1HH2      ARG  86   7.265  -6.430  -2.045
  748   1HH2  ARG  86          2HH1      ARG  86   4.847  -8.220  -3.757
  749   2HH2  ARG  86          1HH1      ARG  86   6.566  -7.828  -3.651
  750    QB   ARG  86           QB       ARG  86   3.029  -8.245   0.624
  751    QG   ARG  86           QG       ARG  86   4.231  -6.237   0.940
  752    QD   ARG  86           QD       ARG  86   3.289  -5.251  -0.950
  753    QH1  ARG  86           QH2      ARG  86   6.710  -5.925  -1.588
  754    QH2  ARG  86           QH1      ARG  86   5.706  -8.024  -3.704
  755    H    VAL  87           H        VAL  87   0.239  -8.229  -0.900
  756    HA   VAL  87           HA       VAL  87  -0.033 -10.846   0.476
  757    HB   VAL  87           HB       VAL  87  -2.173 -11.334  -0.584
  758   1HG1  VAL  87          1HG1      VAL  87  -2.045 -10.704   1.788
  759   2HG1  VAL  87          2HG1      VAL  87  -2.296  -8.994   1.358
  760   3HG1  VAL  87          3HG1      VAL  87  -3.569 -10.193   1.054
  761   1HG2  VAL  87          1HG2      VAL  87  -2.297  -8.344  -1.142
  762   2HG2  VAL  87          2HG2      VAL  87  -2.277  -9.669  -2.338
  763   3HG2  VAL  87          3HG2      VAL  87  -3.664  -9.456  -1.260
  764    QG1  VAL  87           QG1      VAL  87  -2.637  -9.964   1.400
  765    QG2  VAL  87           QG2      VAL  87  -2.746  -9.156  -1.580
  766    QQG  VAL  87           QQG      VAL  87  -2.691  -9.560  -0.090
  767    H    GLU  88           H        GLU  88   0.250  -8.987  -2.590
  768    HA   GLU  88           HA       GLU  88   2.254 -10.940  -3.297
  769   1HB   GLU  88          1HB       GLU  88  -0.343 -11.021  -4.693
  770   2HB   GLU  88          2HB       GLU  88   0.941 -10.340  -5.730
  771   1HG   GLU  88          1HG       GLU  88   2.413 -12.212  -5.143
  772   2HG   GLU  88          2HG       GLU  88   1.005 -13.022  -4.403
  773    QB   GLU  88           QB       GLU  88   0.299 -10.680  -5.212
  774    QG   GLU  88           QG       GLU  88   1.709 -12.617  -4.773
   
  No H/Q in entry =         774
  Start of MODEL   16
    1   1HA   GLY   1          1HA       GLY   1  14.853  -4.786  -9.393
    2   2HA   GLY   1          2HA       GLY   1  15.963  -4.096 -10.595
    3    QA   GLY   1           QA       GLY   1  15.408  -4.441  -9.994
    4    H    ASP   2           H        ASP   2  15.413  -2.110  -9.466
    5    HA   ASP   2           HA       ASP   2  14.822  -0.071  -9.538
    6   1HB   ASP   2          1HB       ASP   2  14.877   0.938 -11.511
    7   2HB   ASP   2          2HB       ASP   2  15.650  -0.603 -11.877
    8    QB   ASP   2           QB       ASP   2  15.263   0.167 -11.694
    9    H    GLY   3           H        GLY   3  12.019  -1.668 -11.065
   10   1HA   GLY   3          1HA       GLY   3  10.175   0.290  -9.941
   11   2HA   GLY   3          2HA       GLY   3   9.729  -1.302 -10.575
   12    QA   GLY   3           QA       GLY   3   9.952  -0.506 -10.258
   13    H    TYR   4           H        TYR   4   8.365  -1.050  -8.336
   14    HA   TYR   4           HA       TYR   4   9.591  -2.499  -6.189
   15   1HB   TYR   4          1HB       TYR   4   9.428  -0.390  -4.632
   16   2HB   TYR   4          2HB       TYR   4  10.845  -0.607  -5.615
   17    HD1  TYR   4          2HD       TYR   4   7.492   1.155  -5.729
   18    HD2  TYR   4          1HD       TYR   4  11.555   1.062  -7.098
   19    HE1  TYR   4          2HE       TYR   4   7.254   3.466  -6.595
   20    HE2  TYR   4          1HE       TYR   4  11.220   3.236  -8.228
   21    HH   TYR   4           HH       TYR   4   9.465   4.582  -9.032
   22    QB   TYR   4           QB       TYR   4  10.137  -0.498  -5.124
   23    QG   TYR   4           QD       TYR   4   9.523   1.109  -6.414
   24    QZ   TYR   4           QE       TYR   4   9.237   3.351  -7.411
   25    QR   TYR   4           QR       TYR   4   9.380   2.230  -6.912
   26    H    LEU   5           H        LEU   5   8.057  -2.008  -4.155
   27    HA   LEU   5           HA       LEU   5   5.538  -0.820  -4.964
   28   1HB   LEU   5          1HB       LEU   5   5.536  -3.591  -4.854
   29   2HB   LEU   5          2HB       LEU   5   5.076  -3.179  -3.213
   30    HG   LEU   5           HG       LEU   5   3.499  -1.424  -4.708
   31   1HD1  LEU   5          2HD1      LEU   5   3.721  -4.129  -6.125
   32   2HD1  LEU   5          3HD1      LEU   5   2.440  -2.936  -6.424
   33   3HD1  LEU   5          1HD1      LEU   5   4.138  -2.553  -6.796
   34   1HD2  LEU   5          1HD2      LEU   5   2.808  -2.675  -2.720
   35   2HD2  LEU   5          2HD2      LEU   5   1.636  -2.802  -4.045
   36   3HD2  LEU   5          3HD2      LEU   5   2.723  -4.154  -3.682
   37    QB   LEU   5           QB       LEU   5   5.306  -3.385  -4.034
   38    QD1  LEU   5           QD1      LEU   5   3.433  -3.206  -6.448
   39    QD2  LEU   5           QD2      LEU   5   2.389  -3.210  -3.483
   40    QQD  LEU   5           QQD      LEU   5   2.911  -3.208  -4.965
   41    H    ILE   6           H        ILE   6   6.153   0.896  -3.881
   42    HA   ILE   6           HA       ILE   6   6.405   0.755  -0.918
   43    HB   ILE   6           HB       ILE   6   7.522   2.925  -1.005
   44   1HG1  ILE   6          1HG1      ILE   6   7.174   2.656  -3.994
   45   2HG1  ILE   6          2HG1      ILE   6   6.790   3.986  -2.932
   46   1HG2  ILE   6          2HG2      ILE   6   8.874   0.833  -0.939
   47   2HG2  ILE   6          3HG2      ILE   6   9.116   0.971  -2.691
   48   3HG2  ILE   6          1HG2      ILE   6   9.720   2.230  -1.592
   49   1HD1  ILE   6          1HD1      ILE   6   9.301   4.306  -2.606
   50   2HD1  ILE   6          2HD1      ILE   6   9.543   3.094  -3.881
   51   3HD1  ILE   6          3HD1      ILE   6   8.703   4.609  -4.249
   52    QG1  ILE   6           QG1      ILE   6   6.982   3.321  -3.463
   53    QG2  ILE   6           QG2      ILE   6   9.237   1.345  -1.741
   54    QD1  ILE   6           QD1      ILE   6   9.182   4.003  -3.579
   55    H    MET   7           H        MET   7   5.216   2.649   0.067
   56    HA   MET   7           HA       MET   7   3.351   3.861  -1.851
   57   1HB   MET   7          1HB       MET   7   1.776   4.212  -0.047
   58   2HB   MET   7          2HB       MET   7   2.026   2.533  -0.546
   59   1HG   MET   7          1HG       MET   7   3.422   2.174   1.478
   60   2HG   MET   7          2HG       MET   7   2.891   3.744   2.054
   61   1HE   MET   7          3HE       MET   7   0.011   4.232   1.985
   62   2HE   MET   7          1HE       MET   7  -0.231   3.282   0.493
   63   3HE   MET   7          2HE       MET   7  -1.131   2.868   1.958
   64    QB   MET   7           QB       MET   7   1.901   3.372  -0.297
   65    QG   MET   7           QG       MET   7   3.156   2.959   1.766
   66    QE   MET   7           QE       MET   7  -0.450   3.461   1.479
   67    H    CYS   8           H        CYS   8   2.645   5.948  -1.072
   68    HA   CYS   8           HA       CYS   8   4.976   7.595  -0.395
   69   1HB   CYS   8          1HB       CYS   8   3.443   7.507  -3.031
   70   2HB   CYS   8          2HB       CYS   8   4.707   8.665  -2.672
   71    QB   CYS   8           QB       CYS   8   4.075   8.086  -2.851
   72    H    LYS   9           H        LYS   9   4.456   9.819  -0.465
   73    HA   LYS   9           HA       LYS   9   1.659  10.444   0.360
   74   1HB   LYS   9          1HB       LYS   9   2.609  12.636   0.777
   75   2HB   LYS   9          2HB       LYS   9   3.437  11.327   1.643
   76   1HG   LYS   9          1HG       LYS   9   5.403  11.642   0.653
   77   2HG   LYS   9          2HG       LYS   9   4.738  11.902  -0.975
   78   1HD   LYS   9          1HD       LYS   9   4.522  13.862   1.285
   79   2HD   LYS   9          2HD       LYS   9   5.889  13.826   0.147
   80   1HE   LYS   9          1HE       LYS   9   4.511  14.377  -1.757
   81   2HE   LYS   9          2HE       LYS   9   3.016  14.026  -0.878
   82   1HZ   LYS   9          1HZ       LYS   9   3.622  15.975   0.552
   83   2HZ   LYS   9          2HZ       LYS   9   4.709  16.392  -0.595
   84   3HZ   LYS   9          3HZ       LYS   9   3.112  16.281  -0.990
   85    QB   LYS   9           QB       LYS   9   3.023  11.982   1.210
   86    QG   LYS   9           QG       LYS   9   5.070  11.772  -0.161
   87    QD   LYS   9           QD       LYS   9   5.205  13.844   0.716
   88    QE   LYS   9           QE       LYS   9   3.764  14.201  -1.318
   89    QZ   LYS   9           QZ       LYS   9   3.814  16.216  -0.345
   90    H    ASN  10           H        ASN  10   3.488  10.718  -2.485
   91    HA   ASN  10           HA       ASN  10   1.094  11.990  -3.752
   92   1HB   ASN  10          1HB       ASN  10   2.396  13.479  -5.001
   93   2HB   ASN  10          2HB       ASN  10   2.953  13.665  -3.364
   94   1HD2  ASN  10          2HD2      ASN  10   5.902  13.342  -5.741
   95   2HD2  ASN  10          1HD2      ASN  10   4.515  14.437  -5.629
   96    QB   ASN  10           QB       ASN  10   2.674  13.572  -4.183
   97    QD2  ASN  10           QD2      ASN  10   5.208  13.890  -5.685
   98    H    CYS  11           H        CYS  11   1.694  12.016  -6.273
   99    HA   CYS  11           HA       CYS  11   1.703   9.144  -6.979
  100   1HB   CYS  11          1HB       CYS  11  -0.094  10.795  -7.626
  101   2HB   CYS  11          2HB       CYS  11   1.103  11.652  -8.599
  102    QB   CYS  11           QB       CYS  11   0.504  11.223  -8.113
  103    H    ASP  12           H        ASP  12   4.080  11.354  -6.626
  104    HA   ASP  12           HA       ASP  12   5.755  10.379  -8.886
  105   1HB   ASP  12          1HB       ASP  12   4.864  12.702  -9.265
  106   2HB   ASP  12          2HB       ASP  12   5.716  13.210  -7.806
  107    QB   ASP  12           QB       ASP  12   5.290  12.956  -8.535
  108    HA   PRO  13           HA       PRO  13   7.791   9.343  -4.863
  109   1HB   PRO  13          1HB       PRO  13   9.333   7.752  -6.929
  110   2HB   PRO  13          2HB       PRO  13   8.874   7.244  -5.287
  111   1HG   PRO  13          1HG       PRO  13   7.457   6.404  -7.451
  112   2HG   PRO  13          2HG       PRO  13   6.594   6.891  -5.969
  113   1HD   PRO  13          1HD       PRO  13   7.036   8.420  -8.510
  114   2HD   PRO  13          2HD       PRO  13   5.568   8.360  -7.491
  115    QB   PRO  13           QB       PRO  13   9.103   7.498  -6.108
  116    QG   PRO  13           QG       PRO  13   7.026   6.648  -6.710
  117    QD   PRO  13           QD       PRO  13   6.302   8.390  -8.001
  118    H    ASN  14           H        ASN  14   9.038  10.592  -7.947
  119    HA   ASN  14           HA       ASN  14  11.657  11.176  -6.970
  120   1HB   ASN  14          1HB       ASN  14  11.275  11.116  -9.344
  121   2HB   ASN  14          2HB       ASN  14  10.091  12.422  -9.231
  122   1HD2  ASN  14          2HD2      ASN  14  12.823  14.525 -10.133
  123   2HD2  ASN  14          1HD2      ASN  14  11.263  13.831 -10.606
  124    QB   ASN  14           QB       ASN  14  10.683  11.769  -9.287
  125    QD2  ASN  14           QD2      ASN  14  12.043  14.178 -10.369
  126    H    THR  15           H        THR  15   8.651  13.113  -7.090
  127    HA   THR  15           HA       THR  15   9.967  15.101  -5.288
  128    HB   THR  15           HB       THR  15   8.188  16.629  -5.926
  129    HG1  THR  15          1HG       THR  15   7.421  14.576  -7.746
  130   1HG2  THR  15          3HG2      THR  15   9.618  15.333  -8.276
  131   2HG2  THR  15          1HG2      THR  15   8.843  16.930  -8.297
  132   3HG2  THR  15          2HG2      THR  15  10.249  16.623  -7.257
  133    QG2  THR  15           QG2      THR  15   9.570  16.295  -7.943
  134    H    GLY  16           H        GLY  16   8.382  12.410  -4.690
  135   1HA   GLY  16          1HA       GLY  16   7.420  13.560  -2.114
  136   2HA   GLY  16          2HA       GLY  16   6.517  12.322  -2.937
  137    QA   GLY  16           QA       GLY  16   6.968  12.941  -2.525
  138    H    SER  17           H        SER  17   8.235  12.647  -0.309
  139    HA   SER  17           HA       SER  17   9.937  10.347  -0.322
  140   1HB   SER  17          1HB       SER  17   8.466  11.928   1.809
  141   2HB   SER  17          2HB       SER  17   9.148  10.357   2.229
  142    HG   SER  17           HG       SER  17  11.139  10.977   1.611
  143    QB   SER  17           QB       SER  17   8.807  11.142   2.019
  144    H    CYS  18           H        CYS  18   9.575   8.206  -0.073
  145    HA   CYS  18           HA       CYS  18   6.823   7.215   0.171
  146   1HB   CYS  18          1HB       CYS  18   9.164   6.425  -1.604
  147   2HB   CYS  18          2HB       CYS  18   7.708   5.474  -1.454
  148    QB   CYS  18           QB       CYS  18   8.436   5.949  -1.529
  149    H    ASP  19           H        ASP  19   6.819   4.897   1.076
  150    HA   ASP  19           HA       ASP  19   9.085   4.718   2.978
  151   1HB   ASP  19          1HB       ASP  19   7.909   3.054   4.067
  152   2HB   ASP  19          2HB       ASP  19   7.002   4.561   3.903
  153    QB   ASP  19           QB       ASP  19   7.455   3.808   3.985
  154    H    TRP  20           H        TRP  20  10.680   4.284   1.737
  155    HA   TRP  20           HA       TRP  20  11.037   1.772   0.215
  156   1HB   TRP  20          1HB       TRP  20  13.039   3.893   1.108
  157   2HB   TRP  20          2HB       TRP  20  13.354   2.557   0.010
  158    HD1  TRP  20           HD       TRP  20  11.807   6.013   0.123
  159    HE1  TRP  20          1HE       TRP  20  11.424   6.868  -2.263
  160    HE3  TRP  20          3HE       TRP  20  12.769   1.696  -2.408
  161    HZ2  TRP  20          2HZ       TRP  20  11.650   5.818  -4.953
  162    HZ3  TRP  20          3HZ       TRP  20  12.813   1.674  -4.884
  163    HH2  TRP  20           HH       TRP  20  12.402   3.777  -6.160
  164    QB   TRP  20           QB       TRP  20  13.196   3.225   0.559
  165    H    LYS  21           H        LYS  21  10.018   1.169   2.514
  166    HA   LYS  21           HA       LYS  21  12.200   0.154   4.315
  167   1HB   LYS  21          1HB       LYS  21  10.189   2.055   4.949
  168   2HB   LYS  21          2HB       LYS  21   9.549   0.532   5.534
  169   1HG   LYS  21          1HG       LYS  21  10.780   1.663   7.267
  170   2HG   LYS  21          2HG       LYS  21  11.688   0.205   6.848
  171   1HD   LYS  21          1HD       LYS  21  13.362   1.398   5.643
  172   2HD   LYS  21          2HD       LYS  21  12.400   2.876   5.581
  173   1HE   LYS  21          1HE       LYS  21  13.443   1.587   8.159
  174   2HE   LYS  21          2HE       LYS  21  14.300   2.838   7.266
  175   1HZ   LYS  21          2HZ       LYS  21  11.970   4.037   7.538
  176   2HZ   LYS  21          3HZ       LYS  21  11.928   3.078   8.900
  177   3HZ   LYS  21          1HZ       LYS  21  13.156   4.111   8.679
  178    QB   LYS  21           QB       LYS  21   9.869   1.293   5.242
  179    QG   LYS  21           QG       LYS  21  11.234   0.934   7.057
  180    QD   LYS  21           QD       LYS  21  12.881   2.137   5.612
  181    QE   LYS  21           QE       LYS  21  13.871   2.213   7.712
  182    QZ   LYS  21           QZ       LYS  21  12.351   3.742   8.372
  183    H    GLN  22           H        GLN  22  10.801  -1.573   5.805
  184    HA   GLN  22           HA       GLN  22  10.140  -3.621   3.796
  185   1HB   GLN  22          1HB       GLN  22  11.200  -4.272   5.972
  186   2HB   GLN  22          2HB       GLN  22   9.735  -3.721   6.812
  187   1HG   GLN  22          1HG       GLN  22   9.790  -6.173   6.546
  188   2HG   GLN  22          2HG       GLN  22   8.395  -5.401   5.781
  189   1HE2  GLN  22          2HE2      GLN  22  11.259  -7.145   3.413
  190   2HE2  GLN  22          1HE2      GLN  22  11.488  -7.049   5.164
  191    QB   GLN  22           QB       GLN  22  10.468  -3.997   6.392
  192    QG   GLN  22           QG       GLN  22   9.093  -5.787   6.164
  193    QE2  GLN  22           QE2      GLN  22  11.373  -7.097   4.289
  194    H    ASN  23           H        ASN  23   8.120  -4.263   3.439
  195    HA   ASN  23           HA       ASN  23   5.789  -2.575   4.292
  196   1HB   ASN  23          1HB       ASN  23   6.767  -3.027   1.442
  197   2HB   ASN  23          2HB       ASN  23   5.281  -2.196   1.902
  198   1HD2  ASN  23          2HD2      ASN  23   7.769   0.407   1.083
  199   2HD2  ASN  23          1HD2      ASN  23   7.147  -0.979   0.199
  200    QB   ASN  23           QB       ASN  23   6.024  -2.611   1.672
  201    QD2  ASN  23           QD2      ASN  23   7.458  -0.286   0.641
  202    H    TRP  24           H        TRP  24   6.889  -5.763   4.169
  203    HA   TRP  24           HA       TRP  24   5.148  -6.789   2.187
  204   1HB   TRP  24          1HB       TRP  24   7.263  -7.605   2.231
  205   2HB   TRP  24          2HB       TRP  24   7.344  -7.675   3.986
  206    HD1  TRP  24           HD       TRP  24   6.769  -9.540   5.141
  207    HE1  TRP  24          1HE       TRP  24   5.749 -11.966   4.704
  208    HE3  TRP  24          3HE       TRP  24   5.429  -8.866   0.370
  209    HZ2  TRP  24          2HZ       TRP  24   4.338 -13.237   2.458
  210    HZ3  TRP  24          3HZ       TRP  24   4.029 -10.482  -0.838
  211    HH2  TRP  24           HH       TRP  24   3.504 -12.675   0.142
  212    QB   TRP  24           QB       TRP  24   7.303  -7.640   3.109
  213    H    ASN  25           H        ASN  25   4.300  -9.130   3.590
  214    HA   ASN  25           HA       ASN  25   1.902  -8.367   4.872
  215   1HB   ASN  25          1HB       ASN  25   2.268 -10.397   3.375
  216   2HB   ASN  25          2HB       ASN  25   3.220 -11.107   4.671
  217   1HD2  ASN  25          2HD2      ASN  25  -0.866 -10.871   4.891
  218   2HD2  ASN  25          1HD2      ASN  25   0.040  -9.784   3.847
  219    QB   ASN  25           QB       ASN  25   2.744 -10.752   4.023
  220    QD2  ASN  25           QD2      ASN  25  -0.413 -10.328   4.369
  221    H    THR  26           H        THR  26   3.290  -7.087   6.368
  222    HA   THR  26           HA       THR  26   3.714  -8.438   8.959
  223    HB   THR  26           HB       THR  26   5.893  -8.560   8.166
  224    HG1  THR  26          1HG       THR  26   5.731  -6.103   9.588
  225   1HG2  THR  26          2HG2      THR  26   5.576  -5.848   6.886
  226   2HG2  THR  26          3HG2      THR  26   7.159  -6.606   7.208
  227   3HG2  THR  26          1HG2      THR  26   5.997  -7.413   6.161
  228    QG2  THR  26           QG2      THR  26   6.244  -6.622   6.752
  229    H    CYS  27           H        CYS  27   3.476  -6.930  10.688
  230    HA   CYS  27           HA       CYS  27   1.195  -5.305  10.185
  231   1HB   CYS  27          1HB       CYS  27   1.666  -6.756  12.183
  232   2HB   CYS  27          2HB       CYS  27   2.816  -5.532  12.726
  233    QB   CYS  27           QB       CYS  27   2.241  -6.144  12.454
  234    H    VAL  28           H        VAL  28   2.272  -3.749   8.626
  235    HA   VAL  28           HA       VAL  28   4.272  -1.949   9.787
  236    HB   VAL  28           HB       VAL  28   3.261  -2.560   6.996
  237   1HG1  VAL  28          1HG1      VAL  28   3.835  -0.115   7.107
  238   2HG1  VAL  28          2HG1      VAL  28   5.428  -0.584   7.743
  239   3HG1  VAL  28          3HG1      VAL  28   4.945  -1.066   6.106
  240   1HG2  VAL  28          1HG2      VAL  28   4.891  -4.129   8.198
  241   2HG2  VAL  28          2HG2      VAL  28   5.514  -3.429   6.690
  242   3HG2  VAL  28          3HG2      VAL  28   6.039  -2.793   8.261
  243    QG1  VAL  28           QG1      VAL  28   4.736  -0.588   6.985
  244    QG2  VAL  28           QG2      VAL  28   5.481  -3.450   7.716
  245    QQG  VAL  28           QQG      VAL  28   5.108  -2.019   7.351
  246    H    GLY  29           H        GLY  29   3.828   0.044  10.482
  247   1HA   GLY  29          1HA       GLY  29   1.186   1.183  10.242
  248   2HA   GLY  29          2HA       GLY  29   2.527   1.870  11.131
  249    QA   GLY  29           QA       GLY  29   1.856   1.526  10.687
  250    H    ILE  30           H        ILE  30   0.678   2.830   8.882
  251    HA   ILE  30           HA       ILE  30   2.621   3.862   6.870
  252    HB   ILE  30           HB       ILE  30  -0.398   4.222   7.218
  253   1HG1  ILE  30          1HG1      ILE  30   1.126   2.787   5.002
  254   2HG1  ILE  30          2HG1      ILE  30   0.407   1.965   6.385
  255   1HG2  ILE  30          3HG2      ILE  30   1.456   5.291   5.066
  256   2HG2  ILE  30          1HG2      ILE  30  -0.315   5.365   4.987
  257   3HG2  ILE  30          2HG2      ILE  30   0.518   6.261   6.228
  258   1HD1  ILE  30          1HD1      ILE  30  -1.844   2.853   5.754
  259   2HD1  ILE  30          2HD1      ILE  30  -1.134   3.510   4.268
  260   3HD1  ILE  30          3HD1      ILE  30  -1.119   1.771   4.552
  261    QG1  ILE  30           QG1      ILE  30   0.766   2.376   5.694
  262    QG2  ILE  30           QG2      ILE  30   0.553   5.639   5.427
  263    QD1  ILE  30           QD1      ILE  30  -1.366   2.711   4.858
  264    H    GLY  31           H        GLY  31   2.948   6.240   6.862
  265   1HA   GLY  31          1HA       GLY  31   1.630   7.824   8.868
  266   2HA   GLY  31          2HA       GLY  31   3.345   7.557   9.250
  267    QA   GLY  31           QA       GLY  31   2.487   7.690   9.059
  268    H    ALA  32           H        ALA  32   2.253   9.981   8.716
  269    HA   ALA  32           HA       ALA  32   2.486  11.866   7.667
  270   1HB   ALA  32          3HB       ALA  32   4.881  11.304   8.261
  271   2HB   ALA  32          1HB       ALA  32   5.093  10.608   6.640
  272   3HB   ALA  32          2HB       ALA  32   4.794  12.343   6.823
  273    QB   ALA  32           QB       ALA  32   4.923  11.418   7.241
  274    H    ASN  33           H        ASN  33   0.652  11.560   6.595
  275    HA   ASN  33           HA       ASN  33  -0.621  11.788   4.763
  276   1HB   ASN  33          1HB       ASN  33   0.069  13.621   3.199
  277   2HB   ASN  33          2HB       ASN  33   0.044  14.000   4.910
  278   1HD2  ASN  33          2HD2      ASN  33   3.433  14.718   2.921
  279   2HD2  ASN  33          1HD2      ASN  33   1.989  14.141   2.091
  280    QB   ASN  33           QB       ASN  33   0.057  13.810   4.055
  281    QD2  ASN  33           QD2      ASN  33   2.711  14.429   2.506
  282    H    VAL  34           H        VAL  34   1.541   9.704   4.681
  283    HA   VAL  34           HA       VAL  34   1.928   9.101   1.834
  284    HB   VAL  34           HB       VAL  34   2.126   7.507   4.399
  285   1HG1  VAL  34          2HG1      VAL  34   2.598   6.500   1.570
  286   2HG1  VAL  34          3HG1      VAL  34   3.181   5.710   3.050
  287   3HG1  VAL  34          1HG1      VAL  34   1.443   5.853   2.748
  288   1HG2  VAL  34          3HG2      VAL  34   3.921   9.172   3.838
  289   2HG2  VAL  34          1HG2      VAL  34   4.518   7.509   3.823
  290   3HG2  VAL  34          2HG2      VAL  34   4.176   8.342   2.292
  291    QG1  VAL  34           QG1      VAL  34   2.407   6.021   2.456
  292    QG2  VAL  34           QG2      VAL  34   4.205   8.341   3.318
  293    QQG  VAL  34           QQG      VAL  34   3.306   7.181   2.887
  294    H    HIS  35           H        HIS  35   0.263   8.786   0.483
  295    HA   HIS  35           HA       HIS  35  -1.956   7.011   1.183
  296   1HB   HIS  35          1HB       HIS  35  -3.659   8.506   1.172
  297   2HB   HIS  35          2HB       HIS  35  -2.469   9.445   2.039
  298    HD1  HIS  35          1HD       HIS  35  -4.741   9.356  -0.854
  299    HD2  HIS  35          2HD       HIS  35  -1.470  11.626   0.486
  300    HE1  HIS  35          1HE       HIS  35  -4.902  11.649  -2.021
  301    QB   HIS  35           QB       HIS  35  -3.064   8.975   1.606
  302    H    TRP  36           H        TRP  36   0.303   7.188  -0.738
  303    HA   TRP  36           HA       TRP  36  -1.393   6.505  -3.163
  304   1HB   TRP  36          1HB       TRP  36   1.217   8.012  -3.050
  305   2HB   TRP  36          2HB       TRP  36   0.460   7.415  -4.518
  306    HD1  TRP  36           HD       TRP  36  -0.339   9.864  -1.640
  307    HE1  TRP  36          1HE       TRP  36  -2.016  11.557  -2.409
  308    HE3  TRP  36          3HE       TRP  36  -1.140   8.006  -6.288
  309    HZ2  TRP  36          2HZ       TRP  36  -3.488  12.172  -4.891
  310    HZ3  TRP  36          3HZ       TRP  36  -2.797   9.078  -7.804
  311    HH2  TRP  36           HH       TRP  36  -3.955  11.169  -7.133
  312    QB   TRP  36           QB       TRP  36   0.839   7.714  -3.784
  313    H    MET  37           H        MET  37  -0.961   4.408  -3.774
  314    HA   MET  37           HA       MET  37   1.582   3.138  -2.825
  315   1HB   MET  37          1HB       MET  37  -0.504   1.792  -2.657
  316   2HB   MET  37          2HB       MET  37  -0.737   1.953  -4.404
  317   1HG   MET  37          1HG       MET  37   0.236  -0.178  -4.070
  318   2HG   MET  37          2HG       MET  37   1.554   0.830  -4.661
  319   1HE   MET  37          2HE       MET  37  -0.026  -1.121  -1.738
  320   2HE   MET  37          3HE       MET  37   1.070  -0.807  -0.379
  321   3HE   MET  37          1HE       MET  37  -0.002   0.479  -0.946
  322    QB   MET  37           QB       MET  37  -0.620   1.873  -3.531
  323    QG   MET  37           QG       MET  37   0.895   0.326  -4.366
  324    QE   MET  37           QE       MET  37   0.347  -0.483  -1.021
  325    H    VAL  38           H        VAL  38   3.301   2.972  -4.357
  326    HA   VAL  38           HA       VAL  38   2.618   3.628  -7.172
  327    HB   VAL  38           HB       VAL  38   5.055   4.831  -5.835
  328   1HG1  VAL  38          3HG1      VAL  38   3.556   5.300  -8.466
  329   2HG1  VAL  38          1HG1      VAL  38   4.956   6.225  -7.932
  330   3HG1  VAL  38          2HG1      VAL  38   5.132   4.499  -8.291
  331   1HG2  VAL  38          1HG2      VAL  38   2.358   6.162  -6.413
  332   2HG2  VAL  38          2HG2      VAL  38   3.061   5.903  -4.805
  333   3HG2  VAL  38          3HG2      VAL  38   3.842   7.008  -5.938
  334    QG1  VAL  38           QG1      VAL  38   4.548   5.341  -8.230
  335    QG2  VAL  38           QG2      VAL  38   3.087   6.358  -5.719
  336    QQG  VAL  38           QQG      VAL  38   3.817   5.849  -6.974
  337    H    THR  39           H        THR  39   3.276   2.057  -8.444
  338    HA   THR  39           HA       THR  39   4.650  -0.143  -7.056
  339    HB   THR  39           HB       THR  39   3.337  -1.453  -8.687
  340    HG1  THR  39          1HG       THR  39   1.884  -0.251  -9.998
  341   1HG2  THR  39          3HG2      THR  39   2.323  -0.595  -6.504
  342   2HG2  THR  39          1HG2      THR  39   1.604   0.724  -7.432
  343   3HG2  THR  39          2HG2      THR  39   1.148  -0.954  -7.777
  344    QG2  THR  39           QG2      THR  39   1.692  -0.275  -7.238
  345    H    GLY  40           H        GLY  40   6.416   1.759  -7.955
  346   1HA   GLY  40          1HA       GLY  40   8.500   1.661  -9.083
  347   2HA   GLY  40          2HA       GLY  40   7.930   0.234  -9.948
  348    QA   GLY  40           QA       GLY  40   8.215   0.947  -9.516
  349    H    GLY  41           H        GLY  41   8.802   1.158 -11.815
  350   1HA   GLY  41          1HA       GLY  41   6.868   2.723 -13.326
  351   2HA   GLY  41          2HA       GLY  41   8.418   3.528 -13.051
  352    QA   GLY  41           QA       GLY  41   7.643   3.125 -13.189
  353    H    SER  42           H        SER  42   8.275   0.010 -13.327
  354    HA   SER  42           HA       SER  42   9.863   0.209 -15.847
  355   1HB   SER  42          1HB       SER  42  10.636  -0.865 -13.365
  356   2HB   SER  42          2HB       SER  42  10.283  -2.260 -14.381
  357    HG   SER  42           HG       SER  42  12.452  -0.980 -14.481
  358    QB   SER  42           QB       SER  42  10.459  -1.562 -13.873
  359    H    THR  43           H        THR  43   7.906  -2.077 -13.985
  360    HA   THR  43           HA       THR  43   5.675  -2.600 -14.696
  361    HB   THR  43           HB       THR  43   6.087  -2.014 -17.182
  362    HG1  THR  43          1HG       THR  43   4.193  -2.830 -16.366
  363   1HG2  THR  43          1HG2      THR  43   8.040  -3.691 -17.489
  364   2HG2  THR  43          2HG2      THR  43   6.845  -4.980 -17.306
  365   3HG2  THR  43          3HG2      THR  43   6.728  -3.850 -18.653
  366    QG2  THR  43           QG2      THR  43   7.204  -4.174 -17.816
  367    H    ASP  44           H        ASP  44   8.760  -4.196 -15.330
  368    HA   ASP  44           HA       ASP  44   7.781  -6.847 -14.943
  369   1HB   ASP  44          1HB       ASP  44  10.366  -7.258 -15.026
  370   2HB   ASP  44          2HB       ASP  44   9.580  -6.581 -16.433
  371    QB   ASP  44           QB       ASP  44   9.973  -6.920 -15.729
  372    H    GLY  45           H        GLY  45   7.234  -5.202 -12.661
  373   1HA   GLY  45          1HA       GLY  45   8.754  -6.549 -10.495
  374   2HA   GLY  45          2HA       GLY  45   7.687  -5.150 -10.320
  375    QA   GLY  45           QA       GLY  45   8.221  -5.850 -10.408
  376    H    LYS  46           H        LYS  46   5.831  -6.489 -12.362
  377    HA   LYS  46           HA       LYS  46   3.886  -7.483 -12.362
  378   1HB   LYS  46          1HB       LYS  46   4.699  -9.158  -9.977
  379   2HB   LYS  46          2HB       LYS  46   3.347  -9.381 -11.106
  380   1HG   LYS  46          1HG       LYS  46   5.285  -9.452 -12.921
  381   2HG   LYS  46          2HG       LYS  46   6.291  -9.906 -11.541
  382   1HD   LYS  46          1HD       LYS  46   3.700 -11.222 -12.505
  383   2HD   LYS  46          2HD       LYS  46   5.313 -11.913 -12.687
  384   1HE   LYS  46          1HE       LYS  46   3.946 -11.368  -9.967
  385   2HE   LYS  46          2HE       LYS  46   3.864 -12.888 -10.840
  386   1HZ   LYS  46          3HZ       LYS  46   6.225 -13.092 -10.693
  387   2HZ   LYS  46          1HZ       LYS  46   6.370 -11.694  -9.793
  388   3HZ   LYS  46          2HZ       LYS  46   5.529 -12.954  -9.215
  389    QB   LYS  46           QB       LYS  46   4.023  -9.270 -10.542
  390    QG   LYS  46           QG       LYS  46   5.788  -9.679 -12.231
  391    QD   LYS  46           QD       LYS  46   4.506 -11.568 -12.596
  392    QE   LYS  46           QE       LYS  46   3.905 -12.128 -10.404
  393    QZ   LYS  46           QZ       LYS  46   6.041 -12.580  -9.900
  394    H    GLN  47           H        GLN  47   1.866  -7.466 -11.339
  395    HA   GLN  47           HA       GLN  47   1.297  -5.235  -9.831
  396   1HB   GLN  47          1HB       GLN  47  -0.948  -6.206  -9.593
  397   2HB   GLN  47          2HB       GLN  47  -0.309  -6.492 -11.229
  398   1HG   GLN  47          1HG       GLN  47   0.202  -8.825 -10.669
  399   2HG   GLN  47          2HG       GLN  47  -0.406  -8.572  -9.022
  400   1HE2  GLN  47          2HE2      GLN  47  -3.075  -8.629 -12.190
  401   2HE2  GLN  47          1HE2      GLN  47  -1.345  -8.584 -12.477
  402    QB   GLN  47           QB       GLN  47  -0.628  -6.349 -10.411
  403    QG   GLN  47           QG       GLN  47  -0.102  -8.698  -9.846
  404    QE2  GLN  47           QE2      GLN  47  -2.210  -8.606 -12.333
  405    H    GLY  48           H        GLY  48   0.627  -4.854  -7.686
  406   1HA   GLY  48          1HA       GLY  48   1.534  -6.874  -5.670
  407   2HA   GLY  48          2HA       GLY  48   1.890  -5.162  -5.517
  408    QA   GLY  48           QA       GLY  48   1.712  -6.018  -5.593
  409    H    CYS  49           H        CYS  49   0.006  -7.251  -4.088
  410    HA   CYS  49           HA       CYS  49  -2.223  -5.304  -3.873
  411   1HB   CYS  49          1HB       CYS  49  -2.419  -8.285  -3.522
  412   2HB   CYS  49          2HB       CYS  49  -3.708  -7.122  -3.395
  413    QB   CYS  49           QB       CYS  49  -3.063  -7.704  -3.459
  414    H    ALA  50           H        ALA  50  -3.047  -5.067  -1.852
  415    HA   ALA  50           HA       ALA  50  -1.347  -5.960   0.398
  416   1HB   ALA  50          2HB       ALA  50  -1.709  -3.041  -0.450
  417   2HB   ALA  50          3HB       ALA  50  -0.947  -3.578   1.057
  418   3HB   ALA  50          1HB       ALA  50  -0.186  -3.956  -0.504
  419    QB   ALA  50           QB       ALA  50  -0.947  -3.525   0.034
  420    H    THR  51           H        THR  51  -2.392  -5.982   2.290
  421    HA   THR  51           HA       THR  51  -5.248  -5.146   2.335
  422    HB   THR  51           HB       THR  51  -3.772  -6.893   4.305
  423    HG1  THR  51          1HG       THR  51  -5.328  -8.401   3.071
  424   1HG2  THR  51          3HG2      THR  51  -5.754  -5.643   5.252
  425   2HG2  THR  51          1HG2      THR  51  -6.755  -6.273   3.937
  426   3HG2  THR  51          2HG2      THR  51  -6.044  -7.380   5.130
  427    QG2  THR  51           QG2      THR  51  -6.184  -6.432   4.773
  428    H    ILE  52           H        ILE  52  -5.678  -3.219   3.085
  429    HA   ILE  52           HA       ILE  52  -3.581  -1.674   4.521
  430    HB   ILE  52           HB       ILE  52  -5.869  -0.922   2.663
  431   1HG1  ILE  52          1HG1      ILE  52  -2.828  -0.928   2.332
  432   2HG1  ILE  52          2HG1      ILE  52  -3.998  -1.925   1.458
  433   1HG2  ILE  52          2HG2      ILE  52  -5.517   0.768   4.415
  434   2HG2  ILE  52          3HG2      ILE  52  -3.803   0.898   3.940
  435   3HG2  ILE  52          1HG2      ILE  52  -5.108   1.361   2.812
  436   1HD1  ILE  52          3HD1      ILE  52  -4.960   0.191   0.469
  437   2HD1  ILE  52          1HD1      ILE  52  -3.586   1.071   1.184
  438   3HD1  ILE  52          2HD1      ILE  52  -3.293  -0.192  -0.013
  439    QG1  ILE  52           QG1      ILE  52  -3.413  -1.427   1.895
  440    QG2  ILE  52           QG2      ILE  52  -4.809   1.009   3.722
  441    QD1  ILE  52           QD1      ILE  52  -3.947   0.357   0.547
  442    H    TRP  53           H        TRP  53  -4.178  -0.651   6.447
  443    HA   TRP  53           HA       TRP  53  -6.834  -1.300   7.563
  444   1HB   TRP  53          1HB       TRP  53  -4.077  -1.710   8.724
  445   2HB   TRP  53          2HB       TRP  53  -5.364  -1.275   9.823
  446    HD1  TRP  53           HD       TRP  53  -7.296  -3.042  10.299
  447    HE1  TRP  53          1HE       TRP  53  -7.392  -5.575  10.113
  448    HE3  TRP  53          3HE       TRP  53  -3.363  -3.710   7.159
  449    HZ2  TRP  53          2HZ       TRP  53  -5.941  -7.669   8.731
  450    HZ3  TRP  53          3HZ       TRP  53  -2.842  -5.935   6.305
  451    HH2  TRP  53           HH       TRP  53  -4.049  -7.960   7.129
  452    QB   TRP  53           QB       TRP  53  -4.720  -1.492   9.273
  453    H    GLU  54           H        GLU  54  -7.515  -0.055   9.314
  454    HA   GLU  54           HA       GLU  54  -7.042   2.812   9.039
  455   1HB   GLU  54          1HB       GLU  54  -9.292   1.666   8.988
  456   2HB   GLU  54          2HB       GLU  54  -9.010   1.128  10.647
  457   1HG   GLU  54          1HG       GLU  54  -9.012   3.427  11.445
  458   2HG   GLU  54          2HG       GLU  54  -9.208   4.035   9.787
  459    QB   GLU  54           QB       GLU  54  -9.151   1.397   9.817
  460    QG   GLU  54           QG       GLU  54  -9.110   3.731  10.616
  461    H    GLY  55           H        GLY  55  -6.502   0.171  11.358
  462   1HA   GLY  55          1HA       GLY  55  -6.040   2.031  13.588
  463   2HA   GLY  55          2HA       GLY  55  -6.346   0.338  13.715
  464    QA   GLY  55           QA       GLY  55  -6.193   1.185  13.652
  465    H    SER  56           H        SER  56  -4.162   2.388  14.406
  466    HA   SER  56           HA       SER  56  -1.911   2.278  12.991
  467   1HB   SER  56          1HB       SER  56  -1.931   2.230  16.043
  468   2HB   SER  56          2HB       SER  56  -0.758   3.015  14.983
  469    HG   SER  56           HG       SER  56  -3.478   3.691  15.472
  470    QB   SER  56           QB       SER  56  -1.344   2.623  15.513
  471    H    GLY  57           H        GLY  57  -0.594   0.857  12.370
  472   1HA   GLY  57          1HA       GLY  57   1.130  -0.713  12.626
  473   2HA   GLY  57          2HA       GLY  57   0.214  -1.427  13.954
  474    QA   GLY  57           QA       GLY  57   0.672  -1.070  13.290
  475    H    CYS  58           H        CYS  58  -2.181  -2.023  13.077
  476    HA   CYS  58           HA       CYS  58  -2.893  -2.694  10.590
  477   1HB   CYS  58          1HB       CYS  58  -2.427  -5.035  10.238
  478   2HB   CYS  58          2HB       CYS  58  -0.912  -4.187  10.264
  479    QB   CYS  58           QB       CYS  58  -1.670  -4.611  10.251
  480    H    VAL  59           H        VAL  59  -4.298  -1.928  12.850
  481    HA   VAL  59           HA       VAL  59  -6.016  -4.267  13.403
  482    HB   VAL  59           HB       VAL  59  -6.431  -3.135  15.598
  483   1HG1  VAL  59          2HG1      VAL  59  -5.177  -5.256  15.401
  484   2HG1  VAL  59          3HG1      VAL  59  -3.666  -4.345  15.194
  485   3HG1  VAL  59          1HG1      VAL  59  -4.550  -4.264  16.731
  486   1HG2  VAL  59          2HG2      VAL  59  -5.298  -0.973  15.206
  487   2HG2  VAL  59          3HG2      VAL  59  -4.669  -1.796  16.637
  488   3HG2  VAL  59          1HG2      VAL  59  -3.734  -1.814  15.137
  489    QG1  VAL  59           QG1      VAL  59  -4.464  -4.622  15.775
  490    QG2  VAL  59           QG2      VAL  59  -4.567  -1.527  15.660
  491    QQG  VAL  59           QQG      VAL  59  -4.515  -3.075  15.718
  492    H    GLY  60           H        GLY  60  -8.230  -3.220  14.144
  493   1HA   GLY  60          1HA       GLY  60  -9.812  -1.502  13.832
  494   2HA   GLY  60          2HA       GLY  60  -8.666  -0.590  12.871
  495    QA   GLY  60           QA       GLY  60  -9.239  -1.046  13.352
  496    H    ARG  61           H        ARG  61 -10.264  -0.247  11.268
  497    HA   ARG  61           HA       ARG  61 -11.593  -2.399   9.772
  498   1HB   ARG  61          1HB       ARG  61 -12.253   0.008  10.545
  499   2HB   ARG  61          2HB       ARG  61 -11.290   0.568   9.174
  500   1HG   ARG  61          1HG       ARG  61 -12.849  -0.416   7.628
  501   2HG   ARG  61          2HG       ARG  61 -13.682  -1.302   8.931
  502   1HD   ARG  61          1HD       ARG  61 -13.442   1.749   8.745
  503   2HD   ARG  61          2HD       ARG  61 -14.872   0.808   8.306
  504    HE   ARG  61           HE       ARG  61 -14.781  -0.049  10.744
  505   1HH1  ARG  61          2HH2      ARG  61 -13.266   3.166  10.259
  506   2HH1  ARG  61          1HH2      ARG  61 -13.979   3.799  11.644
  507   1HH2  ARG  61          2HH1      ARG  61 -15.021   0.622  12.735
  508   2HH2  ARG  61          1HH1      ARG  61 -14.571   2.226  13.279
  509    QB   ARG  61           QB       ARG  61 -11.771   0.288   9.860
  510    QG   ARG  61           QG       ARG  61 -13.265  -0.859   8.280
  511    QD   ARG  61           QD       ARG  61 -14.157   1.278   8.526
  512    QH1  ARG  61           QH2      ARG  61 -13.623   3.482  10.952
  513    QH2  ARG  61           QH1      ARG  61 -14.796   1.424  13.007
  514    H    SER  62           H        SER  62 -11.307  -2.673   7.487
  515    HA   SER  62           HA       SER  62  -8.891  -1.662   6.513
  516   1HB   SER  62          1HB       SER  62  -7.987  -4.162   6.088
  517   2HB   SER  62          2HB       SER  62  -7.705  -3.329   7.586
  518    HG   SER  62           HG       SER  62  -8.542  -5.393   8.038
  519    QB   SER  62           QB       SER  62  -7.846  -3.746   6.837
  520    H    THR  63           H        THR  63  -8.389  -2.407   4.303
  521    HA   THR  63           HA       THR  63 -10.472  -3.975   2.928
  522    HB   THR  63           HB       THR  63 -10.488  -2.267   1.057
  523    HG1  THR  63          1HG       THR  63  -8.591  -1.156   1.929
  524   1HG2  THR  63          2HG2      THR  63 -12.372  -2.441   2.695
  525   2HG2  THR  63          3HG2      THR  63 -11.594  -1.216   3.706
  526   3HG2  THR  63          1HG2      THR  63 -12.150  -0.790   2.082
  527    QG2  THR  63           QG2      THR  63 -12.039  -1.483   2.828
  528    H    THR  64           H        THR  64  -9.606  -4.929   0.967
  529    HA   THR  64           HA       THR  64  -6.627  -4.906   0.872
  530    HB   THR  64           HB       THR  64  -7.449  -7.101   1.171
  531    HG1  THR  64          1HG       THR  64  -6.332  -7.974  -0.436
  532   1HG2  THR  64          2HG2      THR  64  -9.145  -6.652  -1.329
  533   2HG2  THR  64          3HG2      THR  64  -8.850  -8.219  -0.549
  534   3HG2  THR  64          1HG2      THR  64  -9.727  -6.952   0.319
  535    QG2  THR  64           QG2      THR  64  -9.241  -7.274  -0.520
  536    H    MET  65           H        MET  65  -5.645  -3.846  -0.632
  537    HA   MET  65           HA       MET  65  -7.187  -2.732  -2.940
  538   1HB   MET  65          1HB       MET  65  -6.523  -1.210  -1.035
  539   2HB   MET  65          2HB       MET  65  -4.839  -1.475  -1.482
  540   1HG   MET  65          1HG       MET  65  -7.043  -0.349  -3.280
  541   2HG   MET  65          2HG       MET  65  -5.891   0.626  -2.375
  542   1HE   MET  65          2HE       MET  65  -3.361   0.783  -2.858
  543   2HE   MET  65          3HE       MET  65  -3.118  -0.971  -2.850
  544   3HE   MET  65          1HE       MET  65  -2.531  -0.008  -4.221
  545    QB   MET  65           QB       MET  65  -5.681  -1.342  -1.259
  546    QG   MET  65           QG       MET  65  -6.467   0.139  -2.828
  547    QE   MET  65           QE       MET  65  -3.003  -0.065  -3.310
  548    H    CYS  66           H        CYS  66  -6.530  -3.601  -4.837
  549    HA   CYS  66           HA       CYS  66  -3.760  -4.710  -5.124
  550   1HB   CYS  66          1HB       CYS  66  -6.295  -5.149  -6.679
  551   2HB   CYS  66          2HB       CYS  66  -4.719  -5.483  -7.356
  552    QB   CYS  66           QB       CYS  66  -5.507  -5.316  -7.018
  553    H    CYS  67           H        CYS  67  -2.421  -3.869  -6.684
  554    HA   CYS  67           HA       CYS  67  -3.476  -1.972  -8.660
  555   1HB   CYS  67          1HB       CYS  67  -2.729  -0.796  -6.593
  556   2HB   CYS  67          2HB       CYS  67  -1.094  -1.386  -6.854
  557    QB   CYS  67           QB       CYS  67  -1.912  -1.091  -6.723
  558    HA   PRO  68           HA       PRO  68  -0.479  -4.392 -10.985
  559   1HB   PRO  68          1HB       PRO  68  -0.315  -2.929 -13.287
  560   2HB   PRO  68          2HB       PRO  68  -1.584  -4.091 -12.889
  561   1HG   PRO  68          1HG       PRO  68  -1.586  -1.078 -12.587
  562   2HG   PRO  68          2HG       PRO  68  -2.922  -2.076 -13.215
  563   1HD   PRO  68          1HD       PRO  68  -2.872  -1.112 -10.672
  564   2HD   PRO  68          2HD       PRO  68  -3.562  -2.719 -11.006
  565    QB   PRO  68           QB       PRO  68  -0.949  -3.510 -13.088
  566    QG   PRO  68           QG       PRO  68  -2.254  -1.577 -12.901
  567    QD   PRO  68           QD       PRO  68  -3.217  -1.916 -10.839
  568    H    ALA  69           H        ALA  69   1.539  -3.926 -12.325
  569    HA   ALA  69           HA       ALA  69   3.401  -2.444 -10.609
  570   1HB   ALA  69          2HB       ALA  69   4.178  -4.454 -11.875
  571   2HB   ALA  69          3HB       ALA  69   3.903  -3.557 -13.392
  572   3HB   ALA  69          1HB       ALA  69   5.132  -3.017 -12.242
  573    QB   ALA  69           QB       ALA  69   4.404  -3.676 -12.503
  574    H    ASN  70           H        ASN  70   4.901  -0.861 -11.626
  575    HA   ASN  70           HA       ASN  70   5.259   1.189 -12.451
  576   1HB   ASN  70          1HB       ASN  70   5.587   1.309 -14.789
  577   2HB   ASN  70          2HB       ASN  70   6.061  -0.278 -14.203
  578   1HD2  ASN  70          2HD2      ASN  70   3.975  -0.216 -17.491
  579   2HD2  ASN  70          1HD2      ASN  70   5.253   0.834 -16.895
  580    QB   ASN  70           QB       ASN  70   5.824   0.516 -14.496
  581    QD2  ASN  70           QD2      ASN  70   4.614   0.309 -17.193
  582    H    THR  71           H        THR  71   3.057   1.525 -11.145
  583    HA   THR  71           HA       THR  71   1.858   3.638 -12.711
  584    HB   THR  71           HB       THR  71   0.540   1.351 -13.043
  585    HG1  THR  71          1HG       THR  71  -0.367   2.998 -13.936
  586   1HG2  THR  71          1HG2      THR  71   0.325   0.878 -10.620
  587   2HG2  THR  71          2HG2      THR  71  -0.717   2.308 -10.454
  588   3HG2  THR  71          3HG2      THR  71  -1.213   0.953 -11.476
  589    QG2  THR  71           QG2      THR  71  -0.535   1.380 -10.850
  590    H    CYS  72           H        CYS  72   0.356   4.871 -11.321
  591    HA   CYS  72           HA       CYS  72   1.149   4.976  -8.450
  592   1HB   CYS  72          1HB       CYS  72   1.847   6.995  -9.327
  593   2HB   CYS  72          2HB       CYS  72   0.705   6.945 -10.656
  594    QB   CYS  72           QB       CYS  72   1.276   6.970  -9.992
  595    H    CYS  73           H        CYS  73  -0.526   4.652  -7.034
  596    HA   CYS  73           HA       CYS  73  -3.285   4.360  -8.069
  597   1HB   CYS  73          1HB       CYS  73  -2.533   2.692  -5.788
  598   2HB   CYS  73          2HB       CYS  73  -3.313   2.265  -7.299
  599    QB   CYS  73           QB       CYS  73  -2.923   2.478  -6.544
  600    H    ASN  74           H        ASN  74  -4.606   5.776  -7.010
  601    HA   ASN  74           HA       ASN  74  -3.625   7.237  -4.632
  602   1HB   ASN  74          1HB       ASN  74  -4.990   8.466  -6.286
  603   2HB   ASN  74          2HB       ASN  74  -6.250   7.239  -6.209
  604   1HD2  ASN  74          2HD2      ASN  74  -6.070  10.144  -3.321
  605   2HD2  ASN  74          1HD2      ASN  74  -4.653   9.807  -4.300
  606    QB   ASN  74           QB       ASN  74  -5.620   7.852  -6.247
  607    QD2  ASN  74           QD2      ASN  74  -5.361   9.975  -3.811
  608    H    ILE  75           H        ILE  75  -3.832   6.532  -2.601
  609    HA   ILE  75           HA       ILE  75  -6.101   4.763  -1.827
  610    HB   ILE  75           HB       ILE  75  -3.377   5.435  -0.655
  611   1HG1  ILE  75          1HG1      ILE  75  -3.108   2.992  -0.614
  612   2HG1  ILE  75          2HG1      ILE  75  -4.670   2.800  -1.457
  613   1HG2  ILE  75          2HG2      ILE  75  -5.641   3.920   0.667
  614   2HG2  ILE  75          3HG2      ILE  75  -3.952   3.976   1.234
  615   3HG2  ILE  75          1HG2      ILE  75  -4.904   5.457   1.206
  616   1HD1  ILE  75          3HD1      ILE  75  -2.481   4.539  -2.548
  617   2HD1  ILE  75          1HD1      ILE  75  -2.407   2.786  -2.776
  618   3HD1  ILE  75          2HD1      ILE  75  -3.767   3.682  -3.450
  619    QG1  ILE  75           QG1      ILE  75  -3.889   2.896  -1.036
  620    QG2  ILE  75           QG2      ILE  75  -4.832   4.451   1.036
  621    QD1  ILE  75           QD1      ILE  75  -2.885   3.669  -2.925
  622    H    ASN  76           H        ASN  76  -7.796   6.252  -1.571
  623    HA   ASN  76           HA       ASN  76  -7.369   8.050   0.717
  624   1HB   ASN  76          1HB       ASN  76  -6.990   9.431  -1.424
  625   2HB   ASN  76          2HB       ASN  76  -8.716   9.242  -1.748
  626   1HD2  ASN  76          2HD2      ASN  76  -9.522  11.004   1.424
  627   2HD2  ASN  76          1HD2      ASN  76 -10.127   9.718   0.372
  628    QB   ASN  76           QB       ASN  76  -7.853   9.337  -1.586
  629    QD2  ASN  76           QD2      ASN  76  -9.825  10.361   0.898
  630    H    THR  77           H        THR  77  -8.359   6.083   1.451
  631    HA   THR  77           HA       THR  77 -10.660   4.968   0.228
  632    HB   THR  77           HB       THR  77 -10.344   3.578   2.505
  633    HG1  THR  77          1HG       THR  77  -9.056   5.024   3.625
  634   1HG2  THR  77          3HG2      THR  77  -8.179   3.778   0.361
  635   2HG2  THR  77          1HG2      THR  77  -8.279   2.503   1.595
  636   3HG2  THR  77          2HG2      THR  77  -9.564   2.666   0.399
  637    QG2  THR  77           QG2      THR  77  -8.674   2.982   0.785
  638    H    GLY  78           H        GLY  78 -12.551   4.285   1.738
  639   1HA   GLY  78          1HA       GLY  78 -14.043   6.508   2.665
  640   2HA   GLY  78          2HA       GLY  78 -14.314   4.819   3.130
  641    QA   GLY  78           QA       GLY  78 -14.178   5.664   2.898
  642    H    PHE  79           H        PHE  79 -11.768   4.338   4.384
  643    HA   PHE  79           HA       PHE  79 -12.080   5.882   6.923
  644   1HB   PHE  79          1HB       PHE  79 -10.740   4.055   7.881
  645   2HB   PHE  79          2HB       PHE  79 -12.253   3.478   7.250
  646    HD1  PHE  79          2HD       PHE  79 -12.171   2.214   4.919
  647    HD2  PHE  79          1HD       PHE  79  -8.654   3.186   7.230
  648    HE1  PHE  79          2HE       PHE  79 -10.757   0.899   3.373
  649    HE2  PHE  79          1HE       PHE  79  -7.304   1.712   5.805
  650   1HZ   PHE  79           HZ       PHE  79  -8.338   0.580   3.850
  651    QB   PHE  79           QB       PHE  79 -11.496   3.767   7.565
  652    QG   PHE  79           QD       PHE  79 -10.413   2.700   6.074
  653    QZ   PHE  79           QE       PHE  79  -9.030   1.305   4.589
  654    QZ   PHE  79           QR       PHE  79  -9.445   1.718   5.035
  655    H    TYR  80           H        TYR  80 -10.154   6.238   8.120
  656    HA   TYR  80           HA       TYR  80  -8.335   7.677   6.389
  657   1HB   TYR  80          1HB       TYR  80  -9.086   8.779   8.393
  658   2HB   TYR  80          2HB       TYR  80  -8.581   7.413   9.395
  659    HD1  TYR  80          1HD       TYR  80  -6.553   9.076   6.674
  660    HD2  TYR  80          2HD       TYR  80  -7.131   8.523  10.915
  661    HE1  TYR  80          1HE       TYR  80  -4.284   9.891   7.084
  662    HE2  TYR  80          2HE       TYR  80  -4.952   9.624  11.327
  663    HH   TYR  80           HH       TYR  80  -2.667  10.307   8.733
  664    QB   TYR  80           QB       TYR  80  -8.834   8.096   8.894
  665    QG   TYR  80           QD       TYR  80  -6.842   8.799   8.794
  666    QZ   TYR  80           QE       TYR  80  -4.618   9.757   9.205
  667    QR   TYR  80           QR       TYR  80  -5.730   9.278   9.000
  668    H    ILE  81           H        ILE  81  -6.165   6.966   6.038
  669    HA   ILE  81           HA       ILE  81  -5.835   4.116   6.541
  670    HB   ILE  81           HB       ILE  81  -3.777   4.670   4.960
  671   1HG1  ILE  81          1HG1      ILE  81  -4.531   7.173   4.912
  672   2HG1  ILE  81          2HG1      ILE  81  -4.118   6.377   3.417
  673   1HG2  ILE  81          2HG2      ILE  81  -6.672   4.145   4.244
  674   2HG2  ILE  81          3HG2      ILE  81  -5.304   3.906   3.131
  675   3HG2  ILE  81          1HG2      ILE  81  -5.402   2.988   4.635
  676   1HD1  ILE  81          3HD1      ILE  81  -7.027   6.632   4.297
  677   2HD1  ILE  81          1HD1      ILE  81  -6.172   7.763   3.239
  678   3HD1  ILE  81          2HD1      ILE  81  -6.398   6.073   2.758
  679    QG1  ILE  81           QG1      ILE  81  -4.324   6.775   4.165
  680    QG2  ILE  81           QG2      ILE  81  -5.793   3.680   4.003
  681    QD1  ILE  81           QD1      ILE  81  -6.532   6.823   3.431
  682    H    ARG  82           H        ARG  82  -4.341   3.240   7.846
  683    HA   ARG  82           HA       ARG  82  -2.258   5.014   9.026
  684   1HB   ARG  82          1HB       ARG  82  -4.593   4.736  10.251
  685   2HB   ARG  82          2HB       ARG  82  -3.859   3.222  10.829
  686   1HG   ARG  82          1HG       ARG  82  -2.092   4.423  11.907
  687   2HG   ARG  82          2HG       ARG  82  -2.462   5.917  11.022
  688   1HD   ARG  82          1HD       ARG  82  -4.704   6.053  12.153
  689   2HD   ARG  82          2HD       ARG  82  -4.339   4.569  13.014
  690    HE   ARG  82           HE       ARG  82  -3.063   5.699  14.523
  691   1HH1  ARG  82          2HH2      ARG  82  -3.443   7.760  11.679
  692   2HH1  ARG  82          1HH2      ARG  82  -2.787   9.193  12.439
  693   1HH2  ARG  82          2HH1      ARG  82  -2.175   7.602  15.548
  694   2HH2  ARG  82          1HH1      ARG  82  -2.083   9.098  14.672
  695    QB   ARG  82           QB       ARG  82  -4.226   3.979  10.540
  696    QG   ARG  82           QG       ARG  82  -2.277   5.170  11.464
  697    QD   ARG  82           QD       ARG  82  -4.521   5.311  12.584
  698    QH1  ARG  82           QH2      ARG  82  -3.115   8.477  12.059
  699    QH2  ARG  82           QH1      ARG  82  -2.129   8.350  15.110
  700    H    SER  83           H        SER  83  -3.037   1.872   7.847
  701    HA   SER  83           HA       SER  83  -0.280   0.980   8.326
  702   1HB   SER  83          1HB       SER  83  -1.543  -1.127   9.450
  703   2HB   SER  83          2HB       SER  83  -0.886   0.239  10.364
  704    HG   SER  83           HG       SER  83  -2.989   0.013  11.051
  705    QB   SER  83           QB       SER  83  -1.214  -0.444   9.907
  706    H    TYR  84           H        TYR  84   0.047  -1.345   7.502
  707    HA   TYR  84           HA       TYR  84  -1.961  -2.495   5.884
  708   1HB   TYR  84          1HB       TYR  84  -1.135  -2.164   3.705
  709   2HB   TYR  84          2HB       TYR  84  -1.284  -0.556   4.351
  710    HD1  TYR  84          2HD       TYR  84   1.270  -0.098   5.834
  711    HD2  TYR  84          1HD       TYR  84   0.466  -2.032   2.060
  712    HE1  TYR  84          2HE       TYR  84   3.425   0.710   4.944
  713    HE2  TYR  84          1HE       TYR  84   2.638  -1.203   1.217
  714    HH   TYR  84           HH       TYR  84   4.781   0.896   2.987
  715    QB   TYR  84           QB       TYR  84  -1.209  -1.360   4.028
  716    QG   TYR  84           QD       TYR  84   0.868  -1.065   3.947
  717    QZ   TYR  84           QE       TYR  84   3.031  -0.246   3.080
  718    QR   TYR  84           QR       TYR  84   1.950  -0.656   3.514
  719    H    ARG  85           H        ARG  85  -1.100  -4.213   4.476
  720    HA   ARG  85           HA       ARG  85   1.432  -5.535   5.267
  721   1HB   ARG  85          1HB       ARG  85  -1.441  -6.540   5.117
  722   2HB   ARG  85          2HB       ARG  85  -0.260  -7.581   4.636
  723   1HG   ARG  85          1HG       ARG  85  -0.792  -8.194   6.784
  724   2HG   ARG  85          2HG       ARG  85   0.889  -7.657   6.733
  725   1HD   ARG  85          1HD       ARG  85   0.522  -5.864   8.139
  726   2HD   ARG  85          2HD       ARG  85  -0.992  -5.518   7.439
  727    HE   ARG  85           HE       ARG  85  -2.069  -6.825   9.045
  728   1HH1  ARG  85          2HH2      ARG  85   1.259  -7.791   8.727
  729   2HH1  ARG  85          1HH2      ARG  85   1.207  -9.124   9.840
  730   1HH2  ARG  85          2HH1      ARG  85  -2.159  -8.296  10.801
  731   2HH2  ARG  85          1HH1      ARG  85  -0.769  -9.295  11.212
  732    QB   ARG  85           QB       ARG  85  -0.851  -7.061   4.876
  733    QG   ARG  85           QG       ARG  85   0.049  -7.926   6.758
  734    QD   ARG  85           QD       ARG  85  -0.235  -5.691   7.789
  735    QH1  ARG  85           QH2      ARG  85   1.233  -8.457   9.284
  736    QH2  ARG  85           QH1      ARG  85  -1.464  -8.795  11.006
  737    H    ARG  86           H        ARG  86   2.439  -6.021   3.219
  738    HA   ARG  86           HA       ARG  86   0.927  -5.954   0.712
  739   1HB   ARG  86          1HB       ARG  86   3.503  -5.940   1.013
  740   2HB   ARG  86          2HB       ARG  86   3.335  -7.657   1.462
  741   1HG   ARG  86          1HG       ARG  86   4.120  -7.545  -0.756
  742   2HG   ARG  86          2HG       ARG  86   2.460  -8.121  -0.829
  743   1HD   ARG  86          1HD       ARG  86   1.765  -5.781  -1.461
  744   2HD   ARG  86          2HD       ARG  86   3.441  -5.267  -1.359
  745    HE   ARG  86           HE       ARG  86   2.259  -7.209  -3.286
  746   1HH1  ARG  86          2HH2      ARG  86   5.274  -5.443  -2.310
  747   2HH1  ARG  86          1HH2      ARG  86   6.084  -6.047  -3.730
  748   1HH2  ARG  86          2HH1      ARG  86   3.492  -7.880  -4.936
  749   2HH2  ARG  86          1HH1      ARG  86   4.819  -6.945  -5.558
  750    QB   ARG  86           QB       ARG  86   3.419  -6.798   1.237
  751    QG   ARG  86           QG       ARG  86   3.290  -7.833  -0.792
  752    QD   ARG  86           QD       ARG  86   2.603  -5.524  -1.410
  753    QH1  ARG  86           QH2      ARG  86   5.679  -5.745  -3.020
  754    QH2  ARG  86           QH1      ARG  86   4.156  -7.412  -5.247
  755    H    VAL  87           H        VAL  87   0.180  -8.007  -0.425
  756    HA   VAL  87           HA       VAL  87   0.163 -10.398   1.360
  757    HB   VAL  87           HB       VAL  87  -1.868 -11.225   0.310
  758   1HG1  VAL  87          1HG1      VAL  87  -1.960 -10.071   2.489
  759   2HG1  VAL  87          2HG1      VAL  87  -2.248  -8.521   1.668
  760   3HG1  VAL  87          3HG1      VAL  87  -3.445  -9.825   1.556
  761   1HG2  VAL  87          1HG2      VAL  87  -1.841  -9.876  -1.802
  762   2HG2  VAL  87          2HG2      VAL  87  -3.384  -9.820  -0.942
  763   3HG2  VAL  87          3HG2      VAL  87  -2.285  -8.442  -0.836
  764    QG1  VAL  87           QG1      VAL  87  -2.551  -9.472   1.904
  765    QG2  VAL  87           QG2      VAL  87  -2.504  -9.379  -1.193
  766    QQG  VAL  87           QQG      VAL  87  -2.527  -9.426   0.355
  767    H    GLU  88           H        GLU  88   0.463  -9.212  -2.028
  768    HA   GLU  88           HA       GLU  88   2.560 -11.143  -2.354
  769   1HB   GLU  88          1HB       GLU  88   0.294 -12.320  -2.961
  770   2HB   GLU  88          2HB       GLU  88   0.300 -11.263  -4.376
  771   1HG   GLU  88          1HG       GLU  88   2.504 -13.199  -3.531
  772   2HG   GLU  88          2HG       GLU  88   1.270 -13.562  -4.745
  773    QB   GLU  88           QB       GLU  88   0.297 -11.791  -3.669
  774    QG   GLU  88           QG       GLU  88   1.887 -13.381  -4.138
   
  No H/Q in entry =         774
  Start of MODEL   17
    1   1HA   GLY   1          1HA       GLY   1  14.763  -2.707 -14.551
    2   2HA   GLY   1          2HA       GLY   1  14.271  -1.002 -14.620
    3    QA   GLY   1           QA       GLY   1  14.517  -1.854 -14.586
    4    H    ASP   2           H        ASP   2  14.880  -3.531 -12.478
    5    HA   ASP   2           HA       ASP   2  14.803  -3.787 -10.268
    6   1HB   ASP   2          1HB       ASP   2  14.024  -0.820 -10.258
    7   2HB   ASP   2          2HB       ASP   2  13.987  -1.806  -8.800
    8    QB   ASP   2           QB       ASP   2  14.005  -1.313  -9.529
    9    H    GLY   3           H        GLY   3  12.076  -1.672 -10.810
   10   1HA   GLY   3          1HA       GLY   3   9.927  -1.708 -10.068
   11   2HA   GLY   3          2HA       GLY   3  10.021  -3.464  -9.968
   12    QA   GLY   3           QA       GLY   3   9.974  -2.586 -10.018
   13    H    TYR   4           H        TYR   4   8.619  -2.297  -8.045
   14    HA   TYR   4           HA       TYR   4   9.870  -2.849  -5.580
   15   1HB   TYR   4          1HB       TYR   4   9.800  -0.366  -4.811
   16   2HB   TYR   4          2HB       TYR   4  11.175  -0.956  -5.702
   17    HD1  TYR   4          1HD       TYR   4   8.108   1.135  -5.863
   18    HD2  TYR   4          2HD       TYR   4  11.716   0.015  -7.937
   19    HE1  TYR   4          1HE       TYR   4   7.947   3.178  -7.247
   20    HE2  TYR   4          2HE       TYR   4  11.450   1.955  -9.428
   21    HH   TYR   4           HH       TYR   4   9.493   3.584 -10.147
   22    QB   TYR   4           QB       TYR   4  10.488  -0.661  -5.256
   23    QG   TYR   4           QD       TYR   4   9.912   0.575  -6.900
   24    QZ   TYR   4           QE       TYR   4   9.698   2.566  -8.337
   25    QR   TYR   4           QR       TYR   4   9.805   1.571  -7.618
   26    H    LEU   5           H        LEU   5   8.417  -1.952  -3.837
   27    HA   LEU   5           HA       LEU   5   5.679  -1.339  -4.708
   28   1HB   LEU   5          1HB       LEU   5   5.926  -3.801  -4.950
   29   2HB   LEU   5          2HB       LEU   5   6.219  -3.925  -3.217
   30    HG   LEU   5           HG       LEU   5   3.747  -2.443  -4.085
   31   1HD1  LEU   5          3HD1      LEU   5   4.057  -5.425  -4.473
   32   2HD1  LEU   5          1HD1      LEU   5   2.497  -4.569  -4.402
   33   3HD1  LEU   5          2HD1      LEU   5   3.656  -4.209  -5.691
   34   1HD2  LEU   5          2HD2      LEU   5   4.326  -4.578  -1.985
   35   2HD2  LEU   5          3HD2      LEU   5   4.301  -2.850  -1.673
   36   3HD2  LEU   5          1HD2      LEU   5   2.803  -3.686  -2.136
   37    QB   LEU   5           QB       LEU   5   6.073  -3.863  -4.084
   38    QD1  LEU   5           QD1      LEU   5   3.403  -4.734  -4.855
   39    QD2  LEU   5           QD2      LEU   5   3.810  -3.705  -1.931
   40    QQD  LEU   5           QQD      LEU   5   3.607  -4.220  -3.393
   41    H    ILE   6           H        ILE   6   5.395   0.400  -3.583
   42    HA   ILE   6           HA       ILE   6   5.900   0.582  -0.716
   43    HB   ILE   6           HB       ILE   6   7.228   2.686  -1.159
   44   1HG1  ILE   6          1HG1      ILE   6   7.092   1.702  -4.041
   45   2HG1  ILE   6          2HG1      ILE   6   6.553   3.245  -3.392
   46   1HG2  ILE   6          1HG2      ILE   6   8.319   0.547  -0.570
   47   2HG2  ILE   6          2HG2      ILE   6   8.643   0.253  -2.297
   48   3HG2  ILE   6          3HG2      ILE   6   9.332   1.670  -1.495
   49   1HD1  ILE   6          2HD1      ILE   6   9.035   3.645  -2.804
   50   2HD1  ILE   6          3HD1      ILE   6   9.358   2.250  -3.838
   51   3HD1  ILE   6          1HD1      ILE   6   8.579   3.693  -4.516
   52    QG1  ILE   6           QG1      ILE   6   6.822   2.473  -3.717
   53    QG2  ILE   6           QG2      ILE   6   8.765   0.823  -1.454
   54    QD1  ILE   6           QD1      ILE   6   8.991   3.196  -3.719
   55    H    MET   7           H        MET   7   4.919   2.551   0.108
   56    HA   MET   7           HA       MET   7   3.111   3.961  -1.778
   57   1HB   MET   7          1HB       MET   7   1.673   4.449   0.107
   58   2HB   MET   7          2HB       MET   7   2.077   2.732   0.063
   59   1HG   MET   7          1HG       MET   7   3.948   3.485   1.788
   60   2HG   MET   7          2HG       MET   7   2.784   4.753   2.111
   61   1HE   MET   7          1HE       MET   7   0.184   4.194   2.694
   62   2HE   MET   7          2HE       MET   7   0.029   3.014   1.378
   63   3HE   MET   7          3HE       MET   7  -0.405   2.549   3.035
   64    QB   MET   7           QB       MET   7   1.875   3.591   0.085
   65    QG   MET   7           QG       MET   7   3.366   4.119   1.950
   66    QE   MET   7           QE       MET   7  -0.064   3.252   2.369
   67    H    CYS   8           H        CYS   8   2.946   6.193  -1.640
   68    HA   CYS   8           HA       CYS   8   5.321   7.604  -0.519
   69   1HB   CYS   8          1HB       CYS   8   4.203   7.841  -3.306
   70   2HB   CYS   8          2HB       CYS   8   4.792   9.262  -2.528
   71    QB   CYS   8           QB       CYS   8   4.498   8.551  -2.917
   72    H    LYS   9           H        LYS   9   4.945   9.764  -0.049
   73    HA   LYS   9           HA       LYS   9   2.430   9.970   1.104
   74   1HB   LYS   9          1HB       LYS   9   2.870  11.946   1.925
   75   2HB   LYS   9          2HB       LYS   9   4.520  11.416   1.587
   76   1HG   LYS   9          1HG       LYS   9   4.249  12.755  -0.640
   77   2HG   LYS   9          2HG       LYS   9   2.759  13.390   0.104
   78   1HD   LYS   9          1HD       LYS   9   4.378  13.949   2.142
   79   2HD   LYS   9          2HD       LYS   9   5.622  13.766   0.892
   80   1HE   LYS   9          1HE       LYS   9   4.158  15.416  -0.527
   81   2HE   LYS   9          2HE       LYS   9   3.267  15.721   0.974
   82   1HZ   LYS   9          3HZ       LYS   9   5.610  16.343   1.870
   83   2HZ   LYS   9          1HZ       LYS   9   6.008  16.428   0.269
   84   3HZ   LYS   9          2HZ       LYS   9   4.805  17.358   0.893
   85    QB   LYS   9           QB       LYS   9   3.695  11.681   1.756
   86    QG   LYS   9           QG       LYS   9   3.504  13.072  -0.268
   87    QD   LYS   9           QD       LYS   9   5.000  13.858   1.517
   88    QE   LYS   9           QE       LYS   9   3.713  15.569   0.224
   89    QZ   LYS   9           QZ       LYS   9   5.474  16.710   1.011
   90    H    ASN  10           H        ASN  10   3.536  10.797  -2.039
   91    HA   ASN  10           HA       ASN  10   0.911  11.846  -3.000
   92   1HB   ASN  10          1HB       ASN  10   1.964  13.440  -4.413
   93   2HB   ASN  10          2HB       ASN  10   2.563  13.693  -2.777
   94   1HD2  ASN  10          2HD2      ASN  10   5.562  13.940  -4.864
   95   2HD2  ASN  10          1HD2      ASN  10   4.137  14.910  -4.550
   96    QB   ASN  10           QB       ASN  10   2.263  13.567  -3.595
   97    QD2  ASN  10           QD2      ASN  10   4.849  14.425  -4.707
   98    H    CYS  11           H        CYS  11   1.383  11.904  -5.631
   99    HA   CYS  11           HA       CYS  11   1.375   9.098  -6.337
  100   1HB   CYS  11          1HB       CYS  11  -0.079  10.858  -7.222
  101   2HB   CYS  11          2HB       CYS  11   1.300  11.676  -7.944
  102    QB   CYS  11           QB       CYS  11   0.611  11.267  -7.583
  103    H    ASP  12           H        ASP  12   4.049  10.880  -5.764
  104    HA   ASP  12           HA       ASP  12   5.494  10.187  -8.287
  105   1HB   ASP  12          1HB       ASP  12   5.192  12.529  -8.054
  106   2HB   ASP  12          2HB       ASP  12   5.779  12.499  -6.381
  107    QB   ASP  12           QB       ASP  12   5.485  12.514  -7.218
  108    HA   PRO  13           HA       PRO  13   8.111   7.825  -5.401
  109   1HB   PRO  13          1HB       PRO  13   9.790   6.680  -7.240
  110   2HB   PRO  13          2HB       PRO  13   8.216   6.025  -6.771
  111   1HG   PRO  13          1HG       PRO  13   8.981   7.637  -9.205
  112   2HG   PRO  13          2HG       PRO  13   7.813   6.290  -9.103
  113   1HD   PRO  13          1HD       PRO  13   7.175   8.995  -9.167
  114   2HD   PRO  13          2HD       PRO  13   6.100   7.759  -8.474
  115    QB   PRO  13           QB       PRO  13   9.003   6.352  -7.006
  116    QG   PRO  13           QG       PRO  13   8.397   6.963  -9.154
  117    QD   PRO  13           QD       PRO  13   6.637   8.377  -8.820
  118    H    ASN  14           H        ASN  14   9.004  10.311  -7.806
  119    HA   ASN  14           HA       ASN  14  11.784  10.327  -7.123
  120   1HB   ASN  14          1HB       ASN  14  10.891  11.309  -9.205
  121   2HB   ASN  14          2HB       ASN  14  10.204  12.646  -8.275
  122   1HD2  ASN  14          2HD2      ASN  14  13.692  13.514  -9.554
  123   2HD2  ASN  14          1HD2      ASN  14  12.315  12.857 -10.389
  124    QB   ASN  14           QB       ASN  14  10.547  11.978  -8.740
  125    QD2  ASN  14           QD2      ASN  14  13.004  13.185  -9.972
  126    H    THR  15           H        THR  15   9.223  12.636  -6.178
  127    HA   THR  15           HA       THR  15  10.871  13.333  -3.760
  128    HB   THR  15           HB       THR  15   9.988  15.592  -4.001
  129    HG1  THR  15          1HG       THR  15   8.537  14.393  -6.130
  130   1HG2  THR  15          1HG2      THR  15  12.087  14.956  -5.194
  131   2HG2  THR  15          2HG2      THR  15  11.136  14.683  -6.664
  132   3HG2  THR  15          3HG2      THR  15  11.211  16.300  -5.938
  133    QG2  THR  15           QG2      THR  15  11.478  15.313  -5.932
  134    H    GLY  16           H        GLY  16   8.347  11.471  -4.248
  135   1HA   GLY  16          1HA       GLY  16   6.310  12.703  -2.685
  136   2HA   GLY  16          2HA       GLY  16   6.467  10.963  -3.056
  137    QA   GLY  16           QA       GLY  16   6.389  11.833  -2.871
  138    H    SER  17           H        SER  17   9.210  11.078  -1.739
  139    HA   SER  17           HA       SER  17  10.017  10.254   0.170
  140   1HB   SER  17          1HB       SER  17   7.680  11.334   1.762
  141   2HB   SER  17          2HB       SER  17   9.285  10.882   2.327
  142    HG   SER  17           HG       SER  17  10.004  12.586   0.731
  143    QB   SER  17           QB       SER  17   8.482  11.108   2.045
  144    H    CYS  18           H        CYS  18   9.694   8.221  -0.550
  145    HA   CYS  18           HA       CYS  18   7.086   6.887  -0.010
  146   1HB   CYS  18          1HB       CYS  18   9.307   6.351  -1.945
  147   2HB   CYS  18          2HB       CYS  18   8.507   4.959  -1.218
  148    QB   CYS  18           QB       CYS  18   8.907   5.655  -1.581
  149    H    ASP  19           H        ASP  19   6.971   5.080   1.374
  150    HA   ASP  19           HA       ASP  19   9.405   4.694   3.037
  151   1HB   ASP  19          1HB       ASP  19   7.877   3.381   4.483
  152   2HB   ASP  19          2HB       ASP  19   7.723   5.145   4.361
  153    QB   ASP  19           QB       ASP  19   7.800   4.263   4.422
  154    H    TRP  20           H        TRP  20  10.778   3.585   1.887
  155    HA   TRP  20           HA       TRP  20  10.200   1.147   0.372
  156   1HB   TRP  20          1HB       TRP  20  12.763   2.581   1.117
  157   2HB   TRP  20          2HB       TRP  20  12.604   1.253  -0.023
  158    HD1  TRP  20           HD       TRP  20  11.722   4.984   0.288
  159    HE1  TRP  20          1HE       TRP  20  11.488   6.007  -2.010
  160    HE3  TRP  20          3HE       TRP  20  12.016   0.719  -2.437
  161    HZ2  TRP  20          2HZ       TRP  20  11.402   5.066  -4.787
  162    HZ3  TRP  20          3HZ       TRP  20  12.132   0.827  -4.907
  163    HH2  TRP  20           HH       TRP  20  11.791   2.994  -6.101
  164    QB   TRP  20           QB       TRP  20  12.683   1.917   0.547
  165    H    LYS  21           H        LYS  21   9.220   0.875   2.862
  166    HA   LYS  21           HA       LYS  21  11.175  -0.381   4.650
  167   1HB   LYS  21          1HB       LYS  21   8.426   0.736   4.842
  168   2HB   LYS  21          2HB       LYS  21   8.591  -0.754   5.729
  169   1HG   LYS  21          1HG       LYS  21  10.308   1.715   6.114
  170   2HG   LYS  21          2HG       LYS  21   8.986   1.139   7.139
  171   1HD   LYS  21          1HD       LYS  21  10.342  -1.062   7.384
  172   2HD   LYS  21          2HD       LYS  21  11.719  -0.162   6.747
  173   1HE   LYS  21          1HE       LYS  21  10.223   0.274   9.360
  174   2HE   LYS  21          2HE       LYS  21  11.916  -0.161   9.093
  175   1HZ   LYS  21          2HZ       LYS  21  12.045   2.128   7.974
  176   2HZ   LYS  21          3HZ       LYS  21  10.626   2.451   8.738
  177   3HZ   LYS  21          1HZ       LYS  21  11.956   2.097   9.610
  178    QB   LYS  21           QB       LYS  21   8.508  -0.009   5.285
  179    QG   LYS  21           QG       LYS  21   9.647   1.427   6.626
  180    QD   LYS  21           QD       LYS  21  11.030  -0.612   7.066
  181    QE   LYS  21           QE       LYS  21  11.070   0.057   9.226
  182    QZ   LYS  21           QZ       LYS  21  11.543   2.225   8.774
  183    H    GLN  22           H        GLN  22  10.068  -2.436   5.780
  184    HA   GLN  22           HA       GLN  22   9.791  -4.592   3.876
  185   1HB   GLN  22          1HB       GLN  22  10.549  -4.816   6.299
  186   2HB   GLN  22          2HB       GLN  22   8.914  -4.334   6.776
  187   1HG   GLN  22          1HG       GLN  22   8.124  -6.466   5.485
  188   2HG   GLN  22          2HG       GLN  22   9.818  -6.961   5.563
  189   1HE2  GLN  22          2HE2      GLN  22   9.597  -7.011   9.280
  190   2HE2  GLN  22          1HE2      GLN  22  10.607  -6.192   8.086
  191    QB   GLN  22           QB       GLN  22   9.732  -4.575   6.538
  192    QG   GLN  22           QG       GLN  22   8.971  -6.713   5.524
  193    QE2  GLN  22           QE2      GLN  22  10.102  -6.602   8.683
  194    H    ASN  23           H        ASN  23   7.856  -5.631   3.401
  195    HA   ASN  23           HA       ASN  23   5.284  -4.359   4.147
  196   1HB   ASN  23          1HB       ASN  23   4.449  -4.203   1.913
  197   2HB   ASN  23          2HB       ASN  23   5.902  -3.214   2.110
  198   1HD2  ASN  23          2HD2      ASN  23   6.826  -4.636  -1.022
  199   2HD2  ASN  23          1HD2      ASN  23   6.228  -3.181  -0.262
  200    QB   ASN  23           QB       ASN  23   5.176  -3.709   2.012
  201    QD2  ASN  23           QD2      ASN  23   6.527  -3.908  -0.642
  202    H    TRP  24           H        TRP  24   7.133  -7.253   3.472
  203    HA   TRP  24           HA       TRP  24   4.730  -8.833   2.863
  204   1HB   TRP  24          1HB       TRP  24   7.737  -9.199   2.955
  205   2HB   TRP  24          2HB       TRP  24   6.711 -10.585   3.138
  206    HD1  TRP  24           HD       TRP  24   8.607  -9.197   0.625
  207    HE1  TRP  24          1HE       TRP  24   7.806  -9.786  -1.733
  208    HE3  TRP  24          3HE       TRP  24   3.844 -10.649   1.720
  209    HZ2  TRP  24          2HZ       TRP  24   5.412 -10.775  -2.993
  210    HZ3  TRP  24          3HZ       TRP  24   2.261 -11.243  -0.113
  211    HH2  TRP  24           HH       TRP  24   3.033 -11.312  -2.456
  212    QB   TRP  24           QB       TRP  24   7.224  -9.892   3.046
  213    H    ASN  25           H        ASN  25   3.512  -9.360   4.605
  214    HA   ASN  25           HA       ASN  25   2.822  -9.729   6.746
  215   1HB   ASN  25          1HB       ASN  25   5.319 -11.451   6.834
  216   2HB   ASN  25          2HB       ASN  25   4.043 -11.433   8.047
  217   1HD2  ASN  25          2HD2      ASN  25   3.342 -13.298   4.495
  218   2HD2  ASN  25          1HD2      ASN  25   4.862 -12.494   4.836
  219    QB   ASN  25           QB       ASN  25   4.681 -11.442   7.440
  220    QD2  ASN  25           QD2      ASN  25   4.102 -12.896   4.666
  221    H    THR  26           H        THR  26   3.386  -7.361   6.881
  222    HA   THR  26           HA       THR  26   5.190  -6.956   9.194
  223    HB   THR  26           HB       THR  26   5.935  -6.116   6.781
  224    HG1  THR  26          1HG       THR  26   6.984  -5.879   8.685
  225   1HG2  THR  26          3HG2      THR  26   4.156  -3.793   7.607
  226   2HG2  THR  26          1HG2      THR  26   5.414  -3.777   6.386
  227   3HG2  THR  26          2HG2      THR  26   3.997  -4.826   6.182
  228    QG2  THR  26           QG2      THR  26   4.523  -4.132   6.725
  229    H    CYS  27           H        CYS  27   4.616  -4.543   9.971
  230    HA   CYS  27           HA       CYS  27   1.780  -4.076  10.096
  231   1HB   CYS  27          1HB       CYS  27   2.445  -6.037  11.738
  232   2HB   CYS  27          2HB       CYS  27   3.154  -4.761  12.715
  233    QB   CYS  27           QB       CYS  27   2.800  -5.399  12.227
  234    H    VAL  28           H        VAL  28   3.304  -2.394   8.983
  235    HA   VAL  28           HA       VAL  28   4.860  -0.668  10.822
  236    HB   VAL  28           HB       VAL  28   4.664  -0.786   7.792
  237   1HG1  VAL  28          2HG1      VAL  28   6.549   0.828   9.569
  238   2HG1  VAL  28          3HG1      VAL  28   6.664   0.672   7.802
  239   3HG1  VAL  28          1HG1      VAL  28   5.278   1.496   8.519
  240   1HG2  VAL  28          3HG2      VAL  28   5.813  -2.753   8.838
  241   2HG2  VAL  28          1HG2      VAL  28   6.884  -1.776   7.833
  242   3HG2  VAL  28          2HG2      VAL  28   6.961  -1.650   9.605
  243    QG1  VAL  28           QG1      VAL  28   6.164   0.999   8.630
  244    QG2  VAL  28           QG2      VAL  28   6.553  -2.060   8.759
  245    QQG  VAL  28           QQG      VAL  28   6.358  -0.531   8.694
  246    H    GLY  29           H        GLY  29   4.074   1.329  11.467
  247   1HA   GLY  29          1HA       GLY  29   1.514   2.231  10.505
  248   2HA   GLY  29          2HA       GLY  29   2.473   2.959  11.771
  249    QA   GLY  29           QA       GLY  29   1.994   2.595  11.138
  250    H    ILE  30           H        ILE  30   1.251   3.623   9.025
  251    HA   ILE  30           HA       ILE  30   3.330   5.241   7.666
  252    HB   ILE  30           HB       ILE  30   0.513   4.605   6.725
  253   1HG1  ILE  30          1HG1      ILE  30   1.472   2.426   7.274
  254   2HG1  ILE  30          2HG1      ILE  30   1.320   2.619   5.544
  255   1HG2  ILE  30          1HG2      ILE  30   3.069   5.180   5.192
  256   2HG2  ILE  30          2HG2      ILE  30   1.503   4.752   4.496
  257   3HG2  ILE  30          3HG2      ILE  30   1.667   6.256   5.375
  258   1HD1  ILE  30          1HD1      ILE  30   3.865   3.047   7.169
  259   2HD1  ILE  30          2HD1      ILE  30   3.415   1.555   6.340
  260   3HD1  ILE  30          3HD1      ILE  30   3.714   3.030   5.391
  261    QG1  ILE  30           QG1      ILE  30   1.396   2.522   6.409
  262    QG2  ILE  30           QG2      ILE  30   2.080   5.396   5.021
  263    QD1  ILE  30           QD1      ILE  30   3.665   2.544   6.300
  264    H    GLY  31           H        GLY  31   2.544   7.427   6.849
  265   1HA   GLY  31          1HA       GLY  31   0.184   8.573   6.969
  266   2HA   GLY  31          2HA       GLY  31   0.682   8.832   8.654
  267    QA   GLY  31           QA       GLY  31   0.433   8.703   7.811
  268    H    ALA  32           H        ALA  32   0.305  11.025   7.422
  269    HA   ALA  32           HA       ALA  32   1.090  13.004   7.424
  270   1HB   ALA  32          2HB       ALA  32   2.990  12.157   8.696
  271   2HB   ALA  32          3HB       ALA  32   3.908  11.989   7.167
  272   3HB   ALA  32          1HB       ALA  32   3.329  13.597   7.695
  273    QB   ALA  32           QB       ALA  32   3.409  12.581   7.853
  274    H    ASN  33           H        ASN  33  -0.148  13.038   5.688
  275    HA   ASN  33           HA       ASN  33  -0.701  14.073   3.792
  276   1HB   ASN  33          1HB       ASN  33   2.092  13.862   2.653
  277   2HB   ASN  33          2HB       ASN  33   0.745  14.806   2.051
  278   1HD2  ASN  33          2HD2      ASN  33   3.197  16.263   4.989
  279   2HD2  ASN  33          1HD2      ASN  33   3.261  14.585   4.472
  280    QB   ASN  33           QB       ASN  33   1.419  14.334   2.352
  281    QD2  ASN  33           QD2      ASN  33   3.229  15.424   4.730
  282    H    VAL  34           H        VAL  34   0.004  11.019   4.402
  283    HA   VAL  34           HA       VAL  34   0.575  10.042   1.711
  284    HB   VAL  34           HB       VAL  34   0.083   8.516   4.307
  285   1HG1  VAL  34          1HG1      VAL  34   1.291   7.644   1.647
  286   2HG1  VAL  34          2HG1      VAL  34   1.382   6.696   3.128
  287   3HG1  VAL  34          3HG1      VAL  34  -0.191   7.019   2.400
  288   1HG2  VAL  34          1HG2      VAL  34   2.091  10.069   4.418
  289   2HG2  VAL  34          2HG2      VAL  34   2.462   8.354   4.599
  290   3HG2  VAL  34          3HG2      VAL  34   2.797   9.161   3.074
  291    QG1  VAL  34           QG1      VAL  34   0.827   7.120   2.392
  292    QG2  VAL  34           QG2      VAL  34   2.450   9.195   4.030
  293    QQG  VAL  34           QQG      VAL  34   1.639   8.157   3.211
  294    H    HIS  35           H        HIS  35  -0.801   9.658   0.177
  295    HA   HIS  35           HA       HIS  35  -2.906   7.762   0.832
  296   1HB   HIS  35          1HB       HIS  35  -4.707   8.887  -0.308
  297   2HB   HIS  35          2HB       HIS  35  -4.202   9.800   1.106
  298    HD1  HIS  35          1HD       HIS  35  -5.286  10.412  -2.295
  299    HD2  HIS  35          2HD       HIS  35  -2.251  11.854   0.233
  300    HE1  HIS  35          1HE       HIS  35  -4.671  12.738  -3.138
  301    QB   HIS  35           QB       HIS  35  -4.454   9.344   0.399
  302    H    TRP  36           H        TRP  36  -0.334   7.536  -0.676
  303    HA   TRP  36           HA       TRP  36  -1.611   6.614  -3.237
  304   1HB   TRP  36          1HB       TRP  36   0.895   8.220  -2.946
  305   2HB   TRP  36          2HB       TRP  36   0.340   7.441  -4.432
  306    HD1  TRP  36           HD       TRP  36  -0.679  10.209  -2.030
  307    HE1  TRP  36          1HE       TRP  36  -2.222  11.871  -3.196
  308    HE3  TRP  36          3HE       TRP  36  -1.488   7.589  -6.280
  309    HZ2  TRP  36          2HZ       TRP  36  -3.722  11.993  -5.670
  310    HZ3  TRP  36          3HZ       TRP  36  -3.059   8.442  -8.008
  311    HH2  TRP  36           HH       TRP  36  -4.107  10.683  -7.759
  312    QB   TRP  36           QB       TRP  36   0.617   7.830  -3.689
  313    H    MET  37           H        MET  37  -1.154   4.560  -3.642
  314    HA   MET  37           HA       MET  37   1.321   3.310  -2.596
  315   1HB   MET  37          1HB       MET  37  -0.783   1.983  -2.462
  316   2HB   MET  37          2HB       MET  37  -0.890   2.028  -4.242
  317   1HG   MET  37          1HG       MET  37   0.082  -0.035  -3.543
  318   2HG   MET  37          2HG       MET  37   1.427   0.915  -4.194
  319   1HE   MET  37          1HE       MET  37   1.777  -1.629  -2.375
  320   2HE   MET  37          2HE       MET  37   3.140  -0.635  -2.968
  321   3HE   MET  37          3HE       MET  37   3.043  -1.067  -1.237
  322    QB   MET  37           QB       MET  37  -0.836   2.005  -3.352
  323    QG   MET  37           QG       MET  37   0.754   0.440  -3.868
  324    QE   MET  37           QE       MET  37   2.653  -1.111  -2.193
  325    H    VAL  38           H        VAL  38   3.080   3.179  -4.056
  326    HA   VAL  38           HA       VAL  38   2.622   4.076  -6.873
  327    HB   VAL  38           HB       VAL  38   4.667   5.269  -4.950
  328   1HG1  VAL  38          2HG1      VAL  38   5.410   5.187  -7.337
  329   2HG1  VAL  38          3HG1      VAL  38   3.906   6.009  -7.816
  330   3HG1  VAL  38          1HG1      VAL  38   5.082   6.833  -6.769
  331   1HG2  VAL  38          1HG2      VAL  38   2.055   6.387  -6.076
  332   2HG2  VAL  38          2HG2      VAL  38   2.498   6.189  -4.362
  333   3HG2  VAL  38          3HG2      VAL  38   3.325   7.386  -5.361
  334    QG1  VAL  38           QG1      VAL  38   4.799   6.010  -7.307
  335    QG2  VAL  38           QG2      VAL  38   2.626   6.654  -5.266
  336    QQG  VAL  38           QQG      VAL  38   3.713   6.332  -6.287
  337    H    THR  39           H        THR  39   2.902   1.954  -7.511
  338    HA   THR  39           HA       THR  39   5.248   0.531  -6.380
  339    HB   THR  39           HB       THR  39   2.895  -0.377  -6.308
  340    HG1  THR  39          1HG       THR  39   5.097  -1.872  -7.238
  341   1HG2  THR  39          1HG2      THR  39   2.173   0.016  -8.614
  342   2HG2  THR  39          2HG2      THR  39   3.461  -1.053  -9.202
  343   3HG2  THR  39          3HG2      THR  39   2.145  -1.713  -8.216
  344    QG2  THR  39           QG2      THR  39   2.593  -0.917  -8.677
  345    H    GLY  40           H        GLY  40   6.834  -0.383  -7.648
  346   1HA   GLY  40          1HA       GLY  40   7.662   1.172  -9.952
  347   2HA   GLY  40          2HA       GLY  40   8.498  -0.189  -9.200
  348    QA   GLY  40           QA       GLY  40   8.080   0.492  -9.576
  349    H    GLY  41           H        GLY  41   8.701  -0.193 -11.810
  350   1HA   GLY  41          1HA       GLY  41   6.406  -1.190 -13.255
  351   2HA   GLY  41          2HA       GLY  41   8.087  -1.052 -13.820
  352    QA   GLY  41           QA       GLY  41   7.247  -1.121 -13.538
  353    H    SER  42           H        SER  42   9.330  -2.716 -11.935
  354    HA   SER  42           HA       SER  42   8.430  -5.297 -12.984
  355   1HB   SER  42          1HB       SER  42  11.164  -4.776 -12.021
  356   2HB   SER  42          2HB       SER  42  10.509  -5.640 -13.428
  357    HG   SER  42           HG       SER  42  10.074  -3.571 -14.361
  358    QB   SER  42           QB       SER  42  10.836  -5.208 -12.725
  359    H    THR  43           H        THR  43  10.154  -6.871 -11.466
  360    HA   THR  43           HA       THR  43  10.977  -7.549  -9.463
  361    HB   THR  43           HB       THR  43  10.332  -5.179  -8.420
  362    HG1  THR  43          1HG       THR  43  11.750  -6.064  -7.246
  363   1HG2  THR  43          3HG2      THR  43   7.888  -5.665  -7.865
  364   2HG2  THR  43          1HG2      THR  43   8.431  -7.038  -6.903
  365   3HG2  THR  43          2HG2      THR  43   8.895  -5.387  -6.463
  366    QG2  THR  43           QG2      THR  43   8.405  -6.030  -7.077
  367    H    ASP  44           H        ASP  44   7.597  -6.805  -9.777
  368    HA   ASP  44           HA       ASP  44   6.968  -9.701  -9.941
  369   1HB   ASP  44          1HB       ASP  44   5.719  -8.407  -8.070
  370   2HB   ASP  44          2HB       ASP  44   4.882  -7.568  -9.386
  371    QB   ASP  44           QB       ASP  44   5.300  -7.987  -8.728
  372    H    GLY  45           H        GLY  45   5.569 -10.017 -11.787
  373   1HA   GLY  45          1HA       GLY  45   6.056  -8.116 -14.029
  374   2HA   GLY  45          2HA       GLY  45   5.689  -9.839 -14.219
  375    QA   GLY  45           QA       GLY  45   5.872  -8.978 -14.124
  376    H    LYS  46           H        LYS  46   3.746  -9.173 -11.721
  377    HA   LYS  46           HA       LYS  46   1.466  -8.253 -13.374
  378   1HB   LYS  46          1HB       LYS  46   0.078  -9.927 -12.161
  379   2HB   LYS  46          2HB       LYS  46   1.155 -10.557 -13.421
  380   1HG   LYS  46          1HG       LYS  46   2.792 -11.212 -11.771
  381   2HG   LYS  46          2HG       LYS  46   1.835 -10.454 -10.476
  382   1HD   LYS  46          1HD       LYS  46   1.361 -12.752 -10.234
  383   2HD   LYS  46          2HD       LYS  46  -0.018 -12.119 -11.126
  384   1HE   LYS  46          1HE       LYS  46   0.555 -14.125 -12.272
  385   2HE   LYS  46          2HE       LYS  46   1.223 -12.850 -13.293
  386   1HZ   LYS  46          1HZ       LYS  46   3.416 -13.339 -12.129
  387   2HZ   LYS  46          2HZ       LYS  46   2.669 -14.595 -11.404
  388   3HZ   LYS  46          3HZ       LYS  46   2.796 -14.578 -13.027
  389    QB   LYS  46           QB       LYS  46   0.616 -10.242 -12.791
  390    QG   LYS  46           QG       LYS  46   2.314 -10.833 -11.123
  391    QD   LYS  46           QD       LYS  46   0.671 -12.435 -10.680
  392    QE   LYS  46           QE       LYS  46   0.889 -13.487 -12.782
  393    QZ   LYS  46           QZ       LYS  46   2.960 -14.171 -12.187
  394    H    GLN  47           H        GLN  47  -0.241  -7.408 -11.995
  395    HA   GLN  47           HA       GLN  47   0.632  -5.582 -10.152
  396   1HB   GLN  47          1HB       GLN  47  -1.659  -5.231  -9.549
  397   2HB   GLN  47          2HB       GLN  47  -1.641  -5.704 -11.272
  398   1HG   GLN  47          1HG       GLN  47  -2.230  -8.044 -10.542
  399   2HG   GLN  47          2HG       GLN  47  -2.508  -7.405  -8.908
  400   1HE2  GLN  47          2HE2      GLN  47  -4.972  -5.123 -10.995
  401   2HE2  GLN  47          1HE2      GLN  47  -3.456  -4.760 -10.236
  402    QB   GLN  47           QB       GLN  47  -1.650  -5.468 -10.410
  403    QG   GLN  47           QG       GLN  47  -2.369  -7.725  -9.725
  404    QE2  GLN  47           QE2      GLN  47  -4.214  -4.942 -10.616
  405    H    GLY  48           H        GLY  48   0.666  -5.327  -7.965
  406   1HA   GLY  48          1HA       GLY  48   0.532  -7.812  -6.305
  407   2HA   GLY  48          2HA       GLY  48   1.583  -6.428  -5.924
  408    QA   GLY  48           QA       GLY  48   1.058  -7.120  -6.114
  409    H    CYS  49           H        CYS  49  -0.672  -7.415  -4.140
  410    HA   CYS  49           HA       CYS  49  -2.209  -4.915  -4.216
  411   1HB   CYS  49          1HB       CYS  49  -3.396  -7.554  -3.381
  412   2HB   CYS  49          2HB       CYS  49  -4.141  -5.998  -3.570
  413    QB   CYS  49           QB       CYS  49  -3.768  -6.776  -3.475
  414    H    ALA  50           H        ALA  50  -2.606  -4.144  -2.251
  415    HA   ALA  50           HA       ALA  50  -1.064  -5.379  -0.005
  416   1HB   ALA  50          1HB       ALA  50  -1.243  -2.420  -0.745
  417   2HB   ALA  50          2HB       ALA  50  -0.456  -3.083   0.700
  418   3HB   ALA  50          3HB       ALA  50   0.204  -3.438  -0.911
  419    QB   ALA  50           QB       ALA  50  -0.498  -2.980  -0.318
  420    H    THR  51           H        THR  51  -2.262  -5.658   1.770
  421    HA   THR  51           HA       THR  51  -4.972  -4.359   1.823
  422    HB   THR  51           HB       THR  51  -3.859  -6.551   3.556
  423    HG1  THR  51          1HG       THR  51  -4.484  -7.026   1.395
  424   1HG2  THR  51          1HG2      THR  51  -6.603  -5.181   3.511
  425   2HG2  THR  51          2HG2      THR  51  -6.178  -6.627   4.450
  426   3HG2  THR  51          3HG2      THR  51  -5.424  -5.072   4.837
  427    QG2  THR  51           QG2      THR  51  -6.068  -5.626   4.266
  428    H    ILE  52           H        ILE  52  -5.086  -2.481   2.585
  429    HA   ILE  52           HA       ILE  52  -2.970  -1.401   4.300
  430    HB   ILE  52           HB       ILE  52  -5.285  -0.002   2.882
  431   1HG1  ILE  52          1HG1      ILE  52  -2.438  -0.562   1.971
  432   2HG1  ILE  52          2HG1      ILE  52  -3.938  -1.045   1.170
  433   1HG2  ILE  52          3HG2      ILE  52  -4.221   1.255   4.796
  434   2HG2  ILE  52          1HG2      ILE  52  -2.673   1.163   3.922
  435   3HG2  ILE  52          2HG2      ILE  52  -4.051   2.049   3.237
  436   1HD1  ILE  52          1HD1      ILE  52  -4.471   1.368   0.782
  437   2HD1  ILE  52          2HD1      ILE  52  -2.832   1.773   1.362
  438   3HD1  ILE  52          3HD1      ILE  52  -3.031   0.765  -0.071
  439    QG1  ILE  52           QG1      ILE  52  -3.188  -0.804   1.570
  440    QG2  ILE  52           QG2      ILE  52  -3.649   1.489   3.985
  441    QD1  ILE  52           QD1      ILE  52  -3.445   1.302   0.691
  442    H    TRP  53           H        TRP  53  -3.759  -0.357   6.348
  443    HA   TRP  53           HA       TRP  53  -6.384  -1.330   7.364
  444   1HB   TRP  53          1HB       TRP  53  -3.582  -1.625   8.425
  445   2HB   TRP  53          2HB       TRP  53  -4.879  -1.410   9.587
  446    HD1  TRP  53           HD       TRP  53  -6.693  -3.283   9.824
  447    HE1  TRP  53          1HE       TRP  53  -6.668  -5.768   9.412
  448    HE3  TRP  53          3HE       TRP  53  -2.704  -3.422   6.677
  449    HZ2  TRP  53          2HZ       TRP  53  -5.118  -7.648   7.766
  450    HZ3  TRP  53          3HZ       TRP  53  -2.000  -5.548   5.669
  451    HH2  TRP  53           HH       TRP  53  -3.157  -7.686   6.226
  452    QB   TRP  53           QB       TRP  53  -4.230  -1.517   9.006
  453    H    GLU  54           H        GLU  54  -7.284  -0.144   9.047
  454    HA   GLU  54           HA       GLU  54  -6.827   2.695   9.134
  455   1HB   GLU  54          1HB       GLU  54  -9.019   1.571   9.109
  456   2HB   GLU  54          2HB       GLU  54  -8.558   0.653  10.549
  457   1HG   GLU  54          1HG       GLU  54  -8.680   2.683  11.922
  458   2HG   GLU  54          2HG       GLU  54  -9.129   3.623  10.484
  459    QB   GLU  54           QB       GLU  54  -8.789   1.112   9.829
  460    QG   GLU  54           QG       GLU  54  -8.904   3.153  11.203
  461    H    GLY  55           H        GLY  55  -6.373  -0.034  11.391
  462   1HA   GLY  55          1HA       GLY  55  -5.846   1.579  13.692
  463   2HA   GLY  55          2HA       GLY  55  -5.565  -0.136  13.548
  464    QA   GLY  55           QA       GLY  55  -5.705   0.721  13.620
  465    H    SER  56           H        SER  56  -3.979   2.317  14.484
  466    HA   SER  56           HA       SER  56  -1.491   2.444  13.077
  467   1HB   SER  56          1HB       SER  56  -2.089   2.673  16.067
  468   2HB   SER  56          2HB       SER  56  -0.542   3.047  15.314
  469    HG   SER  56           HG       SER  56  -3.035   4.367  14.935
  470    QB   SER  56           QB       SER  56  -1.316   2.860  15.691
  471    H    GLY  57           H        GLY  57  -0.690   0.470  12.367
  472   1HA   GLY  57          1HA       GLY  57   1.081  -1.098  13.463
  473   2HA   GLY  57          2HA       GLY  57  -0.400  -1.721  14.226
  474    QA   GLY  57           QA       GLY  57   0.340  -1.410  13.844
  475    H    CYS  58           H        CYS  58  -2.212  -2.179  12.820
  476    HA   CYS  58           HA       CYS  58  -2.599  -2.618  10.240
  477   1HB   CYS  58          1HB       CYS  58  -1.809  -4.758   9.580
  478   2HB   CYS  58          2HB       CYS  58  -0.436  -3.746   9.883
  479    QB   CYS  58           QB       CYS  58  -1.122  -4.252   9.731
  480    H    VAL  59           H        VAL  59  -4.179  -2.286  12.486
  481    HA   VAL  59           HA       VAL  59  -5.790  -4.759  12.508
  482    HB   VAL  59           HB       VAL  59  -6.336  -4.181  14.800
  483   1HG1  VAL  59          3HG1      VAL  59  -4.535  -5.853  14.289
  484   2HG1  VAL  59          1HG1      VAL  59  -3.326  -4.575  14.520
  485   3HG1  VAL  59          2HG1      VAL  59  -4.342  -5.089  15.876
  486   1HG2  VAL  59          1HG2      VAL  59  -4.116  -2.104  14.703
  487   2HG2  VAL  59          2HG2      VAL  59  -5.858  -1.829  14.973
  488   3HG2  VAL  59          3HG2      VAL  59  -4.902  -2.696  16.174
  489    QG1  VAL  59           QG1      VAL  59  -4.068  -5.173  14.895
  490    QG2  VAL  59           QG2      VAL  59  -4.959  -2.210  15.283
  491    QQG  VAL  59           QQG      VAL  59  -4.513  -3.691  15.089
  492    H    GLY  60           H        GLY  60  -8.134  -3.957  13.165
  493   1HA   GLY  60          1HA       GLY  60  -9.807  -2.315  13.067
  494   2HA   GLY  60          2HA       GLY  60  -8.630  -1.105  12.548
  495    QA   GLY  60           QA       GLY  60  -9.218  -1.710  12.807
  496    H    ARG  61           H        ARG  61 -10.176  -0.486  10.779
  497    HA   ARG  61           HA       ARG  61 -11.124  -2.730   9.096
  498   1HB   ARG  61          1HB       ARG  61 -12.391  -0.384   9.828
  499   2HB   ARG  61          2HB       ARG  61 -11.744   0.054   8.245
  500   1HG   ARG  61          1HG       ARG  61 -12.794  -2.013   7.291
  501   2HG   ARG  61          2HG       ARG  61 -13.380  -2.456   8.910
  502   1HD   ARG  61          1HD       ARG  61 -14.787  -0.446   8.988
  503   2HD   ARG  61          2HD       ARG  61 -14.144   0.069   7.421
  504    HE   ARG  61           HE       ARG  61 -15.354  -2.640   7.526
  505   1HH1  ARG  61          2HH2      ARG  61 -16.075   0.793   6.892
  506   2HH1  ARG  61          1HH2      ARG  61 -16.950   0.462   5.425
  507   1HH2  ARG  61          2HH1      ARG  61 -17.245  -3.009   6.270
  508   2HH2  ARG  61          1HH1      ARG  61 -17.837  -1.783   5.193
  509    QB   ARG  61           QB       ARG  61 -12.068  -0.165   9.037
  510    QG   ARG  61           QG       ARG  61 -13.087  -2.234   8.101
  511    QD   ARG  61           QD       ARG  61 -14.465  -0.189   8.205
  512    QH1  ARG  61           QH2      ARG  61 -16.513   0.628   6.158
  513    QH2  ARG  61           QH1      ARG  61 -17.541  -2.396   5.732
  514    H    SER  62           H        SER  62 -10.759  -2.954   6.897
  515    HA   SER  62           HA       SER  62  -8.231  -1.757   6.086
  516   1HB   SER  62          1HB       SER  62  -8.057  -4.601   5.789
  517   2HB   SER  62          2HB       SER  62  -7.041  -3.536   6.721
  518    HG   SER  62           HG       SER  62  -8.482  -3.757   8.484
  519    QB   SER  62           QB       SER  62  -7.549  -4.069   6.255
  520    H    THR  63           H        THR  63  -7.523  -2.425   3.939
  521    HA   THR  63           HA       THR  63  -9.722  -3.069   2.028
  522    HB   THR  63           HB       THR  63  -8.679  -0.696   1.013
  523    HG1  THR  63          1HG       THR  63  -7.596  -0.327   2.979
  524   1HG2  THR  63          2HG2      THR  63 -11.143  -1.092   2.751
  525   2HG2  THR  63          3HG2      THR  63 -10.789   0.352   1.784
  526   3HG2  THR  63          1HG2      THR  63 -11.024  -1.219   0.995
  527    QG2  THR  63           QG2      THR  63 -10.985  -0.653   1.843
  528    H    THR  64           H        THR  64  -8.843  -4.482   0.617
  529    HA   THR  64           HA       THR  64  -5.995  -4.631   0.065
  530    HB   THR  64           HB       THR  64  -8.301  -5.939  -1.362
  531    HG1  THR  64          1HG       THR  64  -6.821  -6.575   0.991
  532   1HG2  THR  64          2HG2      THR  64  -5.336  -6.630  -1.118
  533   2HG2  THR  64          3HG2      THR  64  -6.580  -7.696  -1.800
  534   3HG2  THR  64          1HG2      THR  64  -6.223  -6.155  -2.589
  535    QG2  THR  64           QG2      THR  64  -6.046  -6.827  -1.836
  536    H    MET  65           H        MET  65  -5.197  -2.783  -0.753
  537    HA   MET  65           HA       MET  65  -6.401  -1.467  -3.071
  538   1HB   MET  65          1HB       MET  65  -5.098  -0.382  -1.079
  539   2HB   MET  65          2HB       MET  65  -3.648  -1.004  -1.838
  540   1HG   MET  65          1HG       MET  65  -4.001   1.254  -2.539
  541   2HG   MET  65          2HG       MET  65  -4.240   0.227  -3.939
  542   1HE   MET  65          2HE       MET  65  -6.350   1.866  -0.948
  543   2HE   MET  65          3HE       MET  65  -7.962   1.867  -1.691
  544   3HE   MET  65          1HE       MET  65  -7.188   0.334  -1.301
  545    QB   MET  65           QB       MET  65  -4.373  -0.693  -1.458
  546    QG   MET  65           QG       MET  65  -4.121   0.741  -3.239
  547    QE   MET  65           QE       MET  65  -7.167   1.355  -1.313
  548    H    CYS  66           H        CYS  66  -6.183  -2.623  -4.951
  549    HA   CYS  66           HA       CYS  66  -3.752  -4.302  -5.413
  550   1HB   CYS  66          1HB       CYS  66  -6.340  -4.069  -6.912
  551   2HB   CYS  66          2HB       CYS  66  -4.917  -4.862  -7.575
  552    QB   CYS  66           QB       CYS  66  -5.628  -4.465  -7.243
  553    H    CYS  67           H        CYS  67  -2.275  -3.760  -7.024
  554    HA   CYS  67           HA       CYS  67  -2.705  -1.231  -8.505
  555   1HB   CYS  67          1HB       CYS  67  -1.879  -0.834  -6.138
  556   2HB   CYS  67          2HB       CYS  67  -0.351  -1.559  -6.642
  557    QB   CYS  67           QB       CYS  67  -1.115  -1.196  -6.390
  558    HA   PRO  68           HA       PRO  68  -0.357  -4.009 -11.221
  559   1HB   PRO  68          1HB       PRO  68  -0.898  -1.757 -13.121
  560   2HB   PRO  68          2HB       PRO  68  -1.001  -3.513 -13.402
  561   1HG   PRO  68          1HG       PRO  68  -3.265  -2.068 -12.994
  562   2HG   PRO  68          2HG       PRO  68  -3.062  -3.649 -12.205
  563   1HD   PRO  68          1HD       PRO  68  -2.615  -0.904 -10.999
  564   2HD   PRO  68          2HD       PRO  68  -3.476  -2.322 -10.325
  565    QB   PRO  68           QB       PRO  68  -0.949  -2.635 -13.262
  566    QG   PRO  68           QG       PRO  68  -3.164  -2.858 -12.599
  567    QD   PRO  68           QD       PRO  68  -3.045  -1.613 -10.662
  568    H    ALA  69           H        ALA  69   1.636  -3.858 -12.481
  569    HA   ALA  69           HA       ALA  69   3.489  -2.351 -10.906
  570   1HB   ALA  69          3HB       ALA  69   3.789  -4.675 -12.029
  571   2HB   ALA  69          1HB       ALA  69   4.256  -3.758 -13.472
  572   3HB   ALA  69          2HB       ALA  69   5.139  -3.568 -11.934
  573    QB   ALA  69           QB       ALA  69   4.395  -4.000 -12.478
  574    H    ASN  70           H        ASN  70   4.607  -0.484 -11.444
  575    HA   ASN  70           HA       ASN  70   4.761   1.671 -12.113
  576   1HB   ASN  70          1HB       ASN  70   4.363   0.460 -14.873
  577   2HB   ASN  70          2HB       ASN  70   4.497   2.196 -14.630
  578   1HD2  ASN  70          2HD2      ASN  70   7.900   0.551 -15.249
  579   2HD2  ASN  70          1HD2      ASN  70   6.336   0.214 -15.985
  580    QB   ASN  70           QB       ASN  70   4.430   1.328 -14.752
  581    QD2  ASN  70           QD2      ASN  70   7.118   0.382 -15.617
  582    H    THR  71           H        THR  71   2.523   1.096 -10.819
  583    HA   THR  71           HA       THR  71   0.677   3.016 -12.144
  584    HB   THR  71           HB       THR  71  -0.354   0.784 -10.448
  585    HG1  THR  71          1HG       THR  71   0.491  -0.088 -12.249
  586   1HG2  THR  71          1HG2      THR  71  -1.622   2.809 -12.367
  587   2HG2  THR  71          2HG2      THR  71  -2.481   1.496 -11.533
  588   3HG2  THR  71          3HG2      THR  71  -1.766   2.831 -10.613
  589    QG2  THR  71           QG2      THR  71  -1.956   2.379 -11.504
  590    H    CYS  72           H        CYS  72   0.928   4.824 -11.149
  591    HA   CYS  72           HA       CYS  72   1.137   5.080  -8.217
  592   1HB   CYS  72          1HB       CYS  72   1.964   6.980  -9.318
  593   2HB   CYS  72          2HB       CYS  72   0.696   6.913 -10.558
  594    QB   CYS  72           QB       CYS  72   1.330   6.946  -9.938
  595    H    CYS  73           H        CYS  73  -0.556   4.455  -7.039
  596    HA   CYS  73           HA       CYS  73  -3.340   4.370  -8.156
  597   1HB   CYS  73          1HB       CYS  73  -1.896   2.614  -6.134
  598   2HB   CYS  73          2HB       CYS  73  -3.637   2.589  -6.406
  599    QB   CYS  73           QB       CYS  73  -2.767   2.602  -6.270
  600    H    ASN  74           H        ASN  74  -4.736   5.754  -7.111
  601    HA   ASN  74           HA       ASN  74  -3.862   7.209  -4.710
  602   1HB   ASN  74          1HB       ASN  74  -5.272   8.291  -6.479
  603   2HB   ASN  74          2HB       ASN  74  -6.578   7.171  -6.100
  604   1HD2  ASN  74          2HD2      ASN  74  -7.522   8.901  -3.116
  605   2HD2  ASN  74          1HD2      ASN  74  -7.735   7.418  -4.044
  606    QB   ASN  74           QB       ASN  74  -5.925   7.731  -6.289
  607    QD2  ASN  74           QD2      ASN  74  -7.629   8.160  -3.580
  608    H    ILE  75           H        ILE  75  -4.378   6.709  -2.625
  609    HA   ILE  75           HA       ILE  75  -6.112   4.367  -2.053
  610    HB   ILE  75           HB       ILE  75  -3.939   5.870  -0.572
  611   1HG1  ILE  75          1HG1      ILE  75  -2.829   3.771  -0.476
  612   2HG1  ILE  75          2HG1      ILE  75  -4.271   2.889  -1.023
  613   1HG2  ILE  75          2HG2      ILE  75  -5.827   3.765   0.521
  614   2HG2  ILE  75          3HG2      ILE  75  -4.316   4.299   1.301
  615   3HG2  ILE  75          1HG2      ILE  75  -5.647   5.442   1.089
  616   1HD1  ILE  75          3HD1      ILE  75  -2.796   4.887  -2.693
  617   2HD1  ILE  75          1HD1      ILE  75  -2.466   3.142  -2.726
  618   3HD1  ILE  75          2HD1      ILE  75  -4.019   3.713  -3.267
  619    QG1  ILE  75           QG1      ILE  75  -3.550   3.330  -0.749
  620    QG2  ILE  75           QG2      ILE  75  -5.263   4.502   0.970
  621    QD1  ILE  75           QD1      ILE  75  -3.094   3.914  -2.895
  622    H    ASN  76           H        ASN  76  -8.211   5.014  -1.919
  623    HA   ASN  76           HA       ASN  76  -8.796   7.115   0.117
  624   1HB   ASN  76          1HB       ASN  76  -9.523   8.041  -2.068
  625   2HB   ASN  76          2HB       ASN  76 -10.411   6.545  -2.403
  626   1HD2  ASN  76          2HD2      ASN  76 -11.843   9.198   0.442
  627   2HD2  ASN  76          1HD2      ASN  76 -10.183   9.311  -0.082
  628    QB   ASN  76           QB       ASN  76  -9.967   7.293  -2.235
  629    QD2  ASN  76           QD2      ASN  76 -11.013   9.255   0.180
  630    H    THR  77           H        THR  77 -10.451   6.401   1.565
  631    HA   THR  77           HA       THR  77 -11.704   3.794   1.120
  632    HB   THR  77           HB       THR  77 -10.961   2.861   3.247
  633    HG1  THR  77          1HG       THR  77  -9.253   5.106   3.549
  634   1HG2  THR  77          1HG2      THR  77  -9.454   2.399   1.333
  635   2HG2  THR  77          2HG2      THR  77  -8.453   3.794   1.788
  636   3HG2  THR  77          3HG2      THR  77  -8.626   2.427   2.898
  637    QG2  THR  77           QG2      THR  77  -8.844   2.873   2.006
  638    H    GLY  78           H        GLY  78 -12.730   3.680   3.792
  639   1HA   GLY  78          1HA       GLY  78 -14.301   6.227   4.010
  640   2HA   GLY  78          2HA       GLY  78 -14.805   4.638   4.585
  641    QA   GLY  78           QA       GLY  78 -14.553   5.432   4.298
  642    H    PHE  79           H        PHE  79 -11.365   5.216   5.093
  643    HA   PHE  79           HA       PHE  79 -11.707   6.274   7.820
  644   1HB   PHE  79          1HB       PHE  79 -10.233   4.186   8.434
  645   2HB   PHE  79          2HB       PHE  79 -11.969   3.999   8.388
  646    HD1  PHE  79          1HD       PHE  79  -8.766   3.139   6.699
  647    HD2  PHE  79          2HD       PHE  79 -13.053   2.590   6.709
  648    HE1  PHE  79          1HE       PHE  79  -8.516   1.073   5.381
  649    HE2  PHE  79          2HE       PHE  79 -12.783   0.560   5.307
  650   1HZ   PHE  79           HZ       PHE  79 -10.509  -0.227   4.707
  651    QB   PHE  79           QB       PHE  79 -11.101   4.093   8.411
  652    QG   PHE  79           QD       PHE  79 -10.910   2.865   6.704
  653    QZ   PHE  79           QE       PHE  79 -10.649   0.817   5.344
  654    QZ   PHE  79           QR       PHE  79 -10.725   1.427   5.761
  655    H    TYR  80           H        TYR  80  -9.528   6.353   8.890
  656    HA   TYR  80           HA       TYR  80  -7.886   7.793   7.018
  657   1HB   TYR  80          1HB       TYR  80  -7.938   8.576   9.298
  658   2HB   TYR  80          2HB       TYR  80  -7.495   6.977   9.909
  659    HD1  TYR  80          1HD       TYR  80  -5.847   8.926   7.115
  660    HD2  TYR  80          2HD       TYR  80  -5.537   7.417  11.145
  661    HE1  TYR  80          1HE       TYR  80  -3.478   9.620   7.196
  662    HE2  TYR  80          2HE       TYR  80  -3.181   8.163  11.234
  663    HH   TYR  80           HH       TYR  80  -1.430   9.055  10.083
  664    QB   TYR  80           QB       TYR  80  -7.717   7.776   9.604
  665    QG   TYR  80           QD       TYR  80  -5.692   8.172   9.130
  666    QZ   TYR  80           QE       TYR  80  -3.330   8.891   9.215
  667    QR   TYR  80           QR       TYR  80  -4.511   8.532   9.172
  668    H    ILE  81           H        ILE  81  -6.024   6.851   6.017
  669    HA   ILE  81           HA       ILE  81  -5.846   3.928   6.249
  670    HB   ILE  81           HB       ILE  81  -4.209   4.391   4.273
  671   1HG1  ILE  81          1HG1      ILE  81  -4.739   6.970   4.552
  672   2HG1  ILE  81          2HG1      ILE  81  -4.662   6.276   2.973
  673   1HG2  ILE  81          1HG2      ILE  81  -7.253   4.222   4.227
  674   2HG2  ILE  81          2HG2      ILE  81  -6.221   3.884   2.824
  675   3HG2  ILE  81          3HG2      ILE  81  -6.104   2.886   4.265
  676   1HD1  ILE  81          3HD1      ILE  81  -7.319   6.641   4.417
  677   2HD1  ILE  81          1HD1      ILE  81  -6.615   7.770   3.254
  678   3HD1  ILE  81          2HD1      ILE  81  -7.070   6.127   2.756
  679    QG1  ILE  81           QG1      ILE  81  -4.700   6.623   3.762
  680    QG2  ILE  81           QG2      ILE  81  -6.526   3.664   3.772
  681    QD1  ILE  81           QD1      ILE  81  -7.002   6.846   3.476
  682    H    ARG  82           H        ARG  82  -4.130   3.020   7.242
  683    HA   ARG  82           HA       ARG  82  -2.113   4.887   8.430
  684   1HB   ARG  82          1HB       ARG  82  -4.478   4.144   9.597
  685   2HB   ARG  82          2HB       ARG  82  -3.489   2.753  10.061
  686   1HG   ARG  82          1HG       ARG  82  -3.146   5.685  10.725
  687   2HG   ARG  82          2HG       ARG  82  -3.456   4.329  11.827
  688   1HD   ARG  82          1HD       ARG  82  -1.135   3.433  11.061
  689   2HD   ARG  82          2HD       ARG  82  -0.930   5.039  10.325
  690    HE   ARG  82           HE       ARG  82  -1.676   4.898  13.188
  691   1HH1  ARG  82          2HH2      ARG  82   0.881   5.517  10.840
  692   2HH1  ARG  82          1HH2      ARG  82   2.098   5.922  11.978
  693   1HH2  ARG  82          2HH1      ARG  82  -0.250   5.548  14.720
  694   2HH2  ARG  82          1HH1      ARG  82   1.385   6.052  14.332
  695    QB   ARG  82           QB       ARG  82  -3.984   3.448   9.829
  696    QG   ARG  82           QG       ARG  82  -3.301   5.007  11.276
  697    QD   ARG  82           QD       ARG  82  -1.032   4.236  10.693
  698    QH1  ARG  82           QH2      ARG  82   1.489   5.719  11.409
  699    QH2  ARG  82           QH1      ARG  82   0.568   5.800  14.526
  700    H    SER  83           H        SER  83  -2.849   1.401   7.932
  701    HA   SER  83           HA       SER  83   0.132   1.039   7.977
  702   1HB   SER  83          1HB       SER  83  -1.573  -0.981   9.295
  703   2HB   SER  83          2HB       SER  83   0.155  -0.648   9.406
  704    HG   SER  83           HG       SER  83  -1.962   0.410  10.835
  705    QB   SER  83           QB       SER  83  -0.709  -0.815   9.351
  706    H    TYR  84           H        TYR  84   0.658  -1.379   7.146
  707    HA   TYR  84           HA       TYR  84  -1.295  -2.294   5.248
  708   1HB   TYR  84          1HB       TYR  84  -0.290  -1.709   3.239
  709   2HB   TYR  84          2HB       TYR  84  -0.255  -0.214   4.141
  710    HD1  TYR  84          2HD       TYR  84   2.192  -0.456   5.847
  711    HD2  TYR  84          1HD       TYR  84   1.519  -1.743   1.777
  712    HE1  TYR  84          2HE       TYR  84   4.618  -0.366   5.404
  713    HE2  TYR  84          1HE       TYR  84   3.927  -1.447   1.311
  714    HH   TYR  84           HH       TYR  84   5.861  -0.272   2.298
  715    QB   TYR  84           QB       TYR  84  -0.272  -0.961   3.690
  716    QG   TYR  84           QD       TYR  84   1.855  -1.100   3.812
  717    QZ   TYR  84           QE       TYR  84   4.272  -0.907   3.357
  718    QR   TYR  84           QR       TYR  84   3.064  -1.003   3.585
  719    H    ARG  85           H        ARG  85  -0.632  -4.092   3.939
  720    HA   ARG  85           HA       ARG  85   2.019  -5.236   4.403
  721   1HB   ARG  85          1HB       ARG  85   0.461  -6.079   6.225
  722   2HB   ARG  85          2HB       ARG  85  -0.524  -6.848   4.973
  723   1HG   ARG  85          1HG       ARG  85   2.411  -7.418   5.292
  724   2HG   ARG  85          2HG       ARG  85   1.169  -8.233   6.260
  725   1HD   ARG  85          1HD       ARG  85   0.252  -8.373   3.578
  726   2HD   ARG  85          2HD       ARG  85   2.003  -8.631   3.509
  727    HE   ARG  85           HE       ARG  85   0.441 -10.198   5.519
  728   1HH1  ARG  85          2HH2      ARG  85   1.712 -10.255   2.184
  729   2HH1  ARG  85          1HH2      ARG  85   1.501 -11.979   2.038
  730   1HH2  ARG  85          2HH1      ARG  85   0.091 -12.513   5.168
  731   2HH2  ARG  85          1HH1      ARG  85   1.056 -13.250   3.913
  732    QB   ARG  85           QB       ARG  85  -0.031  -6.463   5.599
  733    QG   ARG  85           QG       ARG  85   1.790  -7.826   5.776
  734    QD   ARG  85           QD       ARG  85   1.127  -8.502   3.543
  735    QH1  ARG  85           QH2      ARG  85   1.606 -11.117   2.111
  736    QH2  ARG  85           QH1      ARG  85   0.573 -12.882   4.540
  737    H    ARG  86           H        ARG  86   2.713  -6.066   2.407
  738    HA   ARG  86           HA       ARG  86   0.987  -5.876   0.081
  739   1HB   ARG  86          1HB       ARG  86   3.490  -5.588  -0.088
  740   2HB   ARG  86          2HB       ARG  86   3.666  -7.317   0.271
  741   1HG   ARG  86          1HG       ARG  86   1.950  -7.676  -1.676
  742   2HG   ARG  86          2HG       ARG  86   2.273  -6.012  -2.118
  743   1HD   ARG  86          1HD       ARG  86   4.634  -6.652  -2.636
  744   2HD   ARG  86          2HD       ARG  86   4.345  -8.235  -1.921
  745    HE   ARG  86           HE       ARG  86   2.314  -7.981  -3.774
  746   1HH1  ARG  86          2HH2      ARG  86   5.908  -8.218  -4.096
  747   2HH1  ARG  86          1HH2      ARG  86   5.662  -9.229  -5.496
  748   1HH2  ARG  86          2HH1      ARG  86   2.244  -9.026  -5.663
  749   2HH2  ARG  86          1HH1      ARG  86   3.632  -9.192  -6.708
  750    QB   ARG  86           QB       ARG  86   3.578  -6.452   0.092
  751    QG   ARG  86           QG       ARG  86   2.111  -6.844  -1.897
  752    QD   ARG  86           QD       ARG  86   4.489  -7.443  -2.278
  753    QH1  ARG  86           QH2      ARG  86   5.785  -8.724  -4.796
  754    QH2  ARG  86           QH1      ARG  86   2.938  -9.109  -6.185
  755    H    VAL  87           H        VAL  87  -0.609  -7.448  -0.352
  756    HA   VAL  87           HA       VAL  87  -0.560  -9.824   1.236
  757    HB   VAL  87           HB       VAL  87  -2.325  -7.823   0.433
  758   1HG1  VAL  87          2HG1      VAL  87  -3.335 -10.427  -0.663
  759   2HG1  VAL  87          3HG1      VAL  87  -4.325  -9.001  -0.282
  760   3HG1  VAL  87          1HG1      VAL  87  -3.066  -8.882  -1.515
  761   1HG2  VAL  87          1HG2      VAL  87  -1.995  -8.584   2.540
  762   2HG2  VAL  87          2HG2      VAL  87  -3.697  -8.782   2.068
  763   3HG2  VAL  87          3HG2      VAL  87  -2.620 -10.216   2.115
  764    QG1  VAL  87           QG1      VAL  87  -3.575  -9.437  -0.820
  765    QG2  VAL  87           QG2      VAL  87  -2.770  -9.194   2.241
  766    QQG  VAL  87           QQG      VAL  87  -3.173  -9.315   0.710
  767    H    GLU  88           H        GLU  88  -0.473  -8.824  -2.229
  768    HA   GLU  88           HA       GLU  88   0.602 -11.394  -2.936
  769   1HB   GLU  88          1HB       GLU  88  -1.083 -12.025  -4.525
  770   2HB   GLU  88          2HB       GLU  88  -1.783 -11.952  -2.909
  771   1HG   GLU  88          1HG       GLU  88  -2.777  -9.727  -3.488
  772   2HG   GLU  88          2HG       GLU  88  -2.152  -9.901  -5.132
  773    QB   GLU  88           QB       GLU  88  -1.433 -11.988  -3.717
  774    QG   GLU  88           QG       GLU  88  -2.464  -9.814  -4.310
   
  No H/Q in entry =         774
  Start of MODEL   18
    1   1HA   GLY   1          1HA       GLY   1   7.222  -8.554 -14.033
    2   2HA   GLY   1          2HA       GLY   1   8.832  -8.645 -13.330
    3    QA   GLY   1           QA       GLY   1   8.027  -8.599 -13.681
    4    H    ASP   2           H        ASP   2  10.253  -6.936 -13.532
    5    HA   ASP   2           HA       ASP   2  10.869  -4.797 -13.376
    6   1HB   ASP   2          1HB       ASP   2   9.365  -4.579 -15.982
    7   2HB   ASP   2          2HB       ASP   2  10.232  -3.259 -15.194
    8    QB   ASP   2           QB       ASP   2   9.798  -3.919 -15.588
    9    H    GLY   3           H        GLY   3   9.366  -4.993 -11.400
   10   1HA   GLY   3          1HA       GLY   3   8.612  -2.293 -11.218
   11   2HA   GLY   3          2HA       GLY   3   7.153  -3.287 -11.069
   12    QA   GLY   3           QA       GLY   3   7.882  -2.790 -11.143
   13    H    TYR   4           H        TYR   4   8.096  -1.596  -8.961
   14    HA   TYR   4           HA       TYR   4   8.683  -3.652  -6.863
   15   1HB   TYR   4          1HB       TYR   4   9.482  -1.686  -5.463
   16   2HB   TYR   4          2HB       TYR   4  10.489  -2.133  -6.808
   17    HD1  TYR   4          1HD       TYR   4   7.605   0.224  -6.135
   18    HD2  TYR   4          2HD       TYR   4  11.524  -0.291  -7.867
   19    HE1  TYR   4          1HE       TYR   4   7.627   2.572  -6.755
   20    HE2  TYR   4          2HE       TYR   4  11.544   2.101  -8.469
   21    HH   TYR   4           HH       TYR   4  10.314   4.140  -8.423
   22    QB   TYR   4           QB       TYR   4   9.985  -1.910  -6.136
   23    QG   TYR   4           QD       TYR   4   9.564  -0.034  -7.001
   24    QZ   TYR   4           QE       TYR   4   9.586   2.337  -7.612
   25    QR   TYR   4           QR       TYR   4   9.575   1.152  -7.306
   26    H    LEU   5           H        LEU   5   7.768  -2.458  -4.691
   27    HA   LEU   5           HA       LEU   5   5.261  -0.987  -5.181
   28   1HB   LEU   5          1HB       LEU   5   4.774  -3.443  -5.038
   29   2HB   LEU   5          2HB       LEU   5   5.413  -3.454  -3.395
   30    HG   LEU   5           HG       LEU   5   3.218  -1.498  -4.081
   31   1HD1  LEU   5          1HD1      LEU   5   2.764  -4.478  -3.627
   32   2HD1  LEU   5          2HD1      LEU   5   1.496  -3.249  -3.666
   33   3HD1  LEU   5          3HD1      LEU   5   2.439  -3.576  -5.127
   34   1HD2  LEU   5          1HD2      LEU   5   3.832  -3.218  -1.629
   35   2HD2  LEU   5          2HD2      LEU   5   4.093  -1.465  -1.780
   36   3HD2  LEU   5          3HD2      LEU   5   2.454  -2.123  -1.770
   37    QB   LEU   5           QB       LEU   5   5.094  -3.449  -4.216
   38    QD1  LEU   5           QD1      LEU   5   2.233  -3.768  -4.140
   39    QD2  LEU   5           QD2      LEU   5   3.459  -2.269  -1.727
   40    QQD  LEU   5           QQD      LEU   5   2.846  -3.018  -2.933
   41    H    ILE   6           H        ILE   6   5.517   0.888  -3.984
   42    HA   ILE   6           HA       ILE   6   6.487   0.656  -1.212
   43    HB   ILE   6           HB       ILE   6   7.679   2.951  -1.669
   44   1HG1  ILE   6          1HG1      ILE   6   8.357   1.699  -4.309
   45   2HG1  ILE   6          2HG1      ILE   6   6.999   2.838  -4.211
   46   1HG2  ILE   6          1HG2      ILE   6   8.765   0.986  -0.786
   47   2HG2  ILE   6          2HG2      ILE   6   8.978   0.309  -2.418
   48   3HG2  ILE   6          3HG2      ILE   6   9.803   1.800  -1.979
   49   1HD1  ILE   6          2HD1      ILE   6   9.718   3.615  -3.091
   50   2HD1  ILE   6          3HD1      ILE   6   9.325   3.815  -4.806
   51   3HD1  ILE   6          1HD1      ILE   6   8.369   4.624  -3.571
   52    QG1  ILE   6           QG1      ILE   6   7.678   2.268  -4.260
   53    QG2  ILE   6           QG2      ILE   6   9.182   1.032  -1.727
   54    QD1  ILE   6           QD1      ILE   6   9.137   4.018  -3.823
   55    H    MET   7           H        MET   7   6.093   2.714  -0.041
   56    HA   MET   7           HA       MET   7   3.577   3.992  -0.946
   57   1HB   MET   7          1HB       MET   7   2.941   4.289   1.286
   58   2HB   MET   7          2HB       MET   7   3.384   2.589   1.086
   59   1HG   MET   7          1HG       MET   7   5.734   3.382   2.023
   60   2HG   MET   7          2HG       MET   7   4.795   4.766   2.604
   61   1HE   MET   7          1HE       MET   7   2.614   4.439   4.169
   62   2HE   MET   7          2HE       MET   7   1.964   3.140   3.134
   63   3HE   MET   7          3HE       MET   7   2.150   2.881   4.876
   64    QB   MET   7           QB       MET   7   3.162   3.439   1.186
   65    QG   MET   7           QG       MET   7   5.265   4.074   2.313
   66    QE   MET   7           QE       MET   7   2.243   3.487   4.060
   67    H    CYS   8           H        CYS   8   3.513   6.203  -0.890
   68    HA   CYS   8           HA       CYS   8   6.124   7.611  -0.709
   69   1HB   CYS   8          1HB       CYS   8   4.163   7.404  -3.022
   70   2HB   CYS   8          2HB       CYS   8   5.397   8.657  -2.935
   71    QB   CYS   8           QB       CYS   8   4.780   8.031  -2.978
   72    H    LYS   9           H        LYS   9   5.898   9.934  -0.683
   73    HA   LYS   9           HA       LYS   9   3.571  10.785   0.795
   74   1HB   LYS   9          1HB       LYS   9   6.092  12.189  -0.130
   75   2HB   LYS   9          2HB       LYS   9   4.816  12.906   0.874
   76   1HG   LYS   9          1HG       LYS   9   5.158  11.051   2.529
   77   2HG   LYS   9          2HG       LYS   9   6.521  10.467   1.538
   78   1HD   LYS   9          1HD       LYS   9   7.403  12.913   1.777
   79   2HD   LYS   9          2HD       LYS   9   6.225  13.067   3.076
   80   1HE   LYS   9          1HE       LYS   9   8.691  11.274   2.939
   81   2HE   LYS   9          2HE       LYS   9   8.257  12.476   4.162
   82   1HZ   LYS   9          1HZ       LYS   9   6.460  10.989   4.831
   83   2HZ   LYS   9          2HZ       LYS   9   7.057   9.804   3.798
   84   3HZ   LYS   9          3HZ       LYS   9   7.923  10.367   5.065
   85    QB   LYS   9           QB       LYS   9   5.454  12.547   0.372
   86    QG   LYS   9           QG       LYS   9   5.839  10.759   2.033
   87    QD   LYS   9           QD       LYS   9   6.814  12.990   2.426
   88    QE   LYS   9           QE       LYS   9   8.474  11.875   3.551
   89    QZ   LYS   9           QZ       LYS   9   7.147  10.387   4.565
   90    H    ASN  10           H        ASN  10   4.122  10.527  -2.496
   91    HA   ASN  10           HA       ASN  10   1.731  11.906  -3.158
   92   1HB   ASN  10          1HB       ASN  10   2.588  13.555  -4.758
   93   2HB   ASN  10          2HB       ASN  10   3.048  13.912  -3.133
   94   1HD2  ASN  10          2HD2      ASN  10   6.275  14.561  -4.264
   95   2HD2  ASN  10          1HD2      ASN  10   4.763  15.278  -3.739
   96    QB   ASN  10           QB       ASN  10   2.818  13.733  -3.946
   97    QD2  ASN  10           QD2      ASN  10   5.519  14.920  -4.002
   98    H    CYS  11           H        CYS  11   1.992  12.069  -5.900
   99    HA   CYS  11           HA       CYS  11   1.994   9.207  -6.480
  100   1HB   CYS  11          1HB       CYS  11   0.157  10.851  -7.015
  101   2HB   CYS  11          2HB       CYS  11   1.254  11.663  -8.129
  102    QB   CYS  11           QB       CYS  11   0.705  11.257  -7.572
  103    H    ASP  12           H        ASP  12   4.444  11.376  -6.430
  104    HA   ASP  12           HA       ASP  12   5.651  10.400  -9.008
  105   1HB   ASP  12          1HB       ASP  12   4.887  12.700  -9.140
  106   2HB   ASP  12          2HB       ASP  12   5.921  13.125  -7.749
  107    QB   ASP  12           QB       ASP  12   5.404  12.913  -8.444
  108    HA   PRO  13           HA       PRO  13   8.638   9.099  -5.760
  109   1HB   PRO  13          1HB       PRO  13  10.375   7.700  -7.346
  110   2HB   PRO  13          2HB       PRO  13   8.824   7.034  -6.768
  111   1HG   PRO  13          1HG       PRO  13   9.377   8.363  -9.439
  112   2HG   PRO  13          2HG       PRO  13   8.565   6.800  -9.165
  113   1HD   PRO  13          1HD       PRO  13   7.164   9.046  -9.571
  114   2HD   PRO  13          2HD       PRO  13   6.587   7.897  -8.330
  115    QB   PRO  13           QB       PRO  13   9.600   7.367  -7.057
  116    QG   PRO  13           QG       PRO  13   8.971   7.582  -9.302
  117    QD   PRO  13           QD       PRO  13   6.875   8.471  -8.950
  118    H    ASN  14           H        ASN  14   9.119  10.935  -8.776
  119    HA   ASN  14           HA       ASN  14  11.896  11.507  -8.347
  120   1HB   ASN  14          1HB       ASN  14  10.623  11.822 -10.483
  121   2HB   ASN  14          2HB       ASN  14   9.841  13.246  -9.777
  122   1HD2  ASN  14          2HD2      ASN  14  12.616  15.320 -10.548
  123   2HD2  ASN  14          1HD2      ASN  14  10.934  15.257 -10.109
  124    QB   ASN  14           QB       ASN  14  10.232  12.534 -10.130
  125    QD2  ASN  14           QD2      ASN  14  11.775  15.288 -10.328
  126    H    THR  15           H        THR  15   8.918  12.771  -6.934
  127    HA   THR  15           HA       THR  15  10.524  14.573  -5.228
  128    HB   THR  15           HB       THR  15   9.887  15.955  -7.053
  129    HG1  THR  15          1HG       THR  15   9.844  17.066  -5.249
  130   1HG2  THR  15          3HG2      THR  15   7.038  15.026  -6.587
  131   2HG2  THR  15          1HG2      THR  15   7.495  16.421  -7.610
  132   3HG2  THR  15          2HG2      THR  15   8.048  14.799  -8.016
  133    QG2  THR  15           QG2      THR  15   7.527  15.415  -7.404
  134    H    GLY  16           H        GLY  16   8.876  11.939  -5.060
  135   1HA   GLY  16          1HA       GLY  16   7.664  12.724  -2.459
  136   2HA   GLY  16          2HA       GLY  16   7.239  11.276  -3.346
  137    QA   GLY  16           QA       GLY  16   7.451  12.000  -2.903
  138    H    SER  17           H        SER  17   8.888  12.254  -0.803
  139    HA   SER  17           HA       SER  17  11.231  10.498  -0.890
  140   1HB   SER  17          1HB       SER  17  10.949  11.119   1.680
  141   2HB   SER  17          2HB       SER  17  11.625  12.242   0.488
  142    HG   SER  17           HG       SER  17   9.939  13.198   1.812
  143    QB   SER  17           QB       SER  17  11.287  11.681   1.084
  144    H    CYS  18           H        CYS  18  10.552   8.407  -1.240
  145    HA   CYS  18           HA       CYS  18   8.073   7.414   0.027
  146   1HB   CYS  18          1HB       CYS  18   9.916   6.209  -2.060
  147   2HB   CYS  18          2HB       CYS  18   8.347   5.605  -1.574
  148    QB   CYS  18           QB       CYS  18   9.132   5.907  -1.817
  149    H    ASP  19           H        ASP  19   8.128   5.484   1.350
  150    HA   ASP  19           HA       ASP  19  10.807   4.941   2.515
  151   1HB   ASP  19          1HB       ASP  19   9.578   3.888   4.323
  152   2HB   ASP  19          2HB       ASP  19   9.454   5.644   4.122
  153    QB   ASP  19           QB       ASP  19   9.516   4.766   4.222
  154    H    TRP  20           H        TRP  20  11.820   3.640   1.290
  155    HA   TRP  20           HA       TRP  20  10.813   1.391  -0.223
  156   1HB   TRP  20          1HB       TRP  20  13.602   2.482   0.223
  157   2HB   TRP  20          2HB       TRP  20  13.091   1.322  -1.003
  158    HD1  TRP  20           HD       TRP  20  12.672   5.054  -0.177
  159    HE1  TRP  20          1HE       TRP  20  12.337   6.347  -2.325
  160    HE3  TRP  20          3HE       TRP  20  12.179   1.103  -3.293
  161    HZ2  TRP  20          2HZ       TRP  20  12.050   5.722  -5.161
  162    HZ3  TRP  20          3HZ       TRP  20  12.078   1.453  -5.751
  163    HH2  TRP  20           HH       TRP  20  11.980   3.765  -6.682
  164    QB   TRP  20           QB       TRP  20  13.346   1.902  -0.390
  165    H    LYS  21           H        LYS  21  10.312   0.963   2.418
  166    HA   LYS  21           HA       LYS  21  12.268  -1.117   3.235
  167   1HB   LYS  21          1HB       LYS  21  10.595   0.845   4.640
  168   2HB   LYS  21          2HB       LYS  21  10.294  -0.785   5.222
  169   1HG   LYS  21          1HG       LYS  21  13.089   0.382   4.919
  170   2HG   LYS  21          2HG       LYS  21  12.120   0.528   6.397
  171   1HD   LYS  21          1HD       LYS  21  11.866  -1.967   6.438
  172   2HD   LYS  21          2HD       LYS  21  13.046  -2.068   5.106
  173   1HE   LYS  21          1HE       LYS  21  14.769  -1.005   6.504
  174   2HE   LYS  21          2HE       LYS  21  13.590  -0.735   7.799
  175   1HZ   LYS  21          1HZ       LYS  21  14.286  -3.427   6.820
  176   2HZ   LYS  21          2HZ       LYS  21  15.044  -2.715   8.106
  177   3HZ   LYS  21          3HZ       LYS  21  13.431  -3.039   8.143
  178    QB   LYS  21           QB       LYS  21  10.445   0.030   4.931
  179    QG   LYS  21           QG       LYS  21  12.604   0.455   5.658
  180    QD   LYS  21           QD       LYS  21  12.456  -2.018   5.772
  181    QE   LYS  21           QE       LYS  21  14.180  -0.870   7.152
  182    QZ   LYS  21           QZ       LYS  21  14.254  -3.060   7.689
  183    H    GLN  22           H        GLN  22  11.084  -2.932   4.407
  184    HA   GLN  22           HA       GLN  22   9.891  -4.476   2.367
  185   1HB   GLN  22          1HB       GLN  22  11.291  -5.110   4.450
  186   2HB   GLN  22          2HB       GLN  22   9.765  -5.040   5.343
  187   1HG   GLN  22          1HG       GLN  22   8.907  -6.856   3.797
  188   2HG   GLN  22          2HG       GLN  22  10.514  -6.872   3.046
  189   1HE2  GLN  22          2HE2      GLN  22   9.975  -8.270   6.945
  190   2HE2  GLN  22          1HE2      GLN  22   8.686  -7.524   6.023
  191    QB   GLN  22           QB       GLN  22  10.528  -5.075   4.897
  192    QG   GLN  22           QG       GLN  22   9.710  -6.864   3.422
  193    QE2  GLN  22           QE2      GLN  22   9.330  -7.897   6.484
  194    H    ASN  23           H        ASN  23   7.845  -5.131   2.099
  195    HA   ASN  23           HA       ASN  23   5.615  -3.661   3.488
  196   1HB   ASN  23          1HB       ASN  23   5.131  -5.104   0.935
  197   2HB   ASN  23          2HB       ASN  23   4.425  -3.598   1.510
  198   1HD2  ASN  23          2HD2      ASN  23   6.600  -1.753  -0.602
  199   2HD2  ASN  23          1HD2      ASN  23   5.427  -1.572   0.674
  200    QB   ASN  23           QB       ASN  23   4.778  -4.351   1.223
  201    QD2  ASN  23           QD2      ASN  23   6.014  -1.662   0.036
  202    H    TRP  24           H        TRP  24   6.973  -6.814   2.761
  203    HA   TRP  24           HA       TRP  24   4.550  -8.362   3.246
  204   1HB   TRP  24          1HB       TRP  24   7.408  -8.812   2.289
  205   2HB   TRP  24          2HB       TRP  24   6.549 -10.129   3.059
  206    HD1  TRP  24           HD       TRP  24   7.032  -8.730  -0.257
  207    HE1  TRP  24          1HE       TRP  24   5.374  -9.709  -1.935
  208    HE3  TRP  24          3HE       TRP  24   3.737 -10.900   3.027
  209    HZ2  TRP  24          2HZ       TRP  24   2.956 -11.215  -1.873
  210    HZ3  TRP  24          3HZ       TRP  24   1.750 -12.104   2.158
  211    HH2  TRP  24           HH       TRP  24   1.317 -12.213  -0.278
  212    QB   TRP  24           QB       TRP  24   6.979  -9.470   2.674
  213    H    ASN  25           H        ASN  25   4.339  -9.518   4.995
  214    HA   ASN  25           HA       ASN  25   4.361  -9.993   7.286
  215   1HB   ASN  25          1HB       ASN  25   7.130 -10.794   6.313
  216   2HB   ASN  25          2HB       ASN  25   6.449 -11.242   7.885
  217   1HD2  ASN  25          2HD2      ASN  25   5.613 -14.229   6.179
  218   2HD2  ASN  25          1HD2      ASN  25   6.957 -13.396   6.947
  219    QB   ASN  25           QB       ASN  25   6.789 -11.018   7.099
  220    QD2  ASN  25           QD2      ASN  25   6.285 -13.812   6.563
  221    H    THR  26           H        THR  26   4.615  -7.283   7.046
  222    HA   THR  26           HA       THR  26   5.457  -6.791   9.670
  223    HB   THR  26           HB       THR  26   7.685  -6.521   8.837
  224    HG1  THR  26          1HG       THR  26   7.963  -4.282   9.422
  225   1HG2  THR  26          3HG2      THR  26   7.155  -5.868   6.430
  226   2HG2  THR  26          1HG2      THR  26   6.688  -4.274   7.023
  227   3HG2  THR  26          2HG2      THR  26   8.356  -4.842   7.216
  228    QG2  THR  26           QG2      THR  26   7.400  -4.995   6.890
  229    H    CYS  27           H        CYS  27   4.538  -4.777  10.306
  230    HA   CYS  27           HA       CYS  27   2.355  -4.090   8.528
  231   1HB   CYS  27          1HB       CYS  27   1.704  -5.558  10.250
  232   2HB   CYS  27          2HB       CYS  27   2.215  -4.424  11.518
  233    QB   CYS  27           QB       CYS  27   1.960  -4.991  10.884
  234    H    VAL  28           H        VAL  28   3.188  -2.263   7.627
  235    HA   VAL  28           HA       VAL  28   4.613  -0.333   9.280
  236    HB   VAL  28           HB       VAL  28   4.052  -0.640   6.325
  237   1HG1  VAL  28          3HG1      VAL  28   5.766   1.456   7.689
  238   2HG1  VAL  28          1HG1      VAL  28   5.838   1.054   5.959
  239   3HG1  VAL  28          2HG1      VAL  28   4.352   1.708   6.636
  240   1HG2  VAL  28          2HG2      VAL  28   5.564  -2.334   7.321
  241   2HG2  VAL  28          3HG2      VAL  28   6.414  -1.267   6.198
  242   3HG2  VAL  28          1HG2      VAL  28   6.585  -1.036   7.958
  243    QG1  VAL  28           QG1      VAL  28   5.319   1.406   6.761
  244    QG2  VAL  28           QG2      VAL  28   6.188  -1.546   7.159
  245    QQG  VAL  28           QQG      VAL  28   5.753  -0.070   6.960
  246    H    GLY  29           H        GLY  29   4.122   1.920   9.270
  247   1HA   GLY  29          1HA       GLY  29   1.319   2.436   9.661
  248   2HA   GLY  29          2HA       GLY  29   2.662   3.507  10.043
  249    QA   GLY  29           QA       GLY  29   1.990   2.972   9.852
  250    H    ILE  30           H        ILE  30   0.222   4.180   8.671
  251    HA   ILE  30           HA       ILE  30   1.219   5.362   6.108
  252    HB   ILE  30           HB       ILE  30  -1.597   4.692   7.064
  253   1HG1  ILE  30          1HG1      ILE  30  -0.139   3.482   4.691
  254   2HG1  ILE  30          2HG1      ILE  30  -0.164   2.727   6.292
  255   1HG2  ILE  30          3HG2      ILE  30  -0.701   5.956   4.446
  256   2HG2  ILE  30          1HG2      ILE  30  -2.336   5.349   4.755
  257   3HG2  ILE  30          2HG2      ILE  30  -1.747   6.692   5.689
  258   1HD1  ILE  30          1HD1      ILE  30  -2.664   2.692   6.215
  259   2HD1  ILE  30          2HD1      ILE  30  -2.571   3.202   4.513
  260   3HD1  ILE  30          3HD1      ILE  30  -1.840   1.681   5.016
  261    QG1  ILE  30           QG1      ILE  30  -0.152   3.105   5.491
  262    QG2  ILE  30           QG2      ILE  30  -1.595   5.999   4.963
  263    QD1  ILE  30           QD1      ILE  30  -2.358   2.525   5.248
  264    H    GLY  31           H        GLY  31   0.272   7.620   5.853
  265   1HA   GLY  31          1HA       GLY  31  -1.056   9.312   6.770
  266   2HA   GLY  31          2HA       GLY  31  -0.541   8.920   8.418
  267    QA   GLY  31           QA       GLY  31  -0.799   9.116   7.594
  268    H    ALA  32           H        ALA  32  -0.594  11.415   7.583
  269    HA   ALA  32           HA       ALA  32   0.418  13.353   7.389
  270   1HB   ALA  32          3HB       ALA  32   1.681  12.629   9.376
  271   2HB   ALA  32          1HB       ALA  32   2.942  11.929   8.328
  272   3HB   ALA  32          2HB       ALA  32   2.650  13.682   8.318
  273    QB   ALA  32           QB       ALA  32   2.424  12.747   8.674
  274    H    ASN  33           H        ASN  33  -0.024  13.449   5.266
  275    HA   ASN  33           HA       ASN  33   0.335  13.798   3.092
  276   1HB   ASN  33          1HB       ASN  33   3.332  13.826   3.658
  277   2HB   ASN  33          2HB       ASN  33   2.494  14.489   2.259
  278   1HD2  ASN  33          2HD2      ASN  33   3.229  17.387   4.397
  279   2HD2  ASN  33          1HD2      ASN  33   4.139  16.264   3.414
  280    QB   ASN  33           QB       ASN  33   2.913  14.157   2.959
  281    QD2  ASN  33           QD2      ASN  33   3.684  16.826   3.906
  282    H    VAL  34           H        VAL  34   1.027  10.957   4.524
  283    HA   VAL  34           HA       VAL  34   2.065   9.629   2.035
  284    HB   VAL  34           HB       VAL  34   1.883   8.653   4.892
  285   1HG1  VAL  34          3HG1      VAL  34   2.878   7.272   2.356
  286   2HG1  VAL  34          1HG1      VAL  34   3.163   6.692   4.007
  287   3HG1  VAL  34          2HG1      VAL  34   1.516   6.756   3.374
  288   1HG2  VAL  34          1HG2      VAL  34   3.729  10.335   4.289
  289   2HG2  VAL  34          2HG2      VAL  34   4.292   8.780   4.879
  290   3HG2  VAL  34          3HG2      VAL  34   4.322   9.106   3.143
  291    QG1  VAL  34           QG1      VAL  34   2.519   6.907   3.246
  292    QG2  VAL  34           QG2      VAL  34   4.114   9.407   4.104
  293    QQG  VAL  34           QQG      VAL  34   3.316   8.157   3.675
  294    H    HIS  35           H        HIS  35   0.306   9.497   0.756
  295    HA   HIS  35           HA       HIS  35  -1.844   7.677   1.596
  296   1HB   HIS  35          1HB       HIS  35  -3.605   9.108   0.833
  297   2HB   HIS  35          2HB       HIS  35  -2.803   9.825   2.233
  298    HD1  HIS  35          1HD       HIS  35  -4.522  11.138  -0.465
  299    HD2  HIS  35          2HD       HIS  35  -0.580  11.633   0.915
  300    HE1  HIS  35          1HE       HIS  35  -3.701  13.347  -1.388
  301    QB   HIS  35           QB       HIS  35  -3.204   9.466   1.533
  302    H    TRP  36           H        TRP  36   0.447   7.425  -0.190
  303    HA   TRP  36           HA       TRP  36  -1.052   6.740  -2.657
  304   1HB   TRP  36          1HB       TRP  36   1.540   8.313  -2.579
  305   2HB   TRP  36          2HB       TRP  36   0.761   7.665  -4.015
  306    HD1  TRP  36           HD       TRP  36   0.227  10.361  -1.330
  307    HE1  TRP  36          1HE       TRP  36  -1.255  12.195  -2.242
  308    HE3  TRP  36          3HE       TRP  36  -1.166   8.102  -5.691
  309    HZ2  TRP  36          2HZ       TRP  36  -2.867  12.663  -4.637
  310    HZ3  TRP  36          3HZ       TRP  36  -2.717   9.241  -7.254
  311    HH2  TRP  36           HH       TRP  36  -3.558  11.532  -6.736
  312    QB   TRP  36           QB       TRP  36   1.150   7.989  -3.297
  313    H    MET  37           H        MET  37  -0.647   4.679  -3.008
  314    HA   MET  37           HA       MET  37   2.039   3.523  -2.402
  315   1HB   MET  37          1HB       MET  37   0.118   2.093  -1.930
  316   2HB   MET  37          2HB       MET  37  -0.433   2.243  -3.620
  317   1HG   MET  37          1HG       MET  37   1.798   1.237  -4.314
  318   2HG   MET  37          2HG       MET  37   2.153   0.994  -2.599
  319   1HE   MET  37          3HE       MET  37   0.610  -0.542  -1.031
  320   2HE   MET  37          1HE       MET  37  -0.948   0.075  -1.646
  321   3HE   MET  37          2HE       MET  37  -0.613  -1.666  -1.671
  322    QB   MET  37           QB       MET  37  -0.157   2.168  -2.775
  323    QG   MET  37           QG       MET  37   1.976   1.116  -3.456
  324    QE   MET  37           QE       MET  37  -0.317  -0.711  -1.449
  325    H    VAL  38           H        VAL  38   3.494   3.276  -4.129
  326    HA   VAL  38           HA       VAL  38   2.491   3.715  -6.853
  327    HB   VAL  38           HB       VAL  38   5.039   5.109  -5.966
  328   1HG1  VAL  38          3HG1      VAL  38   4.770   4.583  -8.408
  329   2HG1  VAL  38          1HG1      VAL  38   3.213   5.420  -8.409
  330   3HG1  VAL  38          2HG1      VAL  38   4.702   6.326  -8.110
  331   1HG2  VAL  38          3HG2      VAL  38   2.280   6.381  -6.305
  332   2HG2  VAL  38          1HG2      VAL  38   3.181   6.257  -4.780
  333   3HG2  VAL  38          2HG2      VAL  38   3.808   7.254  -6.091
  334    QG1  VAL  38           QG1      VAL  38   4.228   5.443  -8.309
  335    QG2  VAL  38           QG2      VAL  38   3.090   6.631  -5.725
  336    QQG  VAL  38           QQG      VAL  38   3.659   6.037  -7.017
  337    H    THR  39           H        THR  39   3.821   2.614  -8.390
  338    HA   THR  39           HA       THR  39   5.436   0.415  -7.161
  339    HB   THR  39           HB       THR  39   4.251  -1.061  -8.736
  340    HG1  THR  39          1HG       THR  39   2.483   1.145  -9.140
  341   1HG2  THR  39          3HG2      THR  39   3.300  -1.041  -6.507
  342   2HG2  THR  39          1HG2      THR  39   2.232   0.320  -6.937
  343   3HG2  THR  39          2HG2      THR  39   2.054  -1.253  -7.735
  344    QG2  THR  39           QG2      THR  39   2.529  -0.658  -7.060
  345    H    GLY  40           H        GLY  40   6.302  -0.910  -9.198
  346   1HA   GLY  40          1HA       GLY  40   6.832  -0.941 -11.515
  347   2HA   GLY  40          2HA       GLY  40   6.654   0.811 -11.592
  348    QA   GLY  40           QA       GLY  40   6.743  -0.065 -11.554
  349    H    GLY  41           H        GLY  41   8.509   1.001 -12.778
  350   1HA   GLY  41          1HA       GLY  41  10.756   1.342 -13.121
  351   2HA   GLY  41          2HA       GLY  41  10.593   2.195 -11.581
  352    QA   GLY  41           QA       GLY  41  10.674   1.769 -12.351
  353    H    SER  42           H        SER  42  10.737  -1.271 -12.523
  354    HA   SER  42           HA       SER  42  13.161  -1.623 -10.804
  355   1HB   SER  42          1HB       SER  42  10.900  -1.967  -9.469
  356   2HB   SER  42          2HB       SER  42  10.800  -3.415 -10.479
  357    HG   SER  42           HG       SER  42  12.734  -2.782  -8.533
  358    QB   SER  42           QB       SER  42  10.850  -2.691  -9.974
  359    H    THR  43           H        THR  43  12.794  -4.453 -10.692
  360    HA   THR  43           HA       THR  43  13.486  -5.232 -13.482
  361    HB   THR  43           HB       THR  43  15.482  -4.935 -12.224
  362    HG1  THR  43          1HG       THR  43  15.189  -7.723 -12.254
  363   1HG2  THR  43          1HG2      THR  43  14.325  -6.863 -10.157
  364   2HG2  THR  43          2HG2      THR  43  16.020  -6.412 -10.260
  365   3HG2  THR  43          3HG2      THR  43  14.809  -5.173  -9.912
  366    QG2  THR  43           QG2      THR  43  15.051  -6.149 -10.110
  367    H    ASP  44           H        ASP  44  12.136  -6.293 -10.262
  368    HA   ASP  44           HA       ASP  44  10.263  -7.928 -11.753
  369   1HB   ASP  44          1HB       ASP  44  12.574  -9.166 -10.567
  370   2HB   ASP  44          2HB       ASP  44  11.188  -9.544  -9.544
  371    QB   ASP  44           QB       ASP  44  11.881  -9.355 -10.055
  372    H    GLY  45           H        GLY  45   8.367  -7.840 -10.841
  373   1HA   GLY  45          1HA       GLY  45   7.326  -8.019  -8.460
  374   2HA   GLY  45          2HA       GLY  45   7.951  -6.394  -8.288
  375    QA   GLY  45           QA       GLY  45   7.638  -7.206  -8.374
  376    H    LYS  46           H        LYS  46   6.100  -8.496 -10.325
  377    HA   LYS  46           HA       LYS  46   4.620  -6.617 -11.838
  378   1HB   LYS  46          1HB       LYS  46   3.121  -8.402 -12.356
  379   2HB   LYS  46          2HB       LYS  46   4.847  -8.835 -12.500
  380   1HG   LYS  46          1HG       LYS  46   4.740 -10.015 -10.424
  381   2HG   LYS  46          2HG       LYS  46   3.114  -9.388 -10.090
  382   1HD   LYS  46          1HD       LYS  46   3.135 -11.761 -10.908
  383   2HD   LYS  46          2HD       LYS  46   2.119 -10.691 -11.878
  384   1HE   LYS  46          1HE       LYS  46   5.019 -11.285 -12.662
  385   2HE   LYS  46          2HE       LYS  46   3.718 -12.404 -13.057
  386   1HZ   LYS  46          2HZ       LYS  46   3.779  -9.592 -14.038
  387   2HZ   LYS  46          3HZ       LYS  46   4.214 -10.917 -14.849
  388   3HZ   LYS  46          1HZ       LYS  46   2.668 -10.737 -14.407
  389    QB   LYS  46           QB       LYS  46   3.984  -8.619 -12.428
  390    QG   LYS  46           QG       LYS  46   3.927  -9.702 -10.257
  391    QD   LYS  46           QD       LYS  46   2.627 -11.226 -11.393
  392    QE   LYS  46           QE       LYS  46   4.368 -11.844 -12.860
  393    QZ   LYS  46           QZ       LYS  46   3.554 -10.415 -14.431
  394    H    GLN  47           H        GLN  47   1.947  -6.833 -11.602
  395    HA   GLN  47           HA       GLN  47   1.100  -5.041  -9.795
  396   1HB   GLN  47          1HB       GLN  47  -1.137  -6.054 -10.077
  397   2HB   GLN  47          2HB       GLN  47  -0.231  -6.019 -11.603
  398   1HG   GLN  47          1HG       GLN  47   0.432  -8.480 -11.076
  399   2HG   GLN  47          2HG       GLN  47  -0.830  -8.418  -9.840
  400   1HE2  GLN  47          2HE2      GLN  47  -2.709  -9.844 -12.560
  401   2HE2  GLN  47          1HE2      GLN  47  -1.724 -10.236 -11.156
  402    QB   GLN  47           QB       GLN  47  -0.684  -6.036 -10.840
  403    QG   GLN  47           QG       GLN  47  -0.199  -8.449 -10.458
  404    QE2  GLN  47           QE2      GLN  47  -2.216 -10.040 -11.858
  405    H    GLY  48           H        GLY  48   0.258  -4.925  -7.720
  406   1HA   GLY  48          1HA       GLY  48   0.621  -7.310  -5.960
  407   2HA   GLY  48          2HA       GLY  48   1.596  -5.853  -5.680
  408    QA   GLY  48           QA       GLY  48   1.109  -6.581  -5.820
  409    H    CYS  49           H        CYS  49  -0.196  -6.993  -3.794
  410    HA   CYS  49           HA       CYS  49  -2.276  -4.901  -3.550
  411   1HB   CYS  49          1HB       CYS  49  -2.590  -7.882  -3.118
  412   2HB   CYS  49          2HB       CYS  49  -3.793  -6.715  -2.667
  413    QB   CYS  49           QB       CYS  49  -3.191  -7.298  -2.893
  414    H    ALA  50           H        ALA  50  -3.026  -4.619  -1.516
  415    HA   ALA  50           HA       ALA  50  -1.450  -5.776   0.740
  416   1HB   ALA  50          3HB       ALA  50  -2.045  -2.818   0.250
  417   2HB   ALA  50          1HB       ALA  50  -1.529  -3.492   1.801
  418   3HB   ALA  50          2HB       ALA  50  -0.435  -3.569   0.394
  419    QB   ALA  50           QB       ALA  50  -1.336  -3.293   0.815
  420    H    THR  51           H        THR  51  -2.656  -6.134   2.575
  421    HA   THR  51           HA       THR  51  -5.563  -5.397   2.446
  422    HB   THR  51           HB       THR  51  -4.023  -7.082   4.451
  423    HG1  THR  51          1HG       THR  51  -4.629  -7.915   2.293
  424   1HG2  THR  51          3HG2      THR  51  -5.915  -5.773   5.489
  425   2HG2  THR  51          1HG2      THR  51  -7.007  -6.416   4.245
  426   3HG2  THR  51          2HG2      THR  51  -6.260  -7.506   5.433
  427    QG2  THR  51           QG2      THR  51  -6.394  -6.565   5.055
  428    H    ILE  52           H        ILE  52  -5.881  -3.379   3.098
  429    HA   ILE  52           HA       ILE  52  -3.897  -2.020   4.840
  430    HB   ILE  52           HB       ILE  52  -6.178  -0.856   3.204
  431   1HG1  ILE  52          1HG1      ILE  52  -3.201  -1.172   2.635
  432   2HG1  ILE  52          2HG1      ILE  52  -4.562  -1.672   1.636
  433   1HG2  ILE  52          2HG2      ILE  52  -5.477   0.424   5.258
  434   2HG2  ILE  52          3HG2      ILE  52  -3.852   0.545   4.574
  435   3HG2  ILE  52          1HG2      ILE  52  -5.233   1.282   3.740
  436   1HD1  ILE  52          3HD1      ILE  52  -5.093   0.791   1.299
  437   2HD1  ILE  52          1HD1      ILE  52  -3.586   1.175   2.168
  438   3HD1  ILE  52          2HD1      ILE  52  -3.515   0.277   0.658
  439    QG1  ILE  52           QG1      ILE  52  -3.882  -1.422   2.135
  440    QG2  ILE  52           QG2      ILE  52  -4.854   0.750   4.524
  441    QD1  ILE  52           QD1      ILE  52  -4.064   0.748   1.375
  442    H    TRP  53           H        TRP  53  -4.659  -1.085   6.777
  443    HA   TRP  53           HA       TRP  53  -7.238  -2.100   7.825
  444   1HB   TRP  53          1HB       TRP  53  -4.436  -2.316   8.883
  445   2HB   TRP  53          2HB       TRP  53  -5.775  -2.133  10.020
  446    HD1  TRP  53           HD       TRP  53  -7.403  -4.128  10.409
  447    HE1  TRP  53          1HE       TRP  53  -7.110  -6.618  10.135
  448    HE3  TRP  53          3HE       TRP  53  -3.522  -4.079   7.124
  449    HZ2  TRP  53          2HZ       TRP  53  -5.391  -8.437   8.605
  450    HZ3  TRP  53          3HZ       TRP  53  -2.481  -6.167   6.355
  451    HH2  TRP  53           HH       TRP  53  -3.455  -8.379   7.025
  452    QB   TRP  53           QB       TRP  53  -5.105  -2.224   9.451
  453    H    GLU  54           H        GLU  54  -8.166  -0.810   9.398
  454    HA   GLU  54           HA       GLU  54  -7.963   1.925   8.960
  455   1HB   GLU  54          1HB       GLU  54  -9.871   0.500   9.727
  456   2HB   GLU  54          2HB       GLU  54  -9.127   0.367  11.308
  457   1HG   GLU  54          1HG       GLU  54  -9.660   2.650  11.818
  458   2HG   GLU  54          2HG       GLU  54  -9.944   3.055  10.118
  459    QB   GLU  54           QB       GLU  54  -9.499   0.434  10.518
  460    QG   GLU  54           QG       GLU  54  -9.802   2.852  10.968
  461    H    GLY  55           H        GLY  55  -6.440  -0.060  11.636
  462   1HA   GLY  55          1HA       GLY  55  -4.427   1.997  11.576
  463   2HA   GLY  55          2HA       GLY  55  -5.455   2.153  13.041
  464    QA   GLY  55           QA       GLY  55  -4.941   2.075  12.308
  465    H    SER  56           H        SER  56  -3.177   2.268  13.541
  466    HA   SER  56           HA       SER  56  -1.235   1.390  14.354
  467   1HB   SER  56          1HB       SER  56  -3.499   0.713  16.260
  468   2HB   SER  56          2HB       SER  56  -1.886   1.317  16.669
  469    HG   SER  56           HG       SER  56  -4.114   2.655  15.773
  470    QB   SER  56           QB       SER  56  -2.693   1.015  16.465
  471    H    GLY  57           H        GLY  57  -0.407  -0.367  13.086
  472   1HA   GLY  57          1HA       GLY  57   0.451  -2.503  13.021
  473   2HA   GLY  57          2HA       GLY  57  -0.067  -2.708  14.704
  474    QA   GLY  57           QA       GLY  57   0.192  -2.606  13.863
  475    H    CYS  58           H        CYS  58  -2.040  -1.823  11.945
  476    HA   CYS  58           HA       CYS  58  -3.719  -2.740  10.858
  477   1HB   CYS  58          1HB       CYS  58  -3.361  -5.341  10.309
  478   2HB   CYS  58          2HB       CYS  58  -2.523  -4.023   9.486
  479    QB   CYS  58           QB       CYS  58  -2.942  -4.682   9.898
  480    H    VAL  59           H        VAL  59  -4.962  -2.186  12.751
  481    HA   VAL  59           HA       VAL  59  -6.567  -4.481  13.585
  482    HB   VAL  59           HB       VAL  59  -6.983  -3.293  15.633
  483   1HG1  VAL  59          3HG1      VAL  59  -5.146  -4.988  15.578
  484   2HG1  VAL  59          1HG1      VAL  59  -3.979  -3.691  15.266
  485   3HG1  VAL  59          2HG1      VAL  59  -4.850  -3.737  16.798
  486   1HG2  VAL  59          3HG2      VAL  59  -6.520  -0.955  14.904
  487   2HG2  VAL  59          1HG2      VAL  59  -5.792  -1.395  16.451
  488   3HG2  VAL  59          2HG2      VAL  59  -4.788  -1.331  15.006
  489    QG1  VAL  59           QG1      VAL  59  -4.658  -4.139  15.881
  490    QG2  VAL  59           QG2      VAL  59  -5.700  -1.227  15.454
  491    QQG  VAL  59           QQG      VAL  59  -5.179  -2.683  15.667
  492    H    GLY  60           H        GLY  60  -8.804  -3.470  14.257
  493   1HA   GLY  60          1HA       GLY  60 -10.639  -2.186  13.706
  494   2HA   GLY  60          2HA       GLY  60  -9.581  -0.991  12.955
  495    QA   GLY  60           QA       GLY  60 -10.110  -1.589  13.330
  496    H    ARG  61           H        ARG  61 -11.110  -0.927  11.068
  497    HA   ARG  61           HA       ARG  61 -11.879  -3.433   9.795
  498   1HB   ARG  61          1HB       ARG  61 -13.158  -1.232  10.257
  499   2HB   ARG  61          2HB       ARG  61 -12.270  -0.572   8.859
  500   1HG   ARG  61          1HG       ARG  61 -13.337  -2.220   7.405
  501   2HG   ARG  61          2HG       ARG  61 -13.898  -3.163   8.801
  502   1HD   ARG  61          1HD       ARG  61 -15.741  -2.010   8.132
  503   2HD   ARG  61          2HD       ARG  61 -15.272  -1.160   9.563
  504    HE   ARG  61           HE       ARG  61 -15.269  -0.228   6.766
  505   1HH1  ARG  61          2HH2      ARG  61 -14.049   0.537  10.035
  506   2HH1  ARG  61          1HH2      ARG  61 -13.730   2.168   9.713
  507   1HH2  ARG  61          2HH1      ARG  61 -15.409   2.034   6.492
  508   2HH2  ARG  61          1HH1      ARG  61 -14.914   3.113   7.770
  509    QB   ARG  61           QB       ARG  61 -12.714  -0.902   9.558
  510    QG   ARG  61           QG       ARG  61 -13.618  -2.692   8.103
  511    QD   ARG  61           QD       ARG  61 -15.506  -1.585   8.847
  512    QH1  ARG  61           QH2      ARG  61 -13.890   1.352   9.874
  513    QH2  ARG  61           QH1      ARG  61 -15.162   2.573   7.131
  514    H    SER  62           H        SER  62 -11.572  -3.932   7.599
  515    HA   SER  62           HA       SER  62  -9.079  -2.792   6.608
  516   1HB   SER  62          1HB       SER  62  -8.418  -5.372   6.232
  517   2HB   SER  62          2HB       SER  62  -8.006  -4.438   7.637
  518    HG   SER  62           HG       SER  62  -9.762  -5.274   8.749
  519    QB   SER  62           QB       SER  62  -8.212  -4.905   6.935
  520    H    THR  63           H        THR  63  -8.620  -3.030   4.447
  521    HA   THR  63           HA       THR  63 -10.705  -4.154   2.663
  522    HB   THR  63           HB       THR  63 -10.471  -1.931   1.334
  523    HG1  THR  63          1HG       THR  63 -10.036  -0.838   3.918
  524   1HG2  THR  63          1HG2      THR  63 -12.567  -2.651   2.379
  525   2HG2  THR  63          2HG2      THR  63 -12.069  -1.928   3.922
  526   3HG2  THR  63          3HG2      THR  63 -12.350  -0.899   2.501
  527    QG2  THR  63           QG2      THR  63 -12.328  -1.826   2.934
  528    H    THR  64           H        THR  64  -9.879  -4.641   0.587
  529    HA   THR  64           HA       THR  64  -6.969  -5.087   0.620
  530    HB   THR  64           HB       THR  64  -8.753  -6.821   0.089
  531    HG1  THR  64          1HG       THR  64  -7.024  -7.715  -0.462
  532   1HG2  THR  64          2HG2      THR  64  -9.997  -5.453  -1.662
  533   2HG2  THR  64          3HG2      THR  64  -8.586  -5.691  -2.726
  534   3HG2  THR  64          1HG2      THR  64  -9.510  -7.074  -2.150
  535    QG2  THR  64           QG2      THR  64  -9.364  -6.073  -2.179
  536    H    MET  65           H        MET  65  -5.691  -3.515  -0.212
  537    HA   MET  65           HA       MET  65  -6.698  -1.765  -2.393
  538   1HB   MET  65          1HB       MET  65  -5.352  -0.882  -0.362
  539   2HB   MET  65          2HB       MET  65  -3.937  -1.620  -1.154
  540   1HG   MET  65          1HG       MET  65  -4.091   0.696  -1.855
  541   2HG   MET  65          2HG       MET  65  -4.624  -0.279  -3.230
  542   1HE   MET  65          3HE       MET  65  -5.824   1.624  -4.460
  543   2HE   MET  65          1HE       MET  65  -6.918   2.796  -3.673
  544   3HE   MET  65          2HE       MET  65  -5.193   2.751  -3.241
  545    QB   MET  65           QB       MET  65  -4.645  -1.251  -0.758
  546    QG   MET  65           QG       MET  65  -4.357   0.208  -2.543
  547    QE   MET  65           QE       MET  65  -5.979   2.390  -3.791
  548    H    CYS  66           H        CYS  66  -5.819  -2.111  -4.484
  549    HA   CYS  66           HA       CYS  66  -3.730  -4.157  -4.791
  550   1HB   CYS  66          1HB       CYS  66  -6.441  -4.299  -6.107
  551   2HB   CYS  66          2HB       CYS  66  -5.021  -5.082  -6.776
  552    QB   CYS  66           QB       CYS  66  -5.731  -4.690  -6.441
  553    H    CYS  67           H        CYS  67  -2.444  -3.645  -6.553
  554    HA   CYS  67           HA       CYS  67  -3.116  -1.267  -8.199
  555   1HB   CYS  67          1HB       CYS  67  -2.076  -0.640  -5.991
  556   2HB   CYS  67          2HB       CYS  67  -0.614  -1.486  -6.518
  557    QB   CYS  67           QB       CYS  67  -1.345  -1.063  -6.254
  558    HA   PRO  68           HA       PRO  68  -0.724  -3.930 -11.111
  559   1HB   PRO  68          1HB       PRO  68  -0.712  -1.322 -12.618
  560   2HB   PRO  68          2HB       PRO  68  -1.134  -2.943 -13.230
  561   1HG   PRO  68          1HG       PRO  68  -3.047  -1.034 -12.695
  562   2HG   PRO  68          2HG       PRO  68  -3.344  -2.760 -12.381
  563   1HD   PRO  68          1HD       PRO  68  -2.679  -0.601 -10.407
  564   2HD   PRO  68          2HD       PRO  68  -3.743  -2.021 -10.247
  565    QB   PRO  68           QB       PRO  68  -0.923  -2.132 -12.924
  566    QG   PRO  68           QG       PRO  68  -3.196  -1.897 -12.538
  567    QD   PRO  68           QD       PRO  68  -3.211  -1.311 -10.327
  568    H    ALA  69           H        ALA  69   1.565  -3.743 -11.974
  569    HA   ALA  69           HA       ALA  69   3.106  -1.900 -10.264
  570   1HB   ALA  69          1HB       ALA  69   4.019  -4.119 -10.262
  571   2HB   ALA  69          2HB       ALA  69   4.262  -4.064 -12.033
  572   3HB   ALA  69          3HB       ALA  69   5.101  -2.935 -10.963
  573    QB   ALA  69           QB       ALA  69   4.461  -3.706 -11.086
  574    H    ASN  70           H        ASN  70   4.016  -0.117 -11.054
  575    HA   ASN  70           HA       ASN  70   4.798   1.499 -12.457
  576   1HB   ASN  70          1HB       ASN  70   4.007  -0.109 -14.924
  577   2HB   ASN  70          2HB       ASN  70   4.958   1.370 -14.829
  578   1HD2  ASN  70          2HD2      ASN  70   6.737  -2.236 -14.015
  579   2HD2  ASN  70          1HD2      ASN  70   5.030  -2.095 -14.424
  580    QB   ASN  70           QB       ASN  70   4.482   0.630 -14.877
  581    QD2  ASN  70           QD2      ASN  70   5.883  -2.166 -14.219
  582    H    THR  71           H        THR  71   2.508   1.465 -11.067
  583    HA   THR  71           HA       THR  71   1.400   3.660 -12.489
  584    HB   THR  71           HB       THR  71   0.013   1.568 -13.167
  585    HG1  THR  71          1HG       THR  71  -0.583   3.822 -13.424
  586   1HG2  THR  71          3HG2      THR  71  -0.329   0.673 -10.875
  587   2HG2  THR  71          1HG2      THR  71  -1.318   2.098 -10.482
  588   3HG2  THR  71          2HG2      THR  71  -1.840   0.983 -11.755
  589    QG2  THR  71           QG2      THR  71  -1.162   1.251 -11.037
  590    H    CYS  72           H        CYS  72  -0.259   4.730 -10.991
  591    HA   CYS  72           HA       CYS  72   0.973   4.894  -8.264
  592   1HB   CYS  72          1HB       CYS  72   1.601   6.855  -9.497
  593   2HB   CYS  72          2HB       CYS  72   0.012   6.946 -10.271
  594    QB   CYS  72           QB       CYS  72   0.806   6.900  -9.884
  595    H    CYS  73           H        CYS  73  -0.471   4.955  -6.543
  596    HA   CYS  73           HA       CYS  73  -3.367   4.528  -7.161
  597   1HB   CYS  73          1HB       CYS  73  -1.326   2.714  -5.851
  598   2HB   CYS  73          2HB       CYS  73  -3.045   2.581  -5.485
  599    QB   CYS  73           QB       CYS  73  -2.186   2.647  -5.668
  600    H    ASN  74           H        ASN  74  -4.190   6.306  -6.117
  601    HA   ASN  74           HA       ASN  74  -3.138   7.330  -3.621
  602   1HB   ASN  74          1HB       ASN  74  -4.426   8.857  -4.952
  603   2HB   ASN  74          2HB       ASN  74  -5.759   7.711  -5.075
  604   1HD2  ASN  74          2HD2      ASN  74  -5.309   9.637  -1.447
  605   2HD2  ASN  74          1HD2      ASN  74  -3.840   9.081  -2.237
  606    QB   ASN  74           QB       ASN  74  -5.092   8.284  -5.014
  607    QD2  ASN  74           QD2      ASN  74  -4.575   9.359  -1.842
  608    H    ILE  75           H        ILE  75  -3.538   6.651  -1.589
  609    HA   ILE  75           HA       ILE  75  -5.465   4.479  -0.997
  610    HB   ILE  75           HB       ILE  75  -2.988   5.714   0.271
  611   1HG1  ILE  75          1HG1      ILE  75  -2.266   3.419   0.431
  612   2HG1  ILE  75          2HG1      ILE  75  -3.850   2.826  -0.154
  613   1HG2  ILE  75          2HG2      ILE  75  -4.983   3.957   1.681
  614   2HG2  ILE  75          3HG2      ILE  75  -3.308   4.250   2.224
  615   3HG2  ILE  75          1HG2      ILE  75  -4.440   5.598   2.175
  616   1HD1  ILE  75          1HD1      ILE  75  -2.024   4.621  -1.707
  617   2HD1  ILE  75          2HD1      ILE  75  -1.947   2.837  -1.818
  618   3HD1  ILE  75          3HD1      ILE  75  -3.395   3.686  -2.352
  619    QG1  ILE  75           QG1      ILE  75  -3.058   3.122   0.139
  620    QG2  ILE  75           QG2      ILE  75  -4.244   4.602   2.027
  621    QD1  ILE  75           QD1      ILE  75  -2.455   3.715  -1.959
  622    H    ASN  76           H        ASN  76  -7.513   5.412  -0.745
  623    HA   ASN  76           HA       ASN  76  -7.892   7.112   1.564
  624   1HB   ASN  76          1HB       ASN  76  -7.168   8.743  -0.286
  625   2HB   ASN  76          2HB       ASN  76  -8.674   8.386  -1.103
  626   1HD2  ASN  76          2HD2      ASN  76 -10.640   9.958   1.601
  627   2HD2  ASN  76          1HD2      ASN  76 -10.686   8.524   0.590
  628    QB   ASN  76           QB       ASN  76  -7.921   8.564  -0.694
  629    QD2  ASN  76           QD2      ASN  76 -10.663   9.241   1.096
  630    H    THR  77           H        THR  77  -9.052   4.984   1.853
  631    HA   THR  77           HA       THR  77 -11.186   4.396  -0.022
  632    HB   THR  77           HB       THR  77 -11.527   2.445   1.145
  633    HG1  THR  77          1HG       THR  77 -10.258   3.657   3.406
  634   1HG2  THR  77          2HG2      THR  77  -9.339   2.471   0.071
  635   2HG2  THR  77          3HG2      THR  77  -8.571   2.971   1.590
  636   3HG2  THR  77          1HG2      THR  77  -9.394   1.412   1.487
  637    QG2  THR  77           QG2      THR  77  -9.101   2.285   1.049
  638    H    GLY  78           H        GLY  78 -13.230   3.527   1.801
  639   1HA   GLY  78          1HA       GLY  78 -14.751   5.901   2.368
  640   2HA   GLY  78          2HA       GLY  78 -15.050   4.260   2.967
  641    QA   GLY  78           QA       GLY  78 -14.900   5.080   2.668
  642    H    PHE  79           H        PHE  79 -12.143   4.192   4.141
  643    HA   PHE  79           HA       PHE  79 -12.427   6.197   6.296
  644   1HB   PHE  79          1HB       PHE  79 -11.232   4.520   7.695
  645   2HB   PHE  79          2HB       PHE  79 -12.917   4.162   7.458
  646    HD1  PHE  79          1HD       PHE  79 -13.348   2.451   5.413
  647    HD2  PHE  79          2HD       PHE  79  -9.710   2.762   7.655
  648    HE1  PHE  79          1HE       PHE  79 -12.945   0.016   5.076
  649    HE2  PHE  79          2HE       PHE  79  -9.244   0.364   7.231
  650   1HZ   PHE  79           HZ       PHE  79 -10.891  -1.026   6.013
  651    QB   PHE  79           QB       PHE  79 -12.075   4.341   7.577
  652    QG   PHE  79           QD       PHE  79 -11.529   2.606   6.534
  653    QZ   PHE  79           QE       PHE  79 -11.094   0.190   6.153
  654    QZ   PHE  79           QR       PHE  79 -11.228   0.913   6.277
  655    H    TYR  80           H        TYR  80 -10.683   6.928   7.145
  656    HA   TYR  80           HA       TYR  80  -8.417   7.048   5.415
  657   1HB   TYR  80          1HB       TYR  80  -8.973   9.052   6.657
  658   2HB   TYR  80          2HB       TYR  80  -9.046   8.165   8.176
  659    HD1  TYR  80          1HD       TYR  80  -6.568   8.914   5.431
  660    HD2  TYR  80          2HD       TYR  80  -7.203   8.090   9.615
  661    HE1  TYR  80          1HE       TYR  80  -4.124   8.737   5.773
  662    HE2  TYR  80          2HE       TYR  80  -4.777   7.877   9.946
  663    HH   TYR  80           HH       TYR  80  -2.789   7.492   8.778
  664    QB   TYR  80           QB       TYR  80  -9.010   8.608   7.416
  665    QG   TYR  80           QD       TYR  80  -6.886   8.502   7.523
  666    QZ   TYR  80           QE       TYR  80  -4.450   8.307   7.859
  667    QR   TYR  80           QR       TYR  80  -5.668   8.405   7.691
  668    H    ILE  81           H        ILE  81  -6.390   5.898   5.943
  669    HA   ILE  81           HA       ILE  81  -6.816   3.611   7.728
  670    HB   ILE  81           HB       ILE  81  -5.149   2.598   6.062
  671   1HG1  ILE  81          1HG1      ILE  81  -5.053   4.978   4.865
  672   2HG1  ILE  81          2HG1      ILE  81  -5.039   3.507   3.961
  673   1HG2  ILE  81          3HG2      ILE  81  -8.142   3.025   5.671
  674   2HG2  ILE  81          1HG2      ILE  81  -7.219   1.827   4.756
  675   3HG2  ILE  81          2HG2      ILE  81  -7.324   1.701   6.511
  676   1HD1  ILE  81          3HD1      ILE  81  -7.630   4.968   4.507
  677   2HD1  ILE  81          1HD1      ILE  81  -6.636   5.226   3.083
  678   3HD1  ILE  81          2HD1      ILE  81  -7.355   3.624   3.413
  679    QG1  ILE  81           QG1      ILE  81  -5.046   4.243   4.413
  680    QG2  ILE  81           QG2      ILE  81  -7.562   2.184   5.646
  681    QD1  ILE  81           QD1      ILE  81  -7.207   4.606   3.667
  682    H    ARG  82           H        ARG  82  -5.133   3.192   9.235
  683    HA   ARG  82           HA       ARG  82  -2.677   4.894   9.018
  684   1HB   ARG  82          1HB       ARG  82  -3.532   5.605  10.942
  685   2HB   ARG  82          2HB       ARG  82  -4.205   4.068  11.432
  686   1HG   ARG  82          1HG       ARG  82  -1.927   3.166  11.785
  687   2HG   ARG  82          2HG       ARG  82  -1.223   4.712  11.243
  688   1HD   ARG  82          1HD       ARG  82  -2.011   5.813  13.192
  689   2HD   ARG  82          2HD       ARG  82  -2.924   4.391  13.724
  690    HE   ARG  82           HE       ARG  82  -0.388   3.367  13.348
  691   1HH1  ARG  82          2HH2      ARG  82  -0.953   6.396  14.983
  692   2HH1  ARG  82          1HH2      ARG  82  -0.362   5.861  16.533
  693   1HH2  ARG  82          2HH1      ARG  82   0.806   2.766  15.234
  694   2HH2  ARG  82          1HH1      ARG  82   0.811   3.841  16.603
  695    QB   ARG  82           QB       ARG  82  -3.868   4.837  11.187
  696    QG   ARG  82           QG       ARG  82  -1.575   3.939  11.514
  697    QD   ARG  82           QD       ARG  82  -2.468   5.102  13.458
  698    QH1  ARG  82           QH2      ARG  82  -0.657   6.129  15.758
  699    QH2  ARG  82           QH1      ARG  82   0.809   3.303  15.919
  700    H    SER  83           H        SER  83  -3.617   1.452   8.776
  701    HA   SER  83           HA       SER  83  -0.669   1.053   8.456
  702   1HB   SER  83          1HB       SER  83  -2.195  -1.003   9.967
  703   2HB   SER  83          2HB       SER  83  -0.449  -0.833   9.788
  704    HG   SER  83           HG       SER  83  -2.163   0.805  11.369
  705    QB   SER  83           QB       SER  83  -1.322  -0.918   9.877
  706    H    TYR  84           H        TYR  84  -0.089  -1.128   7.476
  707    HA   TYR  84           HA       TYR  84  -2.237  -2.607   6.243
  708   1HB   TYR  84          1HB       TYR  84  -1.739  -2.244   3.967
  709   2HB   TYR  84          2HB       TYR  84  -1.894  -0.618   4.624
  710    HD1  TYR  84          1HD       TYR  84   0.343   0.565   5.321
  711    HD2  TYR  84          2HD       TYR  84   0.233  -3.033   2.964
  712    HE1  TYR  84          1HE       TYR  84   2.773   0.672   4.991
  713    HE2  TYR  84          2HE       TYR  84   2.626  -2.860   2.569
  714    HH   TYR  84           HH       TYR  84   4.346  -1.888   4.476
  715    QB   TYR  84           QB       TYR  84  -1.817  -1.431   4.295
  716    QG   TYR  84           QD       TYR  84   0.288  -1.234   4.142
  717    QZ   TYR  84           QE       TYR  84   2.700  -1.094   3.780
  718    QR   TYR  84           QR       TYR  84   1.494  -1.164   3.961
  719    H    ARG  85           H        ARG  85  -1.334  -4.505   4.957
  720    HA   ARG  85           HA       ARG  85   1.527  -4.823   5.061
  721   1HB   ARG  85          1HB       ARG  85   0.821  -5.690   7.266
  722   2HB   ARG  85          2HB       ARG  85  -0.241  -6.862   6.508
  723   1HG   ARG  85          1HG       ARG  85   2.714  -6.706   5.779
  724   2HG   ARG  85          2HG       ARG  85   2.193  -7.496   7.263
  725   1HD   ARG  85          1HD       ARG  85   0.512  -8.392   5.099
  726   2HD   ARG  85          2HD       ARG  85   2.187  -8.482   4.552
  727    HE   ARG  85           HE       ARG  85   1.998  -9.647   7.176
  728   1HH1  ARG  85          2HH2      ARG  85   0.915 -10.210   3.832
  729   2HH1  ARG  85          1HH2      ARG  85   0.292 -11.793   4.217
  730   1HH2  ARG  85          2HH1      ARG  85   1.490 -11.936   7.514
  731   2HH2  ARG  85          1HH1      ARG  85   1.029 -12.902   6.131
  732    QB   ARG  85           QB       ARG  85   0.290  -6.276   6.887
  733    QG   ARG  85           QG       ARG  85   2.454  -7.101   6.521
  734    QD   ARG  85           QD       ARG  85   1.350  -8.437   4.825
  735    QH1  ARG  85           QH2      ARG  85   0.603 -11.002   4.025
  736    QH2  ARG  85           QH1      ARG  85   1.259 -12.419   6.822
  737    H    ARG  86           H        ARG  86   2.250  -6.219   3.475
  738    HA   ARG  86           HA       ARG  86   0.610  -6.112   1.172
  739   1HB   ARG  86          1HB       ARG  86   2.986  -5.707   1.246
  740   2HB   ARG  86          2HB       ARG  86   3.311  -7.427   1.596
  741   1HG   ARG  86          1HG       ARG  86   2.395  -8.086  -0.536
  742   2HG   ARG  86          2HG       ARG  86   1.797  -6.440  -0.842
  743   1HD   ARG  86          1HD       ARG  86   4.020  -5.569  -1.091
  744   2HD   ARG  86          2HD       ARG  86   4.747  -7.136  -0.647
  745    HE   ARG  86           HE       ARG  86   2.852  -7.589  -2.684
  746   1HH1  ARG  86          2HH2      ARG  86   6.082  -6.090  -2.537
  747   2HH1  ARG  86          1HH2      ARG  86   6.109  -5.782  -4.236
  748   1HH2  ARG  86          2HH1      ARG  86   2.977  -7.459  -4.738
  749   2HH2  ARG  86          1HH1      ARG  86   4.360  -6.750  -5.589
  750    QB   ARG  86           QB       ARG  86   3.148  -6.567   1.421
  751    QG   ARG  86           QG       ARG  86   2.096  -7.263  -0.689
  752    QD   ARG  86           QD       ARG  86   4.384  -6.353  -0.869
  753    QH1  ARG  86           QH2      ARG  86   6.096  -5.936  -3.387
  754    QH2  ARG  86           QH1      ARG  86   3.669  -7.105  -5.163
  755    H    VAL  87           H        VAL  87  -0.140  -7.810  -0.237
  756    HA   VAL  87           HA       VAL  87  -0.283 -10.548   0.853
  757    HB   VAL  87           HB       VAL  87  -2.644 -10.743   0.529
  758   1HG1  VAL  87          3HG1      VAL  87  -1.714 -10.048   2.738
  759   2HG1  VAL  87          1HG1      VAL  87  -2.081  -8.357   2.327
  760   3HG1  VAL  87          2HG1      VAL  87  -3.380  -9.552   2.459
  761   1HG2  VAL  87          1HG2      VAL  87  -2.671  -7.770  -0.107
  762   2HG2  VAL  87          2HG2      VAL  87  -3.060  -9.098  -1.223
  763   3HG2  VAL  87          3HG2      VAL  87  -4.097  -8.786   0.172
  764    QG1  VAL  87           QG1      VAL  87  -2.392  -9.319   2.508
  765    QG2  VAL  87           QG2      VAL  87  -3.276  -8.551  -0.386
  766    QQG  VAL  87           QQG      VAL  87  -2.834  -8.935   1.061
  767    H    GLU  88           H        GLU  88   0.258  -8.640  -2.044
  768    HA   GLU  88           HA       GLU  88   1.170 -11.068  -3.057
  769   1HB   GLU  88          1HB       GLU  88   0.241 -10.963  -5.234
  770   2HB   GLU  88          2HB       GLU  88  -0.917 -11.518  -4.026
  771   1HG   GLU  88          1HG       GLU  88  -2.323  -9.702  -4.356
  772   2HG   GLU  88          2HG       GLU  88  -0.979  -8.619  -4.757
  773    QB   GLU  88           QB       GLU  88  -0.338 -11.241  -4.630
  774    QG   GLU  88           QG       GLU  88  -1.651  -9.161  -4.557
   
  No H/Q in entry =         774
  Start of MODEL   19
    1   1HA   GLY   1          1HA       GLY   1  13.171  -4.754 -12.931
    2   2HA   GLY   1          2HA       GLY   1  12.695  -6.294 -13.675
    3    QA   GLY   1           QA       GLY   1  12.933  -5.524 -13.303
    4    H    ASP   2           H        ASP   2  12.193  -5.536 -10.983
    5    HA   ASP   2           HA       ASP   2  12.784  -7.985  -9.664
    6   1HB   ASP   2          1HB       ASP   2  14.901  -7.151  -8.979
    7   2HB   ASP   2          2HB       ASP   2  14.284  -5.529  -8.704
    8    QB   ASP   2           QB       ASP   2  14.593  -6.340  -8.841
    9    H    GLY   3           H        GLY   3  11.784  -4.549  -9.405
   10   1HA   GLY   3          1HA       GLY   3   9.660  -3.801  -9.041
   11   2HA   GLY   3          2HA       GLY   3   9.115  -5.438  -8.586
   12    QA   GLY   3           QA       GLY   3   9.388  -4.619  -8.814
   13    H    TYR   4           H        TYR   4   8.208  -3.309  -7.159
   14    HA   TYR   4           HA       TYR   4   9.008  -3.858  -4.501
   15   1HB   TYR   4          1HB       TYR   4   9.664  -1.428  -3.970
   16   2HB   TYR   4          2HB       TYR   4  10.854  -2.392  -4.789
   17    HD1  TYR   4          2HD       TYR   4   8.319   0.294  -5.184
   18    HD2  TYR   4          1HD       TYR   4  11.495  -1.840  -7.149
   19    HE1  TYR   4          2HE       TYR   4   8.285   1.937  -7.025
   20    HE2  TYR   4          1HE       TYR   4  11.464  -0.198  -8.995
   21    HH   TYR   4           HH       TYR   4   9.052   2.412  -9.105
   22    QB   TYR   4           QB       TYR   4  10.259  -1.910  -4.379
   23    QG   TYR   4           QD       TYR   4   9.907  -0.773  -6.166
   24    QZ   TYR   4           QE       TYR   4   9.874   0.869  -8.010
   25    QR   TYR   4           QR       TYR   4   9.891   0.048  -7.088
   26    H    LEU   5           H        LEU   5   7.830  -2.441  -3.069
   27    HA   LEU   5           HA       LEU   5   5.453  -1.044  -4.197
   28   1HB   LEU   5          1HB       LEU   5   4.962  -3.460  -3.674
   29   2HB   LEU   5          2HB       LEU   5   5.314  -3.115  -1.991
   30    HG   LEU   5           HG       LEU   5   3.369  -1.221  -3.216
   31   1HD1  LEU   5          2HD1      LEU   5   2.793  -3.202  -4.579
   32   2HD1  LEU   5          3HD1      LEU   5   2.493  -4.137  -3.107
   33   3HD1  LEU   5          1HD1      LEU   5   1.496  -2.733  -3.482
   34   1HD2  LEU   5          3HD2      LEU   5   3.533  -2.919  -0.719
   35   2HD2  LEU   5          1HD2      LEU   5   3.380  -1.168  -0.890
   36   3HD2  LEU   5          2HD2      LEU   5   1.987  -2.232  -1.190
   37    QB   LEU   5           QB       LEU   5   5.138  -3.287  -2.833
   38    QD1  LEU   5           QD1      LEU   5   2.261  -3.357  -3.723
   39    QD2  LEU   5           QD2      LEU   5   2.967  -2.106  -0.933
   40    QQD  LEU   5           QQD      LEU   5   2.614  -2.732  -2.328
   41    H    ILE   6           H        ILE   6   6.347   0.907  -3.646
   42    HA   ILE   6           HA       ILE   6   6.809   1.456  -0.761
   43    HB   ILE   6           HB       ILE   6   7.983   3.530  -1.645
   44   1HG1  ILE   6          1HG1      ILE   6   8.971   2.158  -4.055
   45   2HG1  ILE   6          2HG1      ILE   6   7.271   2.633  -4.196
   46   1HG2  ILE   6          2HG2      ILE   6   9.190   1.772  -0.527
   47   2HG2  ILE   6          3HG2      ILE   6   9.392   0.890  -2.061
   48   3HG2  ILE   6          1HG2      ILE   6  10.119   2.495  -1.869
   49   1HD1  ILE   6          2HD1      ILE   6   9.463   4.521  -3.323
   50   2HD1  ILE   6          3HD1      ILE   6   8.855   4.376  -4.990
   51   3HD1  ILE   6          1HD1      ILE   6   7.761   4.900  -3.699
   52    QG1  ILE   6           QG1      ILE   6   8.121   2.395  -4.126
   53    QG2  ILE   6           QG2      ILE   6   9.567   1.719  -1.486
   54    QD1  ILE   6           QD1      ILE   6   8.693   4.599  -4.004
   55    H    MET   7           H        MET   7   5.929   3.457   0.005
   56    HA   MET   7           HA       MET   7   4.095   4.828  -1.772
   57   1HB   MET   7          1HB       MET   7   3.788   5.420   1.017
   58   2HB   MET   7          2HB       MET   7   2.639   4.890  -0.190
   59   1HG   MET   7          1HG       MET   7   3.429   2.489   0.338
   60   2HG   MET   7          2HG       MET   7   4.356   3.249   1.640
   61   1HE   MET   7          2HE       MET   7   0.931   2.102   0.342
   62   2HE   MET   7          3HE       MET   7  -0.200   2.774   1.536
   63   3HE   MET   7          1HE       MET   7   0.627   3.862   0.394
   64    QB   MET   7           QB       MET   7   3.214   5.155   0.414
   65    QG   MET   7           QG       MET   7   3.892   2.869   0.989
   66    QE   MET   7           QE       MET   7   0.453   2.913   0.758
   67    H    CYS   8           H        CYS   8   3.626   6.975  -1.200
   68    HA   CYS   8           HA       CYS   8   6.033   8.671  -0.986
   69   1HB   CYS   8          1HB       CYS   8   4.143   8.406  -3.333
   70   2HB   CYS   8          2HB       CYS   8   5.497   9.519  -3.249
   71    QB   CYS   8           QB       CYS   8   4.820   8.962  -3.291
   72    H    LYS   9           H        LYS   9   5.616  10.857  -1.135
   73    HA   LYS   9           HA       LYS   9   3.370  11.693   0.444
   74   1HB   LYS   9          1HB       LYS   9   5.252  13.383  -1.287
   75   2HB   LYS   9          2HB       LYS   9   4.252  13.940   0.056
   76   1HG   LYS   9          1HG       LYS   9   5.923  11.758   0.976
   77   2HG   LYS   9          2HG       LYS   9   6.951  12.880   0.125
   78   1HD   LYS   9          1HD       LYS   9   4.989  13.699   2.322
   79   2HD   LYS   9          2HD       LYS   9   6.629  13.111   2.625
   80   1HE   LYS   9          1HE       LYS   9   6.617  15.496   2.817
   81   2HE   LYS   9          2HE       LYS   9   7.628  15.016   1.453
   82   1HZ   LYS   9          2HZ       LYS   9   4.831  15.973   1.094
   83   2HZ   LYS   9          3HZ       LYS   9   6.163  16.942   1.102
   84   3HZ   LYS   9          1HZ       LYS   9   6.012  15.799  -0.032
   85    QB   LYS   9           QB       LYS   9   4.752  13.661  -0.616
   86    QG   LYS   9           QG       LYS   9   6.437  12.319   0.550
   87    QD   LYS   9           QD       LYS   9   5.809  13.405   2.474
   88    QE   LYS   9           QE       LYS   9   7.123  15.256   2.135
   89    QZ   LYS   9           QZ       LYS   9   5.669  16.238   0.721
   90    H    ASN  10           H        ASN  10   4.112  11.654  -3.044
   91    HA   ASN  10           HA       ASN  10   1.345  12.377  -3.759
   92   1HB   ASN  10          1HB       ASN  10   1.982  13.986  -5.371
   93   2HB   ASN  10          2HB       ASN  10   2.719  14.490  -3.862
   94   1HD2  ASN  10          2HD2      ASN  10   5.232  14.676  -6.699
   95   2HD2  ASN  10          1HD2      ASN  10   3.612  15.309  -6.542
   96    QB   ASN  10           QB       ASN  10   2.350  14.238  -4.617
   97    QD2  ASN  10           QD2      ASN  10   4.422  14.993  -6.621
   98    H    CYS  11           H        CYS  11   1.644  12.290  -6.460
   99    HA   CYS  11           HA       CYS  11   1.995   9.445  -6.875
  100   1HB   CYS  11          1HB       CYS  11   0.296  10.997  -7.895
  101   2HB   CYS  11          2HB       CYS  11   1.570  11.700  -8.875
  102    QB   CYS  11           QB       CYS  11   0.933  11.349  -8.385
  103    H    ASP  12           H        ASP  12   4.428  11.603  -6.592
  104    HA   ASP  12           HA       ASP  12   5.725  11.034  -9.184
  105   1HB   ASP  12          1HB       ASP  12   5.230  13.364  -8.521
  106   2HB   ASP  12          2HB       ASP  12   6.484  13.204  -7.257
  107    QB   ASP  12           QB       ASP  12   5.857  13.284  -7.889
  108    HA   PRO  13           HA       PRO  13   8.504   8.501  -6.532
  109   1HB   PRO  13          1HB       PRO  13   9.827   7.205  -8.575
  110   2HB   PRO  13          2HB       PRO  13   8.263   6.673  -7.895
  111   1HG   PRO  13          1HG       PRO  13   8.792   8.287 -10.398
  112   2HG   PRO  13          2HG       PRO  13   7.623   6.952 -10.172
  113   1HD   PRO  13          1HD       PRO  13   6.900   9.554 -10.130
  114   2HD   PRO  13          2HD       PRO  13   6.091   8.350  -9.082
  115    QB   PRO  13           QB       PRO  13   9.045   6.939  -8.235
  116    QG   PRO  13           QG       PRO  13   8.208   7.620 -10.285
  117    QD   PRO  13           QD       PRO  13   6.495   8.952  -9.606
  118    H    ASN  14           H        ASN  14   9.164  10.888  -9.005
  119    HA   ASN  14           HA       ASN  14  12.050  10.632  -8.990
  120   1HB   ASN  14          1HB       ASN  14  10.391  11.413 -10.854
  121   2HB   ASN  14          2HB       ASN  14  10.523  13.006 -10.101
  122   1HD2  ASN  14          2HD2      ASN  14  14.137  13.065 -10.991
  123   2HD2  ASN  14          1HD2      ASN  14  13.336  13.167  -9.445
  124    QB   ASN  14           QB       ASN  14  10.457  12.209 -10.477
  125    QD2  ASN  14           QD2      ASN  14  13.736  13.116 -10.218
  126    H    THR  15           H        THR  15   9.662  13.083  -7.996
  127    HA   THR  15           HA       THR  15  11.582  14.116  -5.948
  128    HB   THR  15           HB       THR  15  11.727  15.420  -8.060
  129    HG1  THR  15          1HG       THR  15  10.546  16.848  -5.930
  130   1HG2  THR  15          3HG2      THR  15   8.813  16.151  -7.541
  131   2HG2  THR  15          1HG2      THR  15   9.887  16.906  -8.730
  132   3HG2  THR  15          2HG2      THR  15   9.442  15.204  -8.910
  133    QG2  THR  15           QG2      THR  15   9.381  16.087  -8.394
  134    H    GLY  16           H        GLY  16   8.818  12.564  -6.060
  135   1HA   GLY  16          1HA       GLY  16   7.158  14.106  -4.268
  136   2HA   GLY  16          2HA       GLY  16   7.170  12.341  -4.482
  137    QA   GLY  16           QA       GLY  16   7.164  13.224  -4.375
  138    H    SER  17           H        SER  17   9.644  11.611  -3.932
  139    HA   SER  17           HA       SER  17  11.011  10.989  -2.263
  140   1HB   SER  17          1HB       SER  17  10.874  13.401  -1.324
  141   2HB   SER  17          2HB       SER  17   9.683  12.740  -0.190
  142    HG   SER  17           HG       SER  17  11.745  12.673   0.654
  143    QB   SER  17           QB       SER  17  10.278  13.070  -0.757
  144    H    CYS  18           H        CYS  18  10.659   9.055  -1.325
  145    HA   CYS  18           HA       CYS  18   7.922   8.208  -0.683
  146   1HB   CYS  18          1HB       CYS  18   9.982   7.140  -2.645
  147   2HB   CYS  18          2HB       CYS  18   8.541   6.283  -2.174
  148    QB   CYS  18           QB       CYS  18   9.261   6.711  -2.410
  149    H    ASP  19           H        ASP  19   7.905   6.394   0.902
  150    HA   ASP  19           HA       ASP  19  10.553   6.299   2.186
  151   1HB   ASP  19          1HB       ASP  19   9.654   5.447   4.010
  152   2HB   ASP  19          2HB       ASP  19   8.711   6.834   3.483
  153    QB   ASP  19           QB       ASP  19   9.182   6.140   3.747
  154    H    TRP  20           H        TRP  20  11.758   5.206   0.950
  155    HA   TRP  20           HA       TRP  20  11.231   2.530  -0.101
  156   1HB   TRP  20          1HB       TRP  20  13.769   4.176  -0.091
  157   2HB   TRP  20          2HB       TRP  20  13.510   2.637  -0.926
  158    HD1  TRP  20           HD       TRP  20  12.722   6.337  -1.275
  159    HE1  TRP  20          1HE       TRP  20  12.021   6.837  -3.658
  160    HE3  TRP  20          3HE       TRP  20  12.503   1.539  -3.029
  161    HZ2  TRP  20          2HZ       TRP  20  11.376   5.329  -6.060
  162    HZ3  TRP  20          3HZ       TRP  20  11.894   1.110  -5.391
  163    HH2  TRP  20           HH       TRP  20  11.263   2.998  -6.893
  164    QB   TRP  20           QB       TRP  20  13.639   3.407  -0.508
  165    H    LYS  21           H        LYS  21  10.627   2.414   2.257
  166    HA   LYS  21           HA       LYS  21  12.551   0.710   3.763
  167   1HB   LYS  21          1HB       LYS  21   9.945   2.115   4.297
  168   2HB   LYS  21          2HB       LYS  21  10.019   0.452   4.873
  169   1HG   LYS  21          1HG       LYS  21  12.222   2.457   5.454
  170   2HG   LYS  21          2HG       LYS  21  10.806   2.235   6.498
  171   1HD   LYS  21          1HD       LYS  21  11.286  -0.048   6.911
  172   2HD   LYS  21          2HD       LYS  21  12.576  -0.161   5.738
  173   1HE   LYS  21          1HE       LYS  21  12.837   1.930   7.909
  174   2HE   LYS  21          2HE       LYS  21  13.096   0.233   8.327
  175   1HZ   LYS  21          1HZ       LYS  21  14.536   1.338   6.013
  176   2HZ   LYS  21          2HZ       LYS  21  15.069   1.626   7.537
  177   3HZ   LYS  21          3HZ       LYS  21  14.916   0.080   7.039
  178    QB   LYS  21           QB       LYS  21   9.982   1.283   4.585
  179    QG   LYS  21           QG       LYS  21  11.514   2.346   5.976
  180    QD   LYS  21           QD       LYS  21  11.931  -0.105   6.324
  181    QE   LYS  21           QE       LYS  21  12.966   1.082   8.118
  182    QZ   LYS  21           QZ       LYS  21  14.840   1.014   6.863
  183    H    GLN  22           H        GLN  22  11.923  -1.547   3.924
  184    HA   GLN  22           HA       GLN  22  10.393  -2.581   1.602
  185   1HB   GLN  22          1HB       GLN  22  12.524  -3.686   2.373
  186   2HB   GLN  22          2HB       GLN  22  11.692  -4.024   3.901
  187   1HG   GLN  22          1HG       GLN  22  10.099  -4.937   1.609
  188   2HG   GLN  22          2HG       GLN  22  11.703  -5.628   1.596
  189   1HE2  GLN  22          2HE2      GLN  22  11.053  -7.753   4.387
  190   2HE2  GLN  22          1HE2      GLN  22  12.205  -7.231   3.121
  191    QB   GLN  22           QB       GLN  22  12.108  -3.855   3.137
  192    QG   GLN  22           QG       GLN  22  10.901  -5.282   1.602
  193    QE2  GLN  22           QE2      GLN  22  11.629  -7.492   3.754
  194    H    ASN  23           H        ASN  23   8.454  -3.616   1.983
  195    HA   ASN  23           HA       ASN  23   7.048  -3.063   4.564
  196   1HB   ASN  23          1HB       ASN  23   5.884  -2.152   1.904
  197   2HB   ASN  23          2HB       ASN  23   5.389  -1.696   3.536
  198   1HD2  ASN  23          2HD2      ASN  23   8.088   0.500   1.512
  199   2HD2  ASN  23          1HD2      ASN  23   7.029  -0.675   0.759
  200    QB   ASN  23           QB       ASN  23   5.637  -1.924   2.720
  201    QD2  ASN  23           QD2      ASN  23   7.558  -0.088   1.136
  202    H    TRP  24           H        TRP  24   7.776  -5.670   3.624
  203    HA   TRP  24           HA       TRP  24   5.269  -6.735   2.428
  204   1HB   TRP  24          1HB       TRP  24   6.864  -6.826   0.717
  205   2HB   TRP  24          2HB       TRP  24   8.223  -7.019   1.823
  206    HD1  TRP  24           HD       TRP  24   8.818  -9.298   2.695
  207    HE1  TRP  24          1HE       TRP  24   8.086 -11.754   2.162
  208    HE3  TRP  24          3HE       TRP  24   4.684  -8.255   0.067
  209    HZ2  TRP  24          2HZ       TRP  24   5.897 -13.017   0.719
  210    HZ3  TRP  24          3HZ       TRP  24   3.204 -10.012  -0.800
  211    HH2  TRP  24           HH       TRP  24   3.816 -12.408  -0.571
  212    QB   TRP  24           QB       TRP  24   7.543  -6.922   1.270
  213    H    ASN  25           H        ASN  25   4.410  -8.386   3.567
  214    HA   ASN  25           HA       ASN  25   3.931  -9.567   5.438
  215   1HB   ASN  25          1HB       ASN  25   5.609 -11.062   4.285
  216   2HB   ASN  25          2HB       ASN  25   6.832 -10.495   5.416
  217   1HD2  ASN  25          2HD2      ASN  25   5.557 -12.461   8.130
  218   2HD2  ASN  25          1HD2      ASN  25   6.563 -11.076   7.743
  219    QB   ASN  25           QB       ASN  25   6.220 -10.779   4.850
  220    QD2  ASN  25           QD2      ASN  25   6.060 -11.769   7.936
  221    H    THR  26           H        THR  26   4.036  -7.098   6.180
  222    HA   THR  26           HA       THR  26   4.806  -7.350   8.871
  223    HB   THR  26           HB       THR  26   6.972  -6.804   8.372
  224    HG1  THR  26          1HG       THR  26   6.010  -5.527  10.012
  225   1HG2  THR  26          1HG2      THR  26   6.002  -4.849   6.301
  226   2HG2  THR  26          2HG2      THR  26   7.602  -4.651   7.041
  227   3HG2  THR  26          3HG2      THR  26   7.214  -6.130   6.194
  228    QG2  THR  26           QG2      THR  26   6.939  -5.210   6.512
  229    H    CYS  27           H        CYS  27   3.921  -5.809  10.171
  230    HA   CYS  27           HA       CYS  27   1.361  -4.830   9.294
  231   1HB   CYS  27          1HB       CYS  27   1.850  -6.158  11.391
  232   2HB   CYS  27          2HB       CYS  27   2.801  -4.799  11.976
  233    QB   CYS  27           QB       CYS  27   2.325  -5.479  11.683
  234    H    VAL  28           H        VAL  28   2.382  -3.120   7.834
  235    HA   VAL  28           HA       VAL  28   4.098  -1.124   9.149
  236    HB   VAL  28           HB       VAL  28   3.230  -1.597   6.291
  237   1HG1  VAL  28          2HG1      VAL  28   4.887   0.689   7.446
  238   2HG1  VAL  28          3HG1      VAL  28   4.909   0.216   5.738
  239   3HG1  VAL  28          1HG1      VAL  28   3.414   0.818   6.463
  240   1HG2  VAL  28          3HG2      VAL  28   4.963  -3.085   7.312
  241   2HG2  VAL  28          1HG2      VAL  28   5.622  -2.068   6.017
  242   3HG2  VAL  28          2HG2      VAL  28   5.936  -1.657   7.712
  243    QG1  VAL  28           QG1      VAL  28   4.403   0.575   6.549
  244    QG2  VAL  28           QG2      VAL  28   5.507  -2.270   7.014
  245    QQG  VAL  28           QQG      VAL  28   4.955  -0.848   6.781
  246    H    GLY  29           H        GLY  29   3.572   0.971   9.606
  247   1HA   GLY  29          1HA       GLY  29   0.793   1.611   9.969
  248   2HA   GLY  29          2HA       GLY  29   2.183   2.634  10.339
  249    QA   GLY  29           QA       GLY  29   1.488   2.122  10.154
  250    H    ILE  30           H        ILE  30  -0.376   3.095   8.795
  251    HA   ILE  30           HA       ILE  30   0.757   4.340   6.328
  252    HB   ILE  30           HB       ILE  30  -2.137   3.824   7.140
  253   1HG1  ILE  30          1HG1      ILE  30  -1.013   1.735   6.459
  254   2HG1  ILE  30          2HG1      ILE  30  -2.258   2.237   5.317
  255   1HG2  ILE  30          2HG2      ILE  30  -0.932   5.283   4.772
  256   2HG2  ILE  30          3HG2      ILE  30  -2.477   4.457   4.623
  257   3HG2  ILE  30          1HG2      ILE  30  -2.294   5.748   5.814
  258   1HD1  ILE  30          3HD1      ILE  30  -0.370   3.293   3.924
  259   2HD1  ILE  30          1HD1      ILE  30   0.758   2.440   5.007
  260   3HD1  ILE  30          2HD1      ILE  30  -0.411   1.541   4.017
  261    QG1  ILE  30           QG1      ILE  30  -1.635   1.986   5.888
  262    QG2  ILE  30           QG2      ILE  30  -1.901   5.163   5.070
  263    QD1  ILE  30           QD1      ILE  30  -0.008   2.424   4.316
  264    H    GLY  31           H        GLY  31  -0.029   6.615   6.029
  265   1HA   GLY  31          1HA       GLY  31  -0.915   8.616   6.847
  266   2HA   GLY  31          2HA       GLY  31  -0.789   8.037   8.518
  267    QA   GLY  31           QA       GLY  31  -0.852   8.326   7.682
  268    H    ALA  32           H        ALA  32   0.139  10.392   8.006
  269    HA   ALA  32           HA       ALA  32   1.769  11.826   8.091
  270   1HB   ALA  32          3HB       ALA  32   2.398  10.625  10.162
  271   2HB   ALA  32          1HB       ALA  32   3.443   9.528   9.220
  272   3HB   ALA  32          2HB       ALA  32   3.843  11.255   9.337
  273    QB   ALA  32           QB       ALA  32   3.228  10.470   9.573
  274    H    ASN  33           H        ASN  33   2.067  12.546   6.211
  275    HA   ASN  33           HA       ASN  33   3.194  13.140   4.417
  276   1HB   ASN  33          1HB       ASN  33   5.518  13.262   4.533
  277   2HB   ASN  33          2HB       ASN  33   5.002  13.223   6.195
  278   1HD2  ASN  33          2HD2      ASN  33   7.139   9.990   4.728
  279   2HD2  ASN  33          1HD2      ASN  33   6.035  10.833   3.649
  280    QB   ASN  33           QB       ASN  33   5.260  13.242   5.364
  281    QD2  ASN  33           QD2      ASN  33   6.587  10.412   4.189
  282    H    VAL  34           H        VAL  34   2.064  10.239   4.659
  283    HA   VAL  34           HA       VAL  34   3.112   9.387   1.966
  284    HB   VAL  34           HB       VAL  34   3.171   7.936   4.607
  285   1HG1  VAL  34          2HG1      VAL  34   2.288   6.546   2.071
  286   2HG1  VAL  34          3HG1      VAL  34   3.205   5.709   3.340
  287   3HG1  VAL  34          1HG1      VAL  34   1.636   6.399   3.716
  288   1HG2  VAL  34          3HG2      VAL  34   5.223   8.701   3.423
  289   2HG2  VAL  34          1HG2      VAL  34   5.191   6.950   3.639
  290   3HG2  VAL  34          2HG2      VAL  34   4.818   7.652   2.052
  291    QG1  VAL  34           QG1      VAL  34   2.376   6.218   3.042
  292    QG2  VAL  34           QG2      VAL  34   5.077   7.767   3.038
  293    QQG  VAL  34           QQG      VAL  34   3.727   6.993   3.040
  294    H    HIS  35           H        HIS  35   1.394   9.443   0.603
  295    HA   HIS  35           HA       HIS  35  -0.975   7.894   1.341
  296   1HB   HIS  35          1HB       HIS  35  -2.577   9.716   0.716
  297   2HB   HIS  35          2HB       HIS  35  -1.803   9.871   2.280
  298    HD1  HIS  35          1HD       HIS  35  -2.488  12.023  -0.577
  299    HD2  HIS  35          2HD       HIS  35   0.405  11.618   2.451
  300    HE1  HIS  35          1HE       HIS  35  -1.322  14.278  -0.348
  301    QB   HIS  35           QB       HIS  35  -2.190   9.793   1.498
  302    H    TRP  36           H        TRP  36   1.293   8.088  -0.799
  303    HA   TRP  36           HA       TRP  36  -0.622   7.238  -2.945
  304   1HB   TRP  36          1HB       TRP  36   1.776   9.018  -3.164
  305   2HB   TRP  36          2HB       TRP  36   1.027   8.238  -4.545
  306    HD1  TRP  36           HD       TRP  36   0.003  10.802  -1.817
  307    HE1  TRP  36          1HE       TRP  36  -1.843  12.292  -2.737
  308    HE3  TRP  36          3HE       TRP  36  -0.595   8.550  -6.339
  309    HZ2  TRP  36          2HZ       TRP  36  -3.303  12.586  -5.247
  310    HZ3  TRP  36          3HZ       TRP  36  -2.221   9.449  -7.999
  311    HH2  TRP  36           HH       TRP  36  -3.496  11.527  -7.496
  312    QB   TRP  36           QB       TRP  36   1.402   8.628  -3.854
  313    H    MET  37           H        MET  37  -0.217   5.227  -3.281
  314    HA   MET  37           HA       MET  37   2.422   4.042  -2.604
  315   1HB   MET  37          1HB       MET  37   0.355   2.937  -1.832
  316   2HB   MET  37          2HB       MET  37  -0.051   2.602  -3.535
  317   1HG   MET  37          1HG       MET  37   2.223   1.409  -3.659
  318   2HG   MET  37          2HG       MET  37   2.406   1.736  -1.934
  319   1HE   MET  37          1HE       MET  37   0.695  -0.254  -4.685
  320   2HE   MET  37          2HE       MET  37  -0.515  -1.234  -3.830
  321   3HE   MET  37          3HE       MET  37  -0.774   0.518  -4.033
  322    QB   MET  37           QB       MET  37   0.152   2.770  -2.684
  323    QG   MET  37           QG       MET  37   2.314   1.573  -2.796
  324    QE   MET  37           QE       MET  37  -0.198  -0.323  -4.183
  325    H    VAL  38           H        VAL  38   3.890   3.765  -4.240
  326    HA   VAL  38           HA       VAL  38   2.897   3.860  -7.062
  327    HB   VAL  38           HB       VAL  38   5.454   5.200  -6.121
  328   1HG1  VAL  38          3HG1      VAL  38   5.277   4.523  -8.510
  329   2HG1  VAL  38          1HG1      VAL  38   3.751   5.408  -8.651
  330   3HG1  VAL  38          2HG1      VAL  38   5.257   6.288  -8.341
  331   1HG2  VAL  38          3HG2      VAL  38   2.715   6.468  -6.622
  332   2HG2  VAL  38          1HG2      VAL  38   3.597   6.465  -5.083
  333   3HG2  VAL  38          2HG2      VAL  38   4.238   7.363  -6.459
  334    QG1  VAL  38           QG1      VAL  38   4.762   5.406  -8.501
  335    QG2  VAL  38           QG2      VAL  38   3.517   6.765  -6.055
  336    QQG  VAL  38           QQG      VAL  38   4.139   6.086  -7.278
  337    H    THR  39           H        THR  39   3.001   1.713  -7.463
  338    HA   THR  39           HA       THR  39   5.245   0.202  -6.213
  339    HB   THR  39           HB       THR  39   3.036  -0.599  -5.679
  340    HG1  THR  39          1HG       THR  39   4.952  -2.025  -6.147
  341   1HG2  THR  39          3HG2      THR  39   1.854   0.016  -7.822
  342   2HG2  THR  39          1HG2      THR  39   2.697  -1.321  -8.613
  343   3HG2  THR  39          2HG2      THR  39   1.572  -1.655  -7.295
  344    QG2  THR  39           QG2      THR  39   2.041  -0.986  -7.910
  345    H    GLY  40           H        GLY  40   6.876  -0.438  -7.387
  346   1HA   GLY  40          1HA       GLY  40   6.985  -0.113 -10.251
  347   2HA   GLY  40          2HA       GLY  40   8.248  -0.809  -9.284
  348    QA   GLY  40           QA       GLY  40   7.617  -0.461  -9.768
  349    H    GLY  41           H        GLY  41   7.095  -2.345  -8.222
  350   1HA   GLY  41          1HA       GLY  41   6.859  -4.827  -8.109
  351   2HA   GLY  41          2HA       GLY  41   5.321  -4.414  -8.879
  352    QA   GLY  41           QA       GLY  41   6.090  -4.620  -8.494
  353    H    SER  42           H        SER  42   8.338  -3.696 -10.633
  354    HA   SER  42           HA       SER  42   7.394  -5.054 -12.806
  355   1HB   SER  42          1HB       SER  42  10.291  -4.450 -12.464
  356   2HB   SER  42          2HB       SER  42   9.238  -4.255 -13.902
  357    HG   SER  42           HG       SER  42   9.870  -2.306 -12.514
  358    QB   SER  42           QB       SER  42   9.764  -4.352 -13.183
  359    H    THR  43           H        THR  43   8.236  -6.878 -13.967
  360    HA   THR  43           HA       THR  43   8.878  -8.964 -14.250
  361    HB   THR  43           HB       THR  43  10.203  -9.717 -11.764
  362    HG1  THR  43          1HG       THR  43  10.882  -7.674 -11.611
  363   1HG2  THR  43          2HG2      THR  43  10.401 -10.936 -13.915
  364   2HG2  THR  43          3HG2      THR  43  11.175  -9.509 -14.646
  365   3HG2  THR  43          1HG2      THR  43  11.981 -10.373 -13.326
  366    QG2  THR  43           QG2      THR  43  11.186 -10.273 -13.963
  367    H    ASP  44           H        ASP  44   6.856  -7.733 -11.896
  368    HA   ASP  44           HA       ASP  44   5.305 -10.263 -12.044
  369   1HB   ASP  44          1HB       ASP  44   5.568  -8.199  -9.872
  370   2HB   ASP  44          2HB       ASP  44   3.943  -8.684 -10.307
  371    QB   ASP  44           QB       ASP  44   4.756  -8.441 -10.090
  372    H    GLY  45           H        GLY  45   3.794 -10.138 -13.549
  373   1HA   GLY  45          1HA       GLY  45   3.032  -7.555 -14.768
  374   2HA   GLY  45          2HA       GLY  45   2.452  -9.183 -15.178
  375    QA   GLY  45           QA       GLY  45   2.742  -8.369 -14.973
  376    H    LYS  46           H        LYS  46   2.117  -9.950 -12.433
  377    HA   LYS  46           HA       LYS  46  -0.595  -9.272 -12.108
  378   1HB   LYS  46          1HB       LYS  46  -0.448 -10.375  -9.883
  379   2HB   LYS  46          2HB       LYS  46  -0.065 -11.346 -11.322
  380   1HG   LYS  46          1HG       LYS  46   2.228 -11.258 -10.955
  381   2HG   LYS  46          2HG       LYS  46   2.099  -9.955  -9.749
  382   1HD   LYS  46          1HD       LYS  46   0.646 -12.549  -9.253
  383   2HD   LYS  46          2HD       LYS  46   2.387 -12.595  -9.055
  384   1HE   LYS  46          1HE       LYS  46   0.699 -10.445  -7.703
  385   2HE   LYS  46          2HE       LYS  46   0.863 -12.052  -6.981
  386   1HZ   LYS  46          3HZ       LYS  46   3.246 -11.726  -6.932
  387   2HZ   LYS  46          1HZ       LYS  46   3.127 -10.261  -7.571
  388   3HZ   LYS  46          2HZ       LYS  46   2.465 -10.500  -6.095
  389    QB   LYS  46           QB       LYS  46  -0.256 -10.861 -10.602
  390    QG   LYS  46           QG       LYS  46   2.163 -10.607 -10.352
  391    QD   LYS  46           QD       LYS  46   1.517 -12.572  -9.154
  392    QE   LYS  46           QE       LYS  46   0.781 -11.249  -7.342
  393    QZ   LYS  46           QZ       LYS  46   2.946 -10.829  -6.866
  394    H    GLN  47           H        GLN  47  -1.589  -7.731 -11.031
  395    HA   GLN  47           HA       GLN  47  -0.598  -5.457  -9.799
  396   1HB   GLN  47          1HB       GLN  47  -2.789  -5.514  -8.517
  397   2HB   GLN  47          2HB       GLN  47  -2.969  -5.787 -10.259
  398   1HG   GLN  47          1HG       GLN  47  -3.053  -8.285  -9.810
  399   2HG   GLN  47          2HG       GLN  47  -3.001  -7.926  -8.090
  400   1HE2  GLN  47          2HE2      GLN  47  -6.467  -7.457  -7.903
  401   2HE2  GLN  47          1HE2      GLN  47  -5.034  -8.292  -7.276
  402    QB   GLN  47           QB       GLN  47  -2.879  -5.650  -9.388
  403    QG   GLN  47           QG       GLN  47  -3.027  -8.105  -8.950
  404    QE2  GLN  47           QE2      GLN  47  -5.751  -7.874  -7.589
  405    H    GLY  48           H        GLY  48  -0.016  -4.868  -7.736
  406   1HA   GLY  48          1HA       GLY  48   0.876  -7.043  -5.875
  407   2HA   GLY  48          2HA       GLY  48   1.404  -5.338  -5.853
  408    QA   GLY  48           QA       GLY  48   1.140  -6.190  -5.864
  409    H    CYS  49           H        CYS  49  -0.121  -7.030  -3.683
  410    HA   CYS  49           HA       CYS  49  -2.346  -5.090  -3.396
  411   1HB   CYS  49          1HB       CYS  49  -2.467  -8.104  -3.097
  412   2HB   CYS  49          2HB       CYS  49  -3.761  -7.040  -2.648
  413    QB   CYS  49           QB       CYS  49  -3.114  -7.572  -2.872
  414    H    ALA  50           H        ALA  50  -3.141  -4.916  -1.388
  415    HA   ALA  50           HA       ALA  50  -1.657  -6.136   0.822
  416   1HB   ALA  50          3HB       ALA  50  -0.376  -4.014   0.337
  417   2HB   ALA  50          1HB       ALA  50  -1.899  -3.104   0.466
  418   3HB   ALA  50          2HB       ALA  50  -1.226  -3.923   1.892
  419    QB   ALA  50           QB       ALA  50  -1.167  -3.680   0.898
  420    H    THR  51           H        THR  51  -2.754  -6.357   2.612
  421    HA   THR  51           HA       THR  51  -5.639  -5.647   2.534
  422    HB   THR  51           HB       THR  51  -4.028  -7.222   4.582
  423    HG1  THR  51          1HG       THR  51  -4.945  -9.013   3.501
  424   1HG2  THR  51          2HG2      THR  51  -6.220  -6.286   5.428
  425   2HG2  THR  51          3HG2      THR  51  -7.041  -7.109   4.083
  426   3HG2  THR  51          1HG2      THR  51  -6.221  -8.057   5.336
  427    QG2  THR  51           QG2      THR  51  -6.494  -7.150   4.949
  428    H    ILE  52           H        ILE  52  -6.393  -3.987   3.862
  429    HA   ILE  52           HA       ILE  52  -4.296  -2.291   5.139
  430    HB   ILE  52           HB       ILE  52  -6.666  -1.464   3.417
  431   1HG1  ILE  52          1HG1      ILE  52  -3.776  -1.888   2.801
  432   2HG1  ILE  52          2HG1      ILE  52  -5.199  -2.223   1.834
  433   1HG2  ILE  52          1HG2      ILE  52  -6.226   0.198   5.172
  434   2HG2  ILE  52          2HG2      ILE  52  -4.526   0.293   4.653
  435   3HG2  ILE  52          3HG2      ILE  52  -5.847   0.815   3.580
  436   1HD1  ILE  52          3HD1      ILE  52  -5.402   0.229   1.359
  437   2HD1  ILE  52          1HD1      ILE  52  -3.927   0.516   2.319
  438   3HD1  ILE  52          2HD1      ILE  52  -3.837  -0.442   0.851
  439    QG1  ILE  52           QG1      ILE  52  -4.488  -2.056   2.317
  440    QG2  ILE  52           QG2      ILE  52  -5.533   0.435   4.468
  441    QD1  ILE  52           QD1      ILE  52  -4.389   0.101   1.510
  442    H    TRP  53           H        TRP  53  -5.169  -0.982   6.960
  443    HA   TRP  53           HA       TRP  53  -7.716  -1.962   8.123
  444   1HB   TRP  53          1HB       TRP  53  -4.961  -2.029   9.329
  445   2HB   TRP  53          2HB       TRP  53  -6.413  -2.124  10.301
  446    HD1  TRP  53           HD       TRP  53  -7.921  -4.327  10.124
  447    HE1  TRP  53          1HE       TRP  53  -7.438  -6.710   9.337
  448    HE3  TRP  53          3HE       TRP  53  -3.523  -3.464   7.698
  449    HZ2  TRP  53          2HZ       TRP  53  -5.293  -8.109   7.948
  450    HZ3  TRP  53          3HZ       TRP  53  -2.244  -5.334   6.718
  451    HH2  TRP  53           HH       TRP  53  -3.098  -7.666   6.861
  452    QB   TRP  53           QB       TRP  53  -5.687  -2.076   9.815
  453    H    GLU  54           H        GLU  54  -8.652  -0.739   9.709
  454    HA   GLU  54           HA       GLU  54  -7.994   2.113   9.979
  455   1HB   GLU  54          1HB       GLU  54 -10.322   1.285   9.740
  456   2HB   GLU  54          2HB       GLU  54 -10.130   0.286  11.177
  457   1HG   GLU  54          1HG       GLU  54 -11.368   2.176  11.859
  458   2HG   GLU  54          2HG       GLU  54  -9.759   2.419  12.531
  459    QB   GLU  54           QB       GLU  54 -10.226   0.785  10.458
  460    QG   GLU  54           QG       GLU  54 -10.563   2.298  12.195
  461    H    GLY  55           H        GLY  55  -7.873  -1.007  11.864
  462   1HA   GLY  55          1HA       GLY  55  -7.212   0.314  14.335
  463   2HA   GLY  55          2HA       GLY  55  -6.811  -1.344  13.992
  464    QA   GLY  55           QA       GLY  55  -7.011  -0.515  14.164
  465    H    SER  56           H        SER  56  -5.422   1.252  14.884
  466    HA   SER  56           HA       SER  56  -3.091   1.554  13.135
  467   1HB   SER  56          1HB       SER  56  -3.409   2.337  16.058
  468   2HB   SER  56          2HB       SER  56  -2.198   2.925  14.911
  469    HG   SER  56           HG       SER  56  -5.007   3.198  14.532
  470    QB   SER  56           QB       SER  56  -2.804   2.631  15.485
  471    H    GLY  57           H        GLY  57  -1.890  -0.338  12.912
  472   1HA   GLY  57          1HA       GLY  57  -0.373  -1.936  13.730
  473   2HA   GLY  57          2HA       GLY  57  -1.311  -2.000  15.213
  474    QA   GLY  57           QA       GLY  57  -0.842  -1.968  14.471
  475    H    CYS  58           H        CYS  58  -2.601  -1.941  11.933
  476    HA   CYS  58           HA       CYS  58  -3.821  -3.369  10.700
  477   1HB   CYS  58          1HB       CYS  58  -2.681  -5.354   9.970
  478   2HB   CYS  58          2HB       CYS  58  -1.566  -3.989  10.042
  479    QB   CYS  58           QB       CYS  58  -2.123  -4.671  10.006
  480    H    VAL  59           H        VAL  59  -5.145  -3.268  12.993
  481    HA   VAL  59           HA       VAL  59  -6.550  -5.850  12.959
  482    HB   VAL  59           HB       VAL  59  -7.219  -5.279  15.284
  483   1HG1  VAL  59          2HG1      VAL  59  -5.553  -7.052  14.776
  484   2HG1  VAL  59          3HG1      VAL  59  -4.247  -5.861  14.943
  485   3HG1  VAL  59          1HG1      VAL  59  -5.245  -6.288  16.345
  486   1HG2  VAL  59          3HG2      VAL  59  -4.867  -3.349  15.289
  487   2HG2  VAL  59          1HG2      VAL  59  -6.592  -2.952  15.496
  488   3HG2  VAL  59          2HG2      VAL  59  -5.752  -3.912  16.712
  489    QG1  VAL  59           QG1      VAL  59  -5.015  -6.400  15.355
  490    QG2  VAL  59           QG2      VAL  59  -5.737  -3.404  15.832
  491    QQG  VAL  59           QQG      VAL  59  -5.376  -4.902  15.593
  492    H    GLY  60           H        GLY  60  -8.947  -5.282  13.675
  493   1HA   GLY  60          1HA       GLY  60 -10.676  -3.679  13.899
  494   2HA   GLY  60          2HA       GLY  60  -9.615  -2.433  13.265
  495    QA   GLY  60           QA       GLY  60 -10.146  -3.056  13.582
  496    H    ARG  61           H        ARG  61 -11.173  -1.676  11.762
  497    HA   ARG  61           HA       ARG  61 -12.534  -3.559   9.907
  498   1HB   ARG  61          1HB       ARG  61 -13.386  -1.108  10.867
  499   2HB   ARG  61          2HB       ARG  61 -12.597  -0.657   9.349
  500   1HG   ARG  61          1HG       ARG  61 -13.994  -2.713   8.358
  501   2HG   ARG  61          2HG       ARG  61 -14.935  -2.515   9.848
  502   1HD   ARG  61          1HD       ARG  61 -14.960   0.034   9.089
  503   2HD   ARG  61          2HD       ARG  61 -14.580  -0.597   7.505
  504    HE   ARG  61           HE       ARG  61 -17.074  -0.497   8.828
  505   1HH1  ARG  61          2HH2      ARG  61 -15.483  -2.593   6.504
  506   2HH1  ARG  61          1HH2      ARG  61 -16.855  -3.627   6.230
  507   1HH2  ARG  61          2HH1      ARG  61 -18.906  -1.331   8.052
  508   2HH2  ARG  61          1HH1      ARG  61 -19.022  -2.804   7.142
  509    QB   ARG  61           QB       ARG  61 -12.991  -0.882  10.108
  510    QG   ARG  61           QG       ARG  61 -14.464  -2.614   9.103
  511    QD   ARG  61           QD       ARG  61 -14.770  -0.282   8.297
  512    QH1  ARG  61           QH2      ARG  61 -16.169  -3.110   6.367
  513    QH2  ARG  61           QH1      ARG  61 -18.964  -2.068   7.597
  514    H    SER  62           H        SER  62 -12.110  -3.607   7.710
  515    HA   SER  62           HA       SER  62  -9.424  -2.663   7.089
  516   1HB   SER  62          1HB       SER  62  -9.014  -5.120   6.315
  517   2HB   SER  62          2HB       SER  62  -9.071  -4.789   8.043
  518    HG   SER  62           HG       SER  62 -10.354  -6.580   7.505
  519    QB   SER  62           QB       SER  62  -9.043  -4.955   7.179
  520    H    THR  63           H        THR  63  -8.795  -3.368   4.799
  521    HA   THR  63           HA       THR  63 -11.028  -4.066   3.106
  522    HB   THR  63           HB       THR  63 -11.191  -1.610   2.915
  523    HG1  THR  63          1HG       THR  63 -10.863  -1.582   0.584
  524   1HG2  THR  63          1HG2      THR  63  -8.839  -0.965   3.305
  525   2HG2  THR  63          2HG2      THR  63  -8.368  -1.721   1.761
  526   3HG2  THR  63          3HG2      THR  63  -9.447  -0.320   1.776
  527    QG2  THR  63           QG2      THR  63  -8.885  -1.002   2.281
  528    H    THR  64           H        THR  64  -9.829  -4.110   0.734
  529    HA   THR  64           HA       THR  64  -7.103  -5.172   1.004
  530    HB   THR  64           HB       THR  64  -8.389  -7.190   1.011
  531    HG1  THR  64          1HG       THR  64  -7.768  -7.484  -1.566
  532   1HG2  THR  64          1HG2      THR  64 -10.523  -6.369   0.075
  533   2HG2  THR  64          2HG2      THR  64  -9.752  -6.188  -1.512
  534   3HG2  THR  64          3HG2      THR  64  -9.935  -7.802  -0.785
  535    QG2  THR  64           QG2      THR  64 -10.070  -6.786  -0.741
  536    H    MET  65           H        MET  65  -5.936  -4.051  -0.307
  537    HA   MET  65           HA       MET  65  -7.249  -2.367  -2.422
  538   1HB   MET  65          1HB       MET  65  -6.441  -1.337  -0.142
  539   2HB   MET  65          2HB       MET  65  -4.817  -1.578  -0.810
  540   1HG   MET  65          1HG       MET  65  -5.322   0.598  -1.489
  541   2HG   MET  65          2HG       MET  65  -5.850  -0.322  -2.905
  542   1HE   MET  65          1HE       MET  65  -6.641   2.645  -2.436
  543   2HE   MET  65          2HE       MET  65  -7.249   1.671  -3.801
  544   3HE   MET  65          3HE       MET  65  -8.384   2.611  -2.801
  545    QB   MET  65           QB       MET  65  -5.629  -1.457  -0.476
  546    QG   MET  65           QG       MET  65  -5.586   0.138  -2.197
  547    QE   MET  65           QE       MET  65  -7.425   2.309  -3.013
  548    H    CYS  66           H        CYS  66  -6.451  -2.872  -4.428
  549    HA   CYS  66           HA       CYS  66  -3.764  -4.201  -4.614
  550   1HB   CYS  66          1HB       CYS  66  -6.261  -4.613  -6.232
  551   2HB   CYS  66          2HB       CYS  66  -4.679  -5.207  -6.724
  552    QB   CYS  66           QB       CYS  66  -5.470  -4.910  -6.478
  553    H    CYS  67           H        CYS  67  -2.407  -3.460  -6.225
  554    HA   CYS  67           HA       CYS  67  -3.259  -1.054  -7.779
  555   1HB   CYS  67          1HB       CYS  67  -2.076  -0.455  -5.689
  556   2HB   CYS  67          2HB       CYS  67  -0.705  -1.436  -6.232
  557    QB   CYS  67           QB       CYS  67  -1.391  -0.945  -5.961
  558    HA   PRO  68           HA       PRO  68  -1.480  -3.810 -10.919
  559   1HB   PRO  68          1HB       PRO  68  -1.359  -1.143 -12.348
  560   2HB   PRO  68          2HB       PRO  68  -1.823  -2.741 -13.012
  561   1HG   PRO  68          1HG       PRO  68  -3.771  -1.043 -12.321
  562   2HG   PRO  68          2HG       PRO  68  -3.864  -2.735 -11.824
  563   1HD   PRO  68          1HD       PRO  68  -3.053  -0.390 -10.111
  564   2HD   PRO  68          2HD       PRO  68  -4.097  -1.790  -9.731
  565    QB   PRO  68           QB       PRO  68  -1.591  -1.942 -12.680
  566    QG   PRO  68           QG       PRO  68  -3.817  -1.889 -12.072
  567    QD   PRO  68           QD       PRO  68  -3.575  -1.090  -9.921
  568    H    ALA  69           H        ALA  69   0.661  -4.167 -11.850
  569    HA   ALA  69           HA       ALA  69   2.791  -2.963 -10.274
  570   1HB   ALA  69          1HB       ALA  69   2.864  -4.910 -12.634
  571   2HB   ALA  69          2HB       ALA  69   4.276  -4.399 -11.702
  572   3HB   ALA  69          3HB       ALA  69   2.987  -5.317 -10.923
  573    QB   ALA  69           QB       ALA  69   3.375  -4.875 -11.753
  574    H    ASN  70           H        ASN  70   4.362  -1.530 -11.045
  575    HA   ASN  70           HA       ASN  70   4.998   0.423 -11.948
  576   1HB   ASN  70          1HB       ASN  70   4.438  -1.150 -14.486
  577   2HB   ASN  70          2HB       ASN  70   5.060   0.506 -14.498
  578   1HD2  ASN  70          2HD2      ASN  70   7.631  -2.445 -13.561
  579   2HD2  ASN  70          1HD2      ASN  70   6.029  -2.761 -14.232
  580    QB   ASN  70           QB       ASN  70   4.749  -0.322 -14.492
  581    QD2  ASN  70           QD2      ASN  70   6.830  -2.603 -13.897
  582    H    THR  71           H        THR  71   2.853   0.952 -10.726
  583    HA   THR  71           HA       THR  71   1.689   2.996 -12.391
  584    HB   THR  71           HB       THR  71   0.297   0.512 -12.187
  585    HG1  THR  71          1HG       THR  71  -1.136   1.610 -13.508
  586   1HG2  THR  71          1HG2      THR  71  -0.659   1.250 -10.080
  587   2HG2  THR  71          2HG2      THR  71  -1.293   2.735 -10.841
  588   3HG2  THR  71          3HG2      THR  71  -1.873   1.147 -11.350
  589    QG2  THR  71           QG2      THR  71  -1.275   1.711 -10.757
  590    H    CYS  72           H        CYS  72   0.377   4.481 -11.152
  591    HA   CYS  72           HA       CYS  72   1.418   4.862  -8.372
  592   1HB   CYS  72          1HB       CYS  72   2.199   6.674  -9.732
  593   2HB   CYS  72          2HB       CYS  72   0.692   6.699 -10.654
  594    QB   CYS  72           QB       CYS  72   1.446   6.687 -10.193
  595    H    CYS  73           H        CYS  73  -0.086   4.737  -6.795
  596    HA   CYS  73           HA       CYS  73  -2.999   4.787  -7.471
  597   1HB   CYS  73          1HB       CYS  73  -1.314   2.859  -5.831
  598   2HB   CYS  73          2HB       CYS  73  -3.059   2.962  -5.666
  599    QB   CYS  73           QB       CYS  73  -2.187   2.911  -5.748
  600    H    ASN  74           H        ASN  74  -3.890   6.482  -6.387
  601    HA   ASN  74           HA       ASN  74  -2.651   7.732  -4.076
  602   1HB   ASN  74          1HB       ASN  74  -4.094   9.020  -5.627
  603   2HB   ASN  74          2HB       ASN  74  -5.424   7.924  -5.259
  604   1HD2  ASN  74          2HD2      ASN  74  -4.348  10.389  -2.113
  605   2HD2  ASN  74          1HD2      ASN  74  -3.100   9.466  -2.891
  606    QB   ASN  74           QB       ASN  74  -4.759   8.472  -5.443
  607    QD2  ASN  74           QD2      ASN  74  -3.724   9.928  -2.502
  608    H    ILE  75           H        ILE  75  -2.890   7.084  -1.933
  609    HA   ILE  75           HA       ILE  75  -4.861   5.027  -1.222
  610    HB   ILE  75           HB       ILE  75  -2.357   6.241  -0.073
  611   1HG1  ILE  75          1HG1      ILE  75  -1.830   3.957   0.321
  612   2HG1  ILE  75          2HG1      ILE  75  -3.484   3.432  -0.109
  613   1HG2  ILE  75          1HG2      ILE  75  -4.478   4.902   1.607
  614   2HG2  ILE  75          2HG2      ILE  75  -2.765   5.089   2.065
  615   3HG2  ILE  75          3HG2      ILE  75  -3.758   6.527   1.842
  616   1HD1  ILE  75          2HD1      ILE  75  -1.492   4.735  -1.954
  617   2HD1  ILE  75          3HD1      ILE  75  -1.810   2.978  -1.869
  618   3HD1  ILE  75          1HD1      ILE  75  -3.063   4.066  -2.454
  619    QG1  ILE  75           QG1      ILE  75  -2.657   3.694   0.106
  620    QG2  ILE  75           QG2      ILE  75  -3.667   5.506   1.838
  621    QD1  ILE  75           QD1      ILE  75  -2.121   3.926  -2.092
  622    H    ASN  76           H        ASN  76  -6.861   5.769  -1.015
  623    HA   ASN  76           HA       ASN  76  -7.387   7.137   1.414
  624   1HB   ASN  76          1HB       ASN  76  -7.812   8.706  -1.125
  625   2HB   ASN  76          2HB       ASN  76  -9.107   8.734   0.075
  626   1HD2  ASN  76          2HD2      ASN  76  -6.655  11.560   0.722
  627   2HD2  ASN  76          1HD2      ASN  76  -7.502  11.038  -0.722
  628    QB   ASN  76           QB       ASN  76  -8.460   8.720  -0.525
  629    QD2  ASN  76           QD2      ASN  76  -7.078  11.299   0.000
  630    H    THR  77           H        THR  77  -8.541   5.375   2.086
  631    HA   THR  77           HA       THR  77 -10.246   3.899   0.233
  632    HB   THR  77           HB       THR  77 -10.673   2.497   2.213
  633    HG1  THR  77          1HG       THR  77  -9.778   3.099   4.181
  634   1HG2  THR  77          2HG2      THR  77  -7.721   3.180   1.846
  635   2HG2  THR  77          3HG2      THR  77  -8.373   1.718   2.605
  636   3HG2  THR  77          1HG2      THR  77  -8.667   2.029   0.883
  637    QG2  THR  77           QG2      THR  77  -8.254   2.309   1.778
  638    H    GLY  78           H        GLY  78 -12.421   3.450   2.166
  639   1HA   GLY  78          1HA       GLY  78 -13.951   5.953   1.942
  640   2HA   GLY  78          2HA       GLY  78 -14.470   4.413   2.597
  641    QA   GLY  78           QA       GLY  78 -14.211   5.183   2.270
  642    H    PHE  79           H        PHE  79 -11.468   4.913   4.099
  643    HA   PHE  79           HA       PHE  79 -12.503   6.521   6.326
  644   1HB   PHE  79          1HB       PHE  79 -11.704   4.654   7.765
  645   2HB   PHE  79          2HB       PHE  79 -13.176   4.256   6.920
  646    HD1  PHE  79          2HD       PHE  79 -13.031   2.677   4.888
  647    HD2  PHE  79          1HD       PHE  79  -9.778   3.282   7.645
  648    HE1  PHE  79          2HE       PHE  79 -12.029   0.531   4.177
  649    HE2  PHE  79          1HE       PHE  79  -8.749   1.174   6.907
  650   1HZ   PHE  79           HZ       PHE  79  -9.892  -0.250   5.215
  651    QB   PHE  79           QB       PHE  79 -12.440   4.455   7.343
  652    QG   PHE  79           QD       PHE  79 -11.404   2.980   6.266
  653    QZ   PHE  79           QE       PHE  79 -10.389   0.853   5.542
  654    QZ   PHE  79           QR       PHE  79 -10.696   1.483   5.766
  655    H    TYR  80           H        TYR  80 -10.658   6.521   8.024
  656    HA   TYR  80           HA       TYR  80  -8.478   7.655   6.484
  657   1HB   TYR  80          1HB       TYR  80  -9.275   8.895   8.382
  658   2HB   TYR  80          2HB       TYR  80  -9.078   7.502   9.446
  659    HD1  TYR  80          2HD       TYR  80  -7.057   9.778   7.211
  660    HD2  TYR  80          1HD       TYR  80  -7.079   7.041  10.506
  661    HE1  TYR  80          2HE       TYR  80  -4.598  10.033   7.442
  662    HE2  TYR  80          1HE       TYR  80  -4.636   7.419  10.847
  663    HH   TYR  80           HH       TYR  80  -2.760   8.139   9.839
  664    QB   TYR  80           QB       TYR  80  -9.177   8.199   8.914
  665    QG   TYR  80           QD       TYR  80  -7.068   8.410   8.859
  666    QZ   TYR  80           QE       TYR  80  -4.617   8.726   9.145
  667    QR   TYR  80           QR       TYR  80  -5.842   8.568   9.002
  668    H    ILE  81           H        ILE  81  -6.453   6.628   6.338
  669    HA   ILE  81           HA       ILE  81  -6.621   3.752   6.875
  670    HB   ILE  81           HB       ILE  81  -4.482   3.862   5.379
  671   1HG1  ILE  81          1HG1      ILE  81  -4.735   6.501   5.366
  672   2HG1  ILE  81          2HG1      ILE  81  -4.329   5.640   3.912
  673   1HG2  ILE  81          1HG2      ILE  81  -7.354   4.020   4.426
  674   2HG2  ILE  81          2HG2      ILE  81  -5.967   3.438   3.463
  675   3HG2  ILE  81          3HG2      ILE  81  -6.467   2.588   4.935
  676   1HD1  ILE  81          3HD1      ILE  81  -7.221   6.372   4.517
  677   2HD1  ILE  81          1HD1      ILE  81  -6.099   7.366   3.581
  678   3HD1  ILE  81          2HD1      ILE  81  -6.533   5.732   3.028
  679    QG1  ILE  81           QG1      ILE  81  -4.532   6.070   4.639
  680    QG2  ILE  81           QG2      ILE  81  -6.596   3.349   4.275
  681    QD1  ILE  81           QD1      ILE  81  -6.618   6.490   3.709
  682    H    ARG  82           H        ARG  82  -5.281   2.690   8.301
  683    HA   ARG  82           HA       ARG  82  -3.218   4.349   9.714
  684   1HB   ARG  82          1HB       ARG  82  -5.513   2.642  10.650
  685   2HB   ARG  82          2HB       ARG  82  -4.101   2.863  11.703
  686   1HG   ARG  82          1HG       ARG  82  -4.277   5.193  11.724
  687   2HG   ARG  82          2HG       ARG  82  -5.470   5.205  10.403
  688   1HD   ARG  82          1HD       ARG  82  -7.180   4.242  11.719
  689   2HD   ARG  82          2HD       ARG  82  -6.126   3.983  13.115
  690    HE   ARG  82           HE       ARG  82  -7.664   6.219  12.453
  691   1HH1  ARG  82          2HH2      ARG  82  -4.589   5.300  13.931
  692   2HH1  ARG  82          1HH2      ARG  82  -4.161   6.872  14.510
  693   1HH2  ARG  82          2HH1      ARG  82  -7.170   8.366  13.237
  694   2HH2  ARG  82          1HH1      ARG  82  -5.761   8.673  14.210
  695    QB   ARG  82           QB       ARG  82  -4.807   2.752  11.177
  696    QG   ARG  82           QG       ARG  82  -4.874   5.199  11.064
  697    QD   ARG  82           QD       ARG  82  -6.653   4.113  12.417
  698    QH1  ARG  82           QH2      ARG  82  -4.375   6.086  14.220
  699    QH2  ARG  82           QH1      ARG  82  -6.465   8.520  13.724
  700    H    SER  83           H        SER  83  -4.005   1.013   8.621
  701    HA   SER  83           HA       SER  83  -1.070   0.686   8.651
  702   1HB   SER  83          1HB       SER  83  -2.615  -1.661   9.600
  703   2HB   SER  83          2HB       SER  83  -0.926  -1.238   9.884
  704    HG   SER  83           HG       SER  83  -3.242  -0.088  11.114
  705    QB   SER  83           QB       SER  83  -1.770  -1.450   9.742
  706    H    TYR  84           H        TYR  84  -0.338  -1.151   7.327
  707    HA   TYR  84           HA       TYR  84  -2.331  -2.656   5.964
  708   1HB   TYR  84          1HB       TYR  84  -1.933  -2.207   3.773
  709   2HB   TYR  84          2HB       TYR  84  -2.126  -0.595   4.459
  710    HD1  TYR  84          2HD       TYR  84   1.000  -0.669   5.478
  711    HD2  TYR  84          1HD       TYR  84  -1.098  -1.252   1.752
  712    HE1  TYR  84          2HE       TYR  84   3.033  -0.075   4.222
  713    HE2  TYR  84          1HE       TYR  84   0.962  -0.682   0.511
  714    HH   TYR  84           HH       TYR  84   3.928   0.367   2.133
  715    QB   TYR  84           QB       TYR  84  -2.030  -1.401   4.116
  716    QG   TYR  84           QD       TYR  84  -0.049  -0.960   3.615
  717    QZ   TYR  84           QE       TYR  84   1.997  -0.378   2.366
  718    QR   TYR  84           QR       TYR  84   0.974  -0.669   2.991
  719    H    ARG  85           H        ARG  85  -1.393  -4.313   4.563
  720    HA   ARG  85           HA       ARG  85   1.491  -4.839   4.827
  721   1HB   ARG  85          1HB       ARG  85   0.696  -5.743   6.922
  722   2HB   ARG  85          2HB       ARG  85  -0.581  -6.645   6.115
  723   1HG   ARG  85          1HG       ARG  85   2.084  -7.298   5.052
  724   2HG   ARG  85          2HG       ARG  85   1.936  -7.612   6.797
  725   1HD   ARG  85          1HD       ARG  85   0.072  -8.993   6.577
  726   2HD   ARG  85          2HD       ARG  85  -0.266  -8.436   4.912
  727    HE   ARG  85           HE       ARG  85   1.913  -9.454   4.290
  728   1HH1  ARG  85          2HH2      ARG  85  -0.843 -10.777   6.041
  729   2HH1  ARG  85          1HH2      ARG  85  -0.590 -12.401   5.466
  730   1HH2  ARG  85          2HH1      ARG  85   2.425 -11.588   3.764
  731   2HH2  ARG  85          1HH1      ARG  85   1.298 -12.878   4.067
  732    QB   ARG  85           QB       ARG  85   0.058  -6.194   6.519
  733    QG   ARG  85           QG       ARG  85   2.010  -7.455   5.925
  734    QD   ARG  85           QD       ARG  85  -0.097  -8.715   5.745
  735    QH1  ARG  85           QH2      ARG  85  -0.717 -11.589   5.753
  736    QH2  ARG  85           QH1      ARG  85   1.861 -12.233   3.916
  737    H    ARG  86           H        ARG  86   2.062  -5.462   2.788
  738    HA   ARG  86           HA       ARG  86   0.406  -6.228   0.752
  739   1HB   ARG  86          1HB       ARG  86   3.299  -6.819   1.272
  740   2HB   ARG  86          2HB       ARG  86   2.471  -7.690  -0.030
  741   1HG   ARG  86          1HG       ARG  86   1.770  -5.549  -1.064
  742   2HG   ARG  86          2HG       ARG  86   2.727  -4.710   0.172
  743   1HD   ARG  86          1HD       ARG  86   4.086  -4.963  -1.866
  744   2HD   ARG  86          2HD       ARG  86   4.750  -5.982  -0.600
  745    HE   ARG  86           HE       ARG  86   2.822  -7.208  -2.568
  746   1HH1  ARG  86          2HH2      ARG  86   6.329  -6.612  -1.880
  747   2HH1  ARG  86          1HH2      ARG  86   6.763  -8.166  -2.495
  748   1HH2  ARG  86          2HH1      ARG  86   3.639  -9.023  -3.780
  749   2HH2  ARG  86          1HH1      ARG  86   5.286  -9.546  -3.448
  750    QB   ARG  86           QB       ARG  86   2.885  -7.254   0.621
  751    QG   ARG  86           QG       ARG  86   2.249  -5.129  -0.446
  752    QD   ARG  86           QD       ARG  86   4.418  -5.473  -1.233
  753    QH1  ARG  86           QH2      ARG  86   6.546  -7.389  -2.187
  754    QH2  ARG  86           QH1      ARG  86   4.463  -9.285  -3.614
  755    H    VAL  87           H        VAL  87  -0.422  -8.106  -0.085
  756    HA   VAL  87           HA       VAL  87   0.008 -10.653   1.428
  757    HB   VAL  87           HB       VAL  87  -1.899 -11.553   0.260
  758   1HG1  VAL  87          1HG1      VAL  87  -2.137 -10.544   2.506
  759   2HG1  VAL  87          2HG1      VAL  87  -2.541  -8.981   1.764
  760   3HG1  VAL  87          3HG1      VAL  87  -3.620 -10.374   1.547
  761   1HG2  VAL  87          1HG2      VAL  87  -2.395  -8.745  -0.799
  762   2HG2  VAL  87          2HG2      VAL  87  -1.994 -10.177  -1.779
  763   3HG2  VAL  87          3HG2      VAL  87  -3.520 -10.110  -0.899
  764    QG1  VAL  87           QG1      VAL  87  -2.766  -9.966   1.939
  765    QG2  VAL  87           QG2      VAL  87  -2.636  -9.677  -1.159
  766    QQG  VAL  87           QQG      VAL  87  -2.701  -9.822   0.390
  767    H    GLU  88           H        GLU  88   0.200  -9.039  -1.824
  768    HA   GLU  88           HA       GLU  88   2.356 -10.677  -2.637
  769   1HB   GLU  88          1HB       GLU  88  -0.181 -11.942  -2.980
  770   2HB   GLU  88          2HB       GLU  88   0.294 -11.353  -4.568
  771   1HG   GLU  88          1HG       GLU  88   2.436 -12.514  -4.425
  772   2HG   GLU  88          2HG       GLU  88   2.157 -12.934  -2.734
  773    QB   GLU  88           QB       GLU  88   0.057 -11.647  -3.774
  774    QG   GLU  88           QG       GLU  88   2.297 -12.724  -3.579
   
  No H/Q in entry =         774
  Start of MODEL   20
    1   1HA   GLY   1          1HA       GLY   1  12.891  -0.202 -13.996
    2   2HA   GLY   1          2HA       GLY   1  13.093  -1.488 -15.205
    3    QA   GLY   1           QA       GLY   1  12.992  -0.845 -14.601
    4    H    ASP   2           H        ASP   2  12.129  -1.691 -12.402
    5    HA   ASP   2           HA       ASP   2  13.338  -4.063 -11.510
    6   1HB   ASP   2          1HB       ASP   2  14.529  -1.582 -10.481
    7   2HB   ASP   2          2HB       ASP   2  13.651  -2.408  -9.203
    8    QB   ASP   2           QB       ASP   2  14.090  -1.995  -9.842
    9    H    GLY   3           H        GLY   3  11.630  -4.980 -10.604
   10   1HA   GLY   3          1HA       GLY   3   9.158  -3.571 -10.257
   11   2HA   GLY   3          2HA       GLY   3   9.424  -5.287  -9.908
   12    QA   GLY   3           QA       GLY   3   9.291  -4.429 -10.082
   13    H    TYR   4           H        TYR   4   7.876  -3.559  -8.225
   14    HA   TYR   4           HA       TYR   4   8.855  -4.189  -5.681
   15   1HB   TYR   4          1HB       TYR   4   9.310  -1.787  -4.873
   16   2HB   TYR   4          2HB       TYR   4  10.567  -2.519  -5.822
   17    HD1  TYR   4          2HD       TYR   4   7.495  -0.314  -6.289
   18    HD2  TYR   4          1HD       TYR   4  11.395  -1.440  -7.763
   19    HE1  TYR   4          2HE       TYR   4   7.429   1.495  -7.925
   20    HE2  TYR   4          1HE       TYR   4  11.459   0.605  -9.115
   21    HH   TYR   4           HH       TYR   4  10.303   2.466  -9.814
   22    QB   TYR   4           QB       TYR   4   9.939  -2.153  -5.348
   23    QG   TYR   4           QD       TYR   4   9.445  -0.877  -7.026
   24    QZ   TYR   4           QE       TYR   4   9.444   1.050  -8.520
   25    QR   TYR   4           QR       TYR   4   9.445   0.087  -7.773
   26    H    LEU   5           H        LEU   5   7.668  -2.929  -4.001
   27    HA   LEU   5           HA       LEU   5   5.363  -1.365  -4.900
   28   1HB   LEU   5          1HB       LEU   5   4.419  -3.559  -4.645
   29   2HB   LEU   5          2HB       LEU   5   5.137  -3.768  -3.053
   30    HG   LEU   5           HG       LEU   5   3.304  -1.403  -3.511
   31   1HD1  LEU   5          3HD1      LEU   5   2.455  -4.315  -3.294
   32   2HD1  LEU   5          1HD1      LEU   5   1.370  -2.986  -2.868
   33   3HD1  LEU   5          2HD1      LEU   5   1.987  -3.108  -4.523
   34   1HD2  LEU   5          3HD2      LEU   5   4.398  -1.759  -1.265
   35   2HD2  LEU   5          1HD2      LEU   5   2.636  -1.863  -1.197
   36   3HD2  LEU   5          2HD2      LEU   5   3.603  -3.334  -1.178
   37    QB   LEU   5           QB       LEU   5   4.778  -3.663  -3.849
   38    QD1  LEU   5           QD1      LEU   5   1.937  -3.470  -3.562
   39    QD2  LEU   5           QD2      LEU   5   3.546  -2.319  -1.213
   40    QQD  LEU   5           QQD      LEU   5   2.741  -2.894  -2.387
   41    H    ILE   6           H        ILE   6   5.696   0.515  -3.927
   42    HA   ILE   6           HA       ILE   6   6.579   0.765  -1.166
   43    HB   ILE   6           HB       ILE   6   8.138   2.578  -1.809
   44   1HG1  ILE   6          1HG1      ILE   6   8.904   1.666  -4.465
   45   2HG1  ILE   6          2HG1      ILE   6   7.208   2.141  -4.500
   46   1HG2  ILE   6          3HG2      ILE   6   9.019   0.350  -1.180
   47   2HG2  ILE   6          1HG2      ILE   6   9.093  -0.092  -2.894
   48   3HG2  ILE   6          2HG2      ILE   6  10.066   1.257  -2.282
   49   1HD1  ILE   6          1HD1      ILE   6   9.417   3.850  -3.318
   50   2HD1  ILE   6          2HD1      ILE   6   8.773   4.031  -4.963
   51   3HD1  ILE   6          3HD1      ILE   6   7.711   4.302  -3.566
   52    QG1  ILE   6           QG1      ILE   6   8.056   1.903  -4.483
   53    QG2  ILE   6           QG2      ILE   6   9.393   0.505  -2.119
   54    QD1  ILE   6           QD1      ILE   6   8.633   4.061  -3.949
   55    H    MET   7           H        MET   7   5.999   3.043  -0.414
   56    HA   MET   7           HA       MET   7   4.115   4.360  -2.245
   57   1HB   MET   7          1HB       MET   7   2.669   4.820  -0.262
   58   2HB   MET   7          2HB       MET   7   2.740   3.104  -0.652
   59   1HG   MET   7          1HG       MET   7   4.318   2.761   1.216
   60   2HG   MET   7          2HG       MET   7   4.267   4.501   1.543
   61   1HE   MET   7          1HE       MET   7   3.841   4.193   3.937
   62   2HE   MET   7          2HE       MET   7   2.574   3.165   4.621
   63   3HE   MET   7          3HE       MET   7   3.939   2.444   3.729
   64    QB   MET   7           QB       MET   7   2.704   3.962  -0.457
   65    QG   MET   7           QG       MET   7   4.293   3.631   1.380
   66    QE   MET   7           QE       MET   7   3.451   3.267   4.096
   67    H    CYS   8           H        CYS   8   3.535   6.530  -1.224
   68    HA   CYS   8           HA       CYS   8   6.103   7.950  -0.789
   69   1HB   CYS   8          1HB       CYS   8   4.289   8.000  -3.212
   70   2HB   CYS   8          2HB       CYS   8   5.561   9.189  -2.953
   71    QB   CYS   8           QB       CYS   8   4.925   8.594  -3.083
   72    H    LYS   9           H        LYS   9   5.862  10.165  -0.287
   73    HA   LYS   9           HA       LYS   9   3.368  10.839   0.918
   74   1HB   LYS   9          1HB       LYS   9   5.725  12.641   0.343
   75   2HB   LYS   9          2HB       LYS   9   4.372  12.868   1.438
   76   1HG   LYS   9          1HG       LYS   9   5.092  10.510   2.424
   77   2HG   LYS   9          2HG       LYS   9   6.625  10.796   1.593
   78   1HD   LYS   9          1HD       LYS   9   5.333  12.471   3.746
   79   2HD   LYS   9          2HD       LYS   9   6.764  11.406   3.861
   80   1HE   LYS   9          1HE       LYS   9   7.861  12.930   2.094
   81   2HE   LYS   9          2HE       LYS   9   6.513  14.048   2.328
   82   1HZ   LYS   9          2HZ       LYS   9   8.367  13.167   4.445
   83   2HZ   LYS   9          3HZ       LYS   9   8.463  14.582   3.611
   84   3HZ   LYS   9          1HZ       LYS   9   7.151  14.315   4.575
   85    QB   LYS   9           QB       LYS   9   5.048  12.755   0.890
   86    QG   LYS   9           QG       LYS   9   5.858  10.653   2.008
   87    QD   LYS   9           QD       LYS   9   6.048  11.938   3.804
   88    QE   LYS   9           QE       LYS   9   7.187  13.489   2.211
   89    QZ   LYS   9           QZ       LYS   9   7.994  14.022   4.210
   90    H    ASN  10           H        ASN  10   4.010  10.850  -2.219
   91    HA   ASN  10           HA       ASN  10   1.601  12.255  -2.838
   92   1HB   ASN  10          1HB       ASN  10   2.326  13.974  -4.301
   93   2HB   ASN  10          2HB       ASN  10   3.149  14.185  -2.798
   94   1HD2  ASN  10          2HD2      ASN  10   6.003  14.754  -4.809
   95   2HD2  ASN  10          1HD2      ASN  10   4.690  15.560  -3.964
   96    QB   ASN  10           QB       ASN  10   2.738  14.079  -3.549
   97    QD2  ASN  10           QD2      ASN  10   5.346  15.157  -4.387
   98    H    CYS  11           H        CYS  11   1.788  12.444  -5.602
   99    HA   CYS  11           HA       CYS  11   1.636   9.551  -6.208
  100   1HB   CYS  11          1HB       CYS  11  -0.148  11.138  -6.750
  101   2HB   CYS  11          2HB       CYS  11   0.937  12.037  -7.806
  102    QB   CYS  11           QB       CYS  11   0.395  11.588  -7.278
  103    H    ASP  12           H        ASP  12   4.166  11.588  -6.178
  104    HA   ASP  12           HA       ASP  12   5.326  10.655  -8.764
  105   1HB   ASP  12          1HB       ASP  12   5.024  13.119  -8.548
  106   2HB   ASP  12          2HB       ASP  12   6.066  13.090  -7.114
  107    QB   ASP  12           QB       ASP  12   5.545  13.104  -7.831
  108    HA   PRO  13           HA       PRO  13   8.055   8.387  -6.039
  109   1HB   PRO  13          1HB       PRO  13  10.043   7.675  -7.804
  110   2HB   PRO  13          2HB       PRO  13   8.464   6.851  -7.667
  111   1HG   PRO  13          1HG       PRO  13   9.297   8.958  -9.675
  112   2HG   PRO  13          2HG       PRO  13   8.396   7.451  -9.976
  113   1HD   PRO  13          1HD       PRO  13   7.161   9.855  -9.743
  114   2HD   PRO  13          2HD       PRO  13   6.393   8.371  -9.116
  115    QB   PRO  13           QB       PRO  13   9.254   7.263  -7.735
  116    QG   PRO  13           QG       PRO  13   8.846   8.204  -9.826
  117    QD   PRO  13           QD       PRO  13   6.777   9.113  -9.429
  118    H    ASN  14           H        ASN  14   9.281  10.770  -8.395
  119    HA   ASN  14           HA       ASN  14  11.893  10.833  -7.402
  120   1HB   ASN  14          1HB       ASN  14  10.755  11.712  -9.670
  121   2HB   ASN  14          2HB       ASN  14  10.713  13.235  -8.821
  122   1HD2  ASN  14          2HD2      ASN  14  14.054  13.898  -9.659
  123   2HD2  ASN  14          1HD2      ASN  14  12.491  14.503  -9.138
  124    QB   ASN  14           QB       ASN  14  10.734  12.473  -9.246
  125    QD2  ASN  14           QD2      ASN  14  13.272  14.201  -9.399
  126    H    THR  15           H        THR  15   9.220  13.138  -6.961
  127    HA   THR  15           HA       THR  15  10.748  14.359  -4.681
  128    HB   THR  15           HB       THR  15  10.389  15.795  -6.688
  129    HG1  THR  15          1HG       THR  15   9.550  17.549  -5.317
  130   1HG2  THR  15          1HG2      THR  15   8.010  15.000  -7.149
  131   2HG2  THR  15          2HG2      THR  15   7.499  15.968  -5.760
  132   3HG2  THR  15          3HG2      THR  15   8.257  16.754  -7.160
  133    QG2  THR  15           QG2      THR  15   7.922  15.907  -6.690
  134    H    GLY  16           H        GLY  16   8.638  12.009  -4.919
  135   1HA   GLY  16          1HA       GLY  16   6.638  12.886  -2.987
  136   2HA   GLY  16          2HA       GLY  16   7.030  11.215  -3.430
  137    QA   GLY  16           QA       GLY  16   6.834  12.051  -3.209
  138    H    SER  17           H        SER  17   9.652  11.001  -2.832
  139    HA   SER  17           HA       SER  17  10.985  10.397  -1.086
  140   1HB   SER  17          1HB       SER  17  10.397  12.669   0.022
  141   2HB   SER  17          2HB       SER  17   9.299  11.668   1.021
  142    HG   SER  17           HG       SER  17  12.080  11.779   0.884
  143    QB   SER  17           QB       SER  17   9.848  12.169   0.522
  144    H    CYS  18           H        CYS  18  10.681   8.377  -0.763
  145    HA   CYS  18           HA       CYS  18   7.962   7.288  -0.387
  146   1HB   CYS  18          1HB       CYS  18  10.165   6.737  -2.399
  147   2HB   CYS  18          2HB       CYS  18   8.721   5.767  -2.251
  148    QB   CYS  18           QB       CYS  18   9.443   6.252  -2.325
  149    H    ASP  19           H        ASP  19   7.844   5.072   0.430
  150    HA   ASP  19           HA       ASP  19  10.256   4.528   2.074
  151   1HB   ASP  19          1HB       ASP  19   8.865   3.093   3.354
  152   2HB   ASP  19          2HB       ASP  19   8.303   4.782   3.316
  153    QB   ASP  19           QB       ASP  19   8.584   3.937   3.335
  154    H    TRP  20           H        TRP  20  11.478   3.812   0.627
  155    HA   TRP  20           HA       TRP  20  11.301   1.056  -0.434
  156   1HB   TRP  20          1HB       TRP  20  13.725   2.882  -0.199
  157   2HB   TRP  20          2HB       TRP  20  13.518   1.472  -1.223
  158    HD1  TRP  20           HD       TRP  20  12.708   5.191  -0.973
  159    HE1  TRP  20          1HE       TRP  20  12.082   6.121  -3.243
  160    HE3  TRP  20          3HE       TRP  20  12.450   0.809  -3.569
  161    HZ2  TRP  20          2HZ       TRP  20  11.386   5.092  -5.868
  162    HZ3  TRP  20          3HZ       TRP  20  11.894   0.816  -5.976
  163    HH2  TRP  20           HH       TRP  20  11.291   2.945  -7.125
  164    QB   TRP  20           QB       TRP  20  13.622   2.177  -0.711
  165    H    LYS  21           H        LYS  21  10.433   0.964   1.873
  166    HA   LYS  21           HA       LYS  21  12.545   0.005   3.740
  167   1HB   LYS  21          1HB       LYS  21  10.759   2.116   4.314
  168   2HB   LYS  21          2HB       LYS  21   9.947   0.695   4.976
  169   1HG   LYS  21          1HG       LYS  21  11.306   1.573   6.712
  170   2HG   LYS  21          2HG       LYS  21  12.174   0.135   6.141
  171   1HD   LYS  21          1HD       LYS  21  13.495   1.731   4.581
  172   2HD   LYS  21          2HD       LYS  21  12.706   3.050   5.408
  173   1HE   LYS  21          1HE       LYS  21  14.690   0.995   6.460
  174   2HE   LYS  21          2HE       LYS  21  14.925   2.749   6.348
  175   1HZ   LYS  21          1HZ       LYS  21  13.139   2.919   8.100
  176   2HZ   LYS  21          2HZ       LYS  21  13.207   1.279   8.237
  177   3HZ   LYS  21          3HZ       LYS  21  14.516   2.150   8.603
  178    QB   LYS  21           QB       LYS  21  10.353   1.405   4.645
  179    QG   LYS  21           QG       LYS  21  11.740   0.854   6.426
  180    QD   LYS  21           QD       LYS  21  13.101   2.391   4.995
  181    QE   LYS  21           QE       LYS  21  14.807   1.872   6.404
  182    QZ   LYS  21           QZ       LYS  21  13.621   2.116   8.314
  183    H    GLN  22           H        GLN  22  11.174  -1.640   5.319
  184    HA   GLN  22           HA       GLN  22  10.322  -3.665   3.431
  185   1HB   GLN  22          1HB       GLN  22  11.405  -4.046   5.728
  186   2HB   GLN  22          2HB       GLN  22   9.800  -3.726   6.415
  187   1HG   GLN  22          1HG       GLN  22   8.834  -5.618   5.239
  188   2HG   GLN  22          2HG       GLN  22  10.305  -5.833   4.276
  189   1HE2  GLN  22          2HE2      GLN  22  12.240  -7.237   6.999
  190   2HE2  GLN  22          1HE2      GLN  22  12.367  -6.152   5.605
  191    QB   GLN  22           QB       GLN  22  10.603  -3.886   6.072
  192    QG   GLN  22           QG       GLN  22   9.570  -5.726   4.757
  193    QE2  GLN  22           QE2      GLN  22  12.304  -6.694   6.302
  194    H    ASN  23           H        ASN  23   8.244  -4.296   3.031
  195    HA   ASN  23           HA       ASN  23   5.934  -2.702   4.077
  196   1HB   ASN  23          1HB       ASN  23   6.669  -3.146   1.153
  197   2HB   ASN  23          2HB       ASN  23   5.083  -2.600   1.694
  198   1HD2  ASN  23          2HD2      ASN  23   7.578   0.292   0.926
  199   2HD2  ASN  23          1HD2      ASN  23   7.261  -1.175   0.013
  200    QB   ASN  23           QB       ASN  23   5.876  -2.873   1.423
  201    QD2  ASN  23           QD2      ASN  23   7.420  -0.442   0.469
  202    H    TRP  24           H        TRP  24   7.307  -5.814   3.436
  203    HA   TRP  24           HA       TRP  24   4.995  -7.038   2.193
  204   1HB   TRP  24          1HB       TRP  24   7.134  -7.354   1.240
  205   2HB   TRP  24          2HB       TRP  24   7.894  -7.547   2.818
  206    HD1  TRP  24           HD       TRP  24   7.981  -9.622   3.924
  207    HE1  TRP  24          1HE       TRP  24   7.565 -12.152   3.225
  208    HE3  TRP  24          3HE       TRP  24   5.273  -8.769  -0.219
  209    HZ2  TRP  24          2HZ       TRP  24   6.189 -13.495   0.992
  210    HZ3  TRP  24          3HZ       TRP  24   4.348 -10.578  -1.578
  211    HH2  TRP  24           HH       TRP  24   4.723 -12.943  -0.977
  212    QB   TRP  24           QB       TRP  24   7.514  -7.450   2.029
  213    H    ASN  25           H        ASN  25   4.430  -9.048   3.087
  214    HA   ASN  25           HA       ASN  25   2.799  -9.264   4.875
  215   1HB   ASN  25          1HB       ASN  25   4.829 -11.365   4.192
  216   2HB   ASN  25          2HB       ASN  25   3.559 -11.736   5.352
  217   1HD2  ASN  25          2HD2      ASN  25   2.553 -11.803   1.464
  218   2HD2  ASN  25          1HD2      ASN  25   4.187 -11.684   2.045
  219    QB   ASN  25           QB       ASN  25   4.194 -11.550   4.772
  220    QD2  ASN  25           QD2      ASN  25   3.370 -11.743   1.754
  221    H    THR  26           H        THR  26   3.541  -7.668   6.281
  222    HA   THR  26           HA       THR  26   3.231  -8.637   8.886
  223    HB   THR  26           HB       THR  26   5.655  -9.100   8.883
  224    HG1  THR  26          1HG       THR  26   6.048  -8.126  10.784
  225   1HG2  THR  26          3HG2      THR  26   5.987  -6.123   8.330
  226   2HG2  THR  26          1HG2      THR  26   7.249  -7.158   9.021
  227   3HG2  THR  26          2HG2      THR  26   6.635  -7.495   7.404
  228    QG2  THR  26           QG2      THR  26   6.624  -6.925   8.252
  229    H    CYS  27           H        CYS  27   3.665  -6.528  10.441
  230    HA   CYS  27           HA       CYS  27   1.555  -4.819   9.494
  231   1HB   CYS  27          1HB       CYS  27   2.156  -5.616  11.943
  232   2HB   CYS  27          2HB       CYS  27   3.215  -4.206  11.929
  233    QB   CYS  27           QB       CYS  27   2.685  -4.911  11.936
  234    H    VAL  28           H        VAL  28   1.794  -2.886   8.351
  235    HA   VAL  28           HA       VAL  28   4.402  -1.444   8.530
  236    HB   VAL  28           HB       VAL  28   2.584  -1.537   6.115
  237   1HG1  VAL  28          2HG1      VAL  28   4.290   0.316   6.301
  238   2HG1  VAL  28          3HG1      VAL  28   5.560  -0.911   6.381
  239   3HG1  VAL  28          1HG1      VAL  28   4.589  -0.764   4.924
  240   1HG2  VAL  28          1HG2      VAL  28   4.979  -3.354   6.566
  241   2HG2  VAL  28          2HG2      VAL  28   3.271  -3.847   6.455
  242   3HG2  VAL  28          3HG2      VAL  28   4.035  -3.123   5.068
  243    QG1  VAL  28           QG1      VAL  28   4.813  -0.453   5.869
  244    QG2  VAL  28           QG2      VAL  28   4.095  -3.441   6.030
  245    QQG  VAL  28           QQG      VAL  28   4.454  -1.947   5.949
  246    H    GLY  29           H        GLY  29   4.181   0.741   8.951
  247   1HA   GLY  29          1HA       GLY  29   1.613   1.706   9.836
  248   2HA   GLY  29          2HA       GLY  29   3.152   2.568   9.850
  249    QA   GLY  29           QA       GLY  29   2.383   2.137   9.843
  250    H    ILE  30           H        ILE  30   0.706   3.801   9.036
  251    HA   ILE  30           HA       ILE  30   1.660   4.868   6.469
  252    HB   ILE  30           HB       ILE  30  -1.282   4.302   7.119
  253   1HG1  ILE  30          1HG1      ILE  30   0.346   3.287   4.758
  254   2HG1  ILE  30          2HG1      ILE  30   0.040   2.341   6.221
  255   1HG2  ILE  30          2HG2      ILE  30   0.037   5.877   4.876
  256   2HG2  ILE  30          3HG2      ILE  30  -1.638   5.340   4.798
  257   3HG2  ILE  30          1HG2      ILE  30  -1.165   6.461   6.051
  258   1HD1  ILE  30          1HD1      ILE  30  -2.368   2.411   5.828
  259   2HD1  ILE  30          2HD1      ILE  30  -2.117   3.321   4.317
  260   3HD1  ILE  30          3HD1      ILE  30  -1.477   1.698   4.472
  261    QG1  ILE  30           QG1      ILE  30   0.193   2.814   5.490
  262    QG2  ILE  30           QG2      ILE  30  -0.922   5.892   5.242
  263    QD1  ILE  30           QD1      ILE  30  -1.988   2.477   4.872
  264    H    GLY  31           H        GLY  31   1.347   7.192   6.478
  265   1HA   GLY  31          1HA       GLY  31  -0.528   8.645   7.601
  266   2HA   GLY  31          2HA       GLY  31   0.514   8.472   9.026
  267    QA   GLY  31           QA       GLY  31  -0.007   8.558   8.313
  268    H    ALA  32           H        ALA  32  -0.164  10.899   7.731
  269    HA   ALA  32           HA       ALA  32   0.673  12.876   7.368
  270   1HB   ALA  32          3HB       ALA  32   3.332  11.688   8.178
  271   2HB   ALA  32          1HB       ALA  32   2.951  13.415   7.951
  272   3HB   ALA  32          2HB       ALA  32   2.112  12.488   9.202
  273    QB   ALA  32           QB       ALA  32   2.799  12.531   8.444
  274    H    ASN  33           H        ASN  33   0.047  12.998   5.367
  275    HA   ASN  33           HA       ASN  33   0.024  13.283   3.163
  276   1HB   ASN  33          1HB       ASN  33   3.067  13.452   3.306
  277   2HB   ASN  33          2HB       ASN  33   2.022  14.090   2.034
  278   1HD2  ASN  33          2HD2      ASN  33   3.074  16.742   4.651
  279   2HD2  ASN  33          1HD2      ASN  33   4.018  15.424   3.992
  280    QB   ASN  33           QB       ASN  33   2.545  13.771   2.670
  281    QD2  ASN  33           QD2      ASN  33   3.546  16.083   4.322
  282    H    VAL  34           H        VAL  34   1.179  10.518   4.466
  283    HA   VAL  34           HA       VAL  34   2.113   9.240   1.954
  284    HB   VAL  34           HB       VAL  34   1.647   8.159   4.749
  285   1HG1  VAL  34          3HG1      VAL  34   1.320   6.377   3.002
  286   2HG1  VAL  34          1HG1      VAL  34   2.896   6.798   2.312
  287   3HG1  VAL  34          2HG1      VAL  34   2.788   6.144   3.960
  288   1HG2  VAL  34          3HG2      VAL  34   3.644   9.705   4.407
  289   2HG2  VAL  34          1HG2      VAL  34   4.061   8.056   4.913
  290   3HG2  VAL  34          2HG2      VAL  34   4.254   8.540   3.221
  291    QG1  VAL  34           QG1      VAL  34   2.335   6.439   3.091
  292    QG2  VAL  34           QG2      VAL  34   3.986   8.767   4.180
  293    QQG  VAL  34           QQG      VAL  34   3.161   7.603   3.636
  294    H    HIS  35           H        HIS  35   0.356   9.313   0.569
  295    HA   HIS  35           HA       HIS  35  -1.736   7.391   1.295
  296   1HB   HIS  35          1HB       HIS  35  -3.558   8.680   0.900
  297   2HB   HIS  35          2HB       HIS  35  -2.627   9.628   2.054
  298    HD1  HIS  35          1HD       HIS  35  -4.369   9.653  -1.225
  299    HD2  HIS  35          2HD       HIS  35  -1.717  12.051   0.990
  300    HE1  HIS  35          1HE       HIS  35  -4.679  12.044  -2.070
  301    QB   HIS  35           QB       HIS  35  -3.093   9.154   1.477
  302    H    TRP  36           H        TRP  36   0.552   7.437  -0.533
  303    HA   TRP  36           HA       TRP  36  -0.914   6.884  -3.071
  304   1HB   TRP  36          1HB       TRP  36   1.539   8.586  -2.627
  305   2HB   TRP  36          2HB       TRP  36   0.954   8.057  -4.197
  306    HD1  TRP  36           HD       TRP  36  -0.027  10.514  -1.372
  307    HE1  TRP  36          1HE       TRP  36  -1.803  12.092  -2.249
  308    HE3  TRP  36          3HE       TRP  36  -1.132   8.032  -5.627
  309    HZ2  TRP  36          2HZ       TRP  36  -3.632  12.185  -4.526
  310    HZ3  TRP  36          3HZ       TRP  36  -2.953   8.835  -7.145
  311    HH2  TRP  36           HH       TRP  36  -4.212  10.887  -6.593
  312    QB   TRP  36           QB       TRP  36   1.246   8.321  -3.412
  313    H    MET  37           H        MET  37  -0.410   4.862  -3.447
  314    HA   MET  37           HA       MET  37   2.270   3.715  -2.802
  315   1HB   MET  37          1HB       MET  37   0.364   2.389  -2.160
  316   2HB   MET  37          2HB       MET  37  -0.224   2.388  -3.839
  317   1HG   MET  37          1HG       MET  37   2.023   1.283  -4.414
  318   2HG   MET  37          2HG       MET  37   2.244   1.051  -2.690
  319   1HE   MET  37          2HE       MET  37   0.771  -0.486  -1.197
  320   2HE   MET  37          3HE       MET  37  -0.705   0.386  -1.649
  321   3HE   MET  37          1HE       MET  37  -0.657  -1.385  -1.768
  322    QB   MET  37           QB       MET  37   0.070   2.389  -3.000
  323    QG   MET  37           QG       MET  37   2.133   1.167  -3.552
  324    QE   MET  37           QE       MET  37  -0.197  -0.495  -1.538
  325    H    VAL  38           H        VAL  38   3.739   3.279  -4.557
  326    HA   VAL  38           HA       VAL  38   2.796   4.060  -7.275
  327    HB   VAL  38           HB       VAL  38   5.354   5.224  -6.137
  328   1HG1  VAL  38          3HG1      VAL  38   5.018   5.130  -8.602
  329   2HG1  VAL  38          1HG1      VAL  38   3.474   5.990  -8.422
  330   3HG1  VAL  38          2HG1      VAL  38   4.991   6.805  -8.010
  331   1HG2  VAL  38          3HG2      VAL  38   2.598   6.544  -6.148
  332   2HG2  VAL  38          1HG2      VAL  38   3.578   6.171  -4.711
  333   3HG2  VAL  38          2HG2      VAL  38   4.133   7.378  -5.869
  334    QG1  VAL  38           QG1      VAL  38   4.494   5.975  -8.345
  335    QG2  VAL  38           QG2      VAL  38   3.436   6.698  -5.576
  336    QQG  VAL  38           QQG      VAL  38   3.965   6.336  -6.960
  337    H    THR  39           H        THR  39   2.933   2.078  -8.132
  338    HA   THR  39           HA       THR  39   4.835   0.176  -7.032
  339    HB   THR  39           HB       THR  39   3.234  -1.278  -8.512
  340    HG1  THR  39          1HG       THR  39   1.336  -0.173  -9.051
  341   1HG2  THR  39          2HG2      THR  39   3.074  -1.019  -6.005
  342   2HG2  THR  39          3HG2      THR  39   1.943   0.329  -6.316
  343   3HG2  THR  39          1HG2      THR  39   1.543  -1.319  -6.839
  344    QG2  THR  39           QG2      THR  39   2.186  -0.670  -6.387
  345    H    GLY  40           H        GLY  40   6.036  -1.368  -8.232
  346   1HA   GLY  40          1HA       GLY  40   6.955  -0.504 -10.944
  347   2HA   GLY  40          2HA       GLY  40   8.065  -1.033  -9.683
  348    QA   GLY  40           QA       GLY  40   7.510  -0.768 -10.314
  349    H    GLY  41           H        GLY  41   7.335  -2.162 -12.329
  350   1HA   GLY  41          1HA       GLY  41   6.000  -4.778 -11.607
  351   2HA   GLY  41          2HA       GLY  41   5.765  -3.736 -13.005
  352    QA   GLY  41           QA       GLY  41   5.882  -4.257 -12.306
  353    H    SER  42           H        SER  42   8.015  -2.998 -13.825
  354    HA   SER  42           HA       SER  42   9.260  -4.668 -15.619
  355   1HB   SER  42          1HB       SER  42  10.055  -2.807 -13.394
  356   2HB   SER  42          2HB       SER  42  11.227  -3.418 -14.624
  357    HG   SER  42           HG       SER  42   8.874  -1.858 -15.072
  358    QB   SER  42           QB       SER  42  10.641  -3.112 -14.009
  359    H    THR  43           H        THR  43  11.242  -6.038 -15.398
  360    HA   THR  43           HA       THR  43  12.050  -7.968 -14.658
  361    HB   THR  43           HB       THR  43  13.074  -5.953 -13.143
  362    HG1  THR  43          1HG       THR  43  14.742  -7.122 -13.165
  363   1HG2  THR  43          3HG2      THR  43  11.634  -6.766 -11.130
  364   2HG2  THR  43          1HG2      THR  43  12.773  -8.095 -11.040
  365   3HG2  THR  43          2HG2      THR  43  13.370  -6.449 -10.892
  366    QG2  THR  43           QG2      THR  43  12.592  -7.103 -11.021
  367    H    ASP  44           H        ASP  44   9.222  -7.541 -14.508
  368    HA   ASP  44           HA       ASP  44   7.365  -8.769 -14.002
  369   1HB   ASP  44          1HB       ASP  44   8.674 -10.553 -14.878
  370   2HB   ASP  44          2HB       ASP  44   9.479 -10.802 -13.328
  371    QB   ASP  44           QB       ASP  44   9.076 -10.678 -14.103
  372    H    GLY  45           H        GLY  45   8.276  -6.943 -12.182
  373   1HA   GLY  45          1HA       GLY  45   7.739  -7.380  -9.445
  374   2HA   GLY  45          2HA       GLY  45   7.263  -5.983 -10.398
  375    QA   GLY  45           QA       GLY  45   7.501  -6.682  -9.921
  376    H    LYS  46           H        LYS  46   5.712  -7.057 -12.254
  377    HA   LYS  46           HA       LYS  46   3.427  -7.202 -12.633
  378   1HB   LYS  46          1HB       LYS  46   3.754  -9.476 -10.630
  379   2HB   LYS  46          2HB       LYS  46   2.254  -9.170 -11.499
  380   1HG   LYS  46          1HG       LYS  46   3.386  -9.357 -13.659
  381   2HG   LYS  46          2HG       LYS  46   4.922  -9.689 -12.861
  382   1HD   LYS  46          1HD       LYS  46   2.402 -11.411 -12.553
  383   2HD   LYS  46          2HD       LYS  46   3.726 -11.723 -13.686
  384   1HE   LYS  46          1HE       LYS  46   5.299 -11.644 -11.640
  385   2HE   LYS  46          2HE       LYS  46   3.850 -11.786 -10.632
  386   1HZ   LYS  46          3HZ       LYS  46   4.620 -13.717 -12.733
  387   2HZ   LYS  46          1HZ       LYS  46   4.988 -13.861 -11.156
  388   3HZ   LYS  46          2HZ       LYS  46   3.401 -13.891 -11.623
  389    QB   LYS  46           QB       LYS  46   3.004  -9.323 -11.064
  390    QG   LYS  46           QG       LYS  46   4.154  -9.523 -13.260
  391    QD   LYS  46           QD       LYS  46   3.064 -11.567 -13.120
  392    QE   LYS  46           QE       LYS  46   4.575 -11.715 -11.136
  393    QZ   LYS  46           QZ       LYS  46   4.336 -13.823 -11.837
  394    H    GLN  47           H        GLN  47   1.156  -7.460 -11.187
  395    HA   GLN  47           HA       GLN  47   0.975  -5.078  -9.684
  396   1HB   GLN  47          1HB       GLN  47  -1.210  -5.915  -8.953
  397   2HB   GLN  47          2HB       GLN  47  -0.969  -6.388 -10.635
  398   1HG   GLN  47          1HG       GLN  47  -0.026  -8.634  -9.580
  399   2HG   GLN  47          2HG       GLN  47  -0.892  -8.110  -8.134
  400   1HE2  GLN  47          2HE2      GLN  47  -4.125  -8.237  -9.961
  401   2HE2  GLN  47          1HE2      GLN  47  -3.264  -7.155  -8.879
  402    QB   GLN  47           QB       GLN  47  -1.090  -6.152  -9.794
  403    QG   GLN  47           QG       GLN  47  -0.459  -8.372  -8.857
  404    QE2  GLN  47           QE2      GLN  47  -3.694  -7.696  -9.420
  405    H    GLY  48           H        GLY  48   0.663  -4.733  -7.474
  406   1HA   GLY  48          1HA       GLY  48   1.718  -6.837  -5.605
  407   2HA   GLY  48          2HA       GLY  48   2.221  -5.148  -5.455
  408    QA   GLY  48           QA       GLY  48   1.970  -5.992  -5.530
  409    H    CYS  49           H        CYS  49   0.339  -7.074  -3.798
  410    HA   CYS  49           HA       CYS  49  -1.886  -5.122  -3.601
  411   1HB   CYS  49          1HB       CYS  49  -2.163  -8.135  -3.285
  412   2HB   CYS  49          2HB       CYS  49  -3.407  -6.923  -3.274
  413    QB   CYS  49           QB       CYS  49  -2.785  -7.529  -3.280
  414    H    ALA  50           H        ALA  50  -2.955  -5.146  -1.582
  415    HA   ALA  50           HA       ALA  50  -1.358  -6.125   0.678
  416   1HB   ALA  50          1HB       ALA  50  -1.927  -3.168   0.094
  417   2HB   ALA  50          2HB       ALA  50  -1.225  -3.788   1.602
  418   3HB   ALA  50          3HB       ALA  50  -0.322  -3.916   0.075
  419    QB   ALA  50           QB       ALA  50  -1.158  -3.624   0.591
  420    H    THR  51           H        THR  51  -2.413  -5.949   2.661
  421    HA   THR  51           HA       THR  51  -5.345  -5.482   2.510
  422    HB   THR  51           HB       THR  51  -3.760  -6.941   4.659
  423    HG1  THR  51          1HG       THR  51  -5.142  -7.854   2.355
  424   1HG2  THR  51          1HG2      THR  51  -5.965  -6.049   5.431
  425   2HG2  THR  51          2HG2      THR  51  -6.762  -6.896   4.087
  426   3HG2  THR  51          3HG2      THR  51  -5.947  -7.819   5.364
  427    QG2  THR  51           QG2      THR  51  -6.225  -6.922   4.961
  428    H    ILE  52           H        ILE  52  -6.161  -3.821   3.699
  429    HA   ILE  52           HA       ILE  52  -4.133  -1.922   4.765
  430    HB   ILE  52           HB       ILE  52  -6.836  -1.276   3.526
  431   1HG1  ILE  52          1HG1      ILE  52  -5.790  -2.487   1.744
  432   2HG1  ILE  52          2HG1      ILE  52  -5.836  -0.771   1.381
  433   1HG2  ILE  52          2HG2      ILE  52  -4.319   0.386   3.876
  434   2HG2  ILE  52          3HG2      ILE  52  -5.805   0.918   3.058
  435   3HG2  ILE  52          1HG2      ILE  52  -5.838   0.515   4.783
  436   1HD1  ILE  52          2HD1      ILE  52  -3.417  -0.578   1.983
  437   2HD1  ILE  52          3HD1      ILE  52  -3.390  -2.333   2.284
  438   3HD1  ILE  52          1HD1      ILE  52  -3.732  -1.722   0.669
  439    QG1  ILE  52           QG1      ILE  52  -5.813  -1.629   1.563
  440    QG2  ILE  52           QG2      ILE  52  -5.320   0.607   3.906
  441    QD1  ILE  52           QD1      ILE  52  -3.513  -1.544   1.646
  442    H    TRP  53           H        TRP  53  -4.830  -0.777   6.768
  443    HA   TRP  53           HA       TRP  53  -7.374  -1.757   7.960
  444   1HB   TRP  53          1HB       TRP  53  -4.575  -1.883   9.054
  445   2HB   TRP  53          2HB       TRP  53  -5.920  -1.678  10.165
  446    HD1  TRP  53           HD       TRP  53  -7.629  -3.676  10.483
  447    HE1  TRP  53          1HE       TRP  53  -7.364  -6.185  10.231
  448    HE3  TRP  53          3HE       TRP  53  -3.594  -3.703   7.373
  449    HZ2  TRP  53          2HZ       TRP  53  -5.596  -8.023   8.827
  450    HZ3  TRP  53          3HZ       TRP  53  -2.632  -5.831   6.606
  451    HH2  TRP  53           HH       TRP  53  -3.621  -8.006   7.306
  452    QB   TRP  53           QB       TRP  53  -5.247  -1.780   9.609
  453    H    GLU  54           H        GLU  54  -8.299  -0.493   9.528
  454    HA   GLU  54           HA       GLU  54  -7.772   2.375   9.323
  455   1HB   GLU  54          1HB       GLU  54 -10.027   1.241   9.024
  456   2HB   GLU  54          2HB       GLU  54 -10.026   0.860  10.744
  457   1HG   GLU  54          1HG       GLU  54 -10.104   3.188  11.342
  458   2HG   GLU  54          2HG       GLU  54  -9.732   3.693   9.661
  459    QB   GLU  54           QB       GLU  54 -10.026   1.051   9.884
  460    QG   GLU  54           QG       GLU  54  -9.918   3.440  10.501
  461    H    GLY  55           H        GLY  55  -7.508  -0.347  11.642
  462   1HA   GLY  55          1HA       GLY  55  -6.985   1.327  13.966
  463   2HA   GLY  55          2HA       GLY  55  -6.583  -0.349  13.803
  464    QA   GLY  55           QA       GLY  55  -6.784   0.489  13.885
  465    H    SER  56           H        SER  56  -4.972   2.053  14.703
  466    HA   SER  56           HA       SER  56  -2.653   2.076  13.027
  467   1HB   SER  56          1HB       SER  56  -2.908   2.548  16.025
  468   2HB   SER  56          2HB       SER  56  -1.630   3.119  14.935
  469    HG   SER  56           HG       SER  56  -3.182   4.768  15.386
  470    QB   SER  56           QB       SER  56  -2.269   2.833  15.480
  471    H    GLY  57           H        GLY  57  -0.907   0.824  13.577
  472   1HA   GLY  57          1HA       GLY  57   0.174  -1.231  13.892
  473   2HA   GLY  57          2HA       GLY  57  -0.758  -1.382  15.388
  474    QA   GLY  57           QA       GLY  57  -0.292  -1.306  14.640
  475    H    CYS  58           H        CYS  58  -2.124  -1.095  12.138
  476    HA   CYS  58           HA       CYS  58  -3.480  -2.419  10.915
  477   1HB   CYS  58          1HB       CYS  58  -2.439  -4.398  10.004
  478   2HB   CYS  58          2HB       CYS  58  -1.267  -3.088  10.069
  479    QB   CYS  58           QB       CYS  58  -1.853  -3.743  10.036
  480    H    VAL  59           H        VAL  59  -4.725  -2.345  13.188
  481    HA   VAL  59           HA       VAL  59  -6.003  -5.016  13.234
  482    HB   VAL  59           HB       VAL  59  -6.709  -4.342  15.563
  483   1HG1  VAL  59          3HG1      VAL  59  -5.071  -6.148  15.140
  484   2HG1  VAL  59          1HG1      VAL  59  -3.753  -4.962  15.138
  485   3HG1  VAL  59          2HG1      VAL  59  -4.673  -5.264  16.623
  486   1HG2  VAL  59          1HG2      VAL  59  -5.938  -1.951  15.470
  487   2HG2  VAL  59          2HG2      VAL  59  -5.370  -2.854  16.884
  488   3HG2  VAL  59          3HG2      VAL  59  -4.265  -2.559  15.538
  489    QG1  VAL  59           QG1      VAL  59  -4.499  -5.458  15.634
  490    QG2  VAL  59           QG2      VAL  59  -5.191  -2.455  15.964
  491    QQG  VAL  59           QQG      VAL  59  -4.845  -3.956  15.799
  492    H    GLY  60           H        GLY  60  -8.386  -4.599  14.036
  493   1HA   GLY  60          1HA       GLY  60 -10.295  -3.203  14.078
  494   2HA   GLY  60          2HA       GLY  60  -9.351  -1.896  13.384
  495    QA   GLY  60           QA       GLY  60  -9.823  -2.549  13.731
  496    H    ARG  61           H        ARG  61 -10.690  -1.394  11.749
  497    HA   ARG  61           HA       ARG  61 -12.022  -3.465  10.057
  498   1HB   ARG  61          1HB       ARG  61 -13.501  -1.711  10.881
  499   2HB   ARG  61          2HB       ARG  61 -12.326  -0.459  10.450
  500   1HG   ARG  61          1HG       ARG  61 -12.673  -0.809   8.101
  501   2HG   ARG  61          2HG       ARG  61 -13.730  -2.214   8.386
  502   1HD   ARG  61          1HD       ARG  61 -15.500  -0.894   9.094
  503   2HD   ARG  61          2HD       ARG  61 -14.465   0.372   9.735
  504    HE   ARG  61           HE       ARG  61 -15.096  -0.132   6.839
  505   1HH1  ARG  61          2HH2      ARG  61 -13.828   2.089   9.290
  506   2HH1  ARG  61          1HH2      ARG  61 -13.786   3.454   8.357
  507   1HH2  ARG  61          2HH1      ARG  61 -15.035   1.714   5.435
  508   2HH2  ARG  61          1HH1      ARG  61 -14.601   3.274   6.067
  509    QB   ARG  61           QB       ARG  61 -12.914  -1.085  10.665
  510    QG   ARG  61           QG       ARG  61 -13.202  -1.512   8.243
  511    QD   ARG  61           QD       ARG  61 -14.982  -0.261   9.414
  512    QH1  ARG  61           QH2      ARG  61 -13.807   2.771   8.824
  513    QH2  ARG  61           QH1      ARG  61 -14.818   2.494   5.751
  514    H    SER  62           H        SER  62 -11.770  -3.545   7.856
  515    HA   SER  62           HA       SER  62  -9.260  -2.372   6.963
  516   1HB   SER  62          1HB       SER  62  -8.692  -4.888   6.338
  517   2HB   SER  62          2HB       SER  62  -8.522  -4.345   8.002
  518    HG   SER  62           HG       SER  62  -9.723  -6.299   7.877
  519    QB   SER  62           QB       SER  62  -8.607  -4.617   7.170
  520    H    THR  63           H        THR  63  -8.718  -3.286   4.776
  521    HA   THR  63           HA       THR  63 -10.851  -4.490   3.275
  522    HB   THR  63           HB       THR  63 -11.435  -2.147   2.784
  523    HG1  THR  63          1HG       THR  63 -11.397  -2.392   0.551
  524   1HG2  THR  63          3HG2      THR  63  -9.217  -1.071   3.039
  525   2HG2  THR  63          1HG2      THR  63  -8.629  -1.908   1.586
  526   3HG2  THR  63          2HG2      THR  63  -9.930  -0.714   1.463
  527    QG2  THR  63           QG2      THR  63  -9.259  -1.231   2.029
  528    H    THR  64           H        THR  64  -9.670  -4.708   0.861
  529    HA   THR  64           HA       THR  64  -6.809  -4.843   1.217
  530    HB   THR  64           HB       THR  64  -7.912  -7.206   1.733
  531    HG1  THR  64          1HG       THR  64  -5.586  -6.659   0.261
  532   1HG2  THR  64          3HG2      THR  64  -9.179  -7.366  -0.411
  533   2HG2  THR  64          1HG2      THR  64  -7.618  -7.427  -1.278
  534   3HG2  THR  64          2HG2      THR  64  -8.046  -8.701  -0.129
  535    QG2  THR  64           QG2      THR  64  -8.281  -7.832  -0.606
  536    H    MET  65           H        MET  65  -5.744  -4.237  -0.505
  537    HA   MET  65           HA       MET  65  -7.367  -3.480  -2.918
  538   1HB   MET  65          1HB       MET  65  -6.977  -1.558  -1.328
  539   2HB   MET  65          2HB       MET  65  -5.236  -1.781  -1.573
  540   1HG   MET  65          1HG       MET  65  -5.537  -1.313  -4.000
  541   2HG   MET  65          2HG       MET  65  -7.284  -1.173  -3.754
  542   1HE   MET  65          2HE       MET  65  -7.223   1.078  -5.096
  543   2HE   MET  65          3HE       MET  65  -6.180   2.458  -4.683
  544   3HE   MET  65          1HE       MET  65  -5.462   0.948  -5.298
  545    QB   MET  65           QB       MET  65  -6.106  -1.669  -1.451
  546    QG   MET  65           QG       MET  65  -6.410  -1.243  -3.877
  547    QE   MET  65           QE       MET  65  -6.288   1.495  -5.026
  548    H    CYS  66           H        CYS  66  -6.305  -3.610  -4.875
  549    HA   CYS  66           HA       CYS  66  -3.545  -4.781  -4.877
  550   1HB   CYS  66          1HB       CYS  66  -5.933  -5.334  -6.650
  551   2HB   CYS  66          2HB       CYS  66  -4.296  -5.569  -7.229
  552    QB   CYS  66           QB       CYS  66  -5.114  -5.452  -6.940
  553    H    CYS  67           H        CYS  67  -2.145  -3.839  -6.406
  554    HA   CYS  67           HA       CYS  67  -3.253  -1.724  -8.186
  555   1HB   CYS  67          1HB       CYS  67  -2.383  -0.780  -6.105
  556   2HB   CYS  67          2HB       CYS  67  -0.791  -1.431  -6.465
  557    QB   CYS  67           QB       CYS  67  -1.587  -1.106  -6.285
  558    HA   PRO  68           HA       PRO  68  -0.483  -4.147 -10.917
  559   1HB   PRO  68          1HB       PRO  68  -1.191  -1.864 -12.745
  560   2HB   PRO  68          2HB       PRO  68  -1.144  -3.607 -13.124
  561   1HG   PRO  68          1HG       PRO  68  -3.531  -2.405 -12.746
  562   2HG   PRO  68          2HG       PRO  68  -3.222  -3.963 -11.927
  563   1HD   PRO  68          1HD       PRO  68  -2.880  -1.164 -10.772
  564   2HD   PRO  68          2HD       PRO  68  -3.835  -2.519 -10.119
  565    QB   PRO  68           QB       PRO  68  -1.167  -2.735 -12.935
  566    QG   PRO  68           QG       PRO  68  -3.377  -3.184 -12.337
  567    QD   PRO  68           QD       PRO  68  -3.358  -1.841 -10.445
  568    H    ALA  69           H        ALA  69   1.579  -3.490 -12.101
  569    HA   ALA  69           HA       ALA  69   2.983  -1.376 -10.612
  570   1HB   ALA  69          1HB       ALA  69   3.851  -3.112 -12.933
  571   2HB   ALA  69          2HB       ALA  69   4.875  -1.913 -12.146
  572   3HB   ALA  69          3HB       ALA  69   4.309  -3.314 -11.224
  573    QB   ALA  69           QB       ALA  69   4.345  -2.780 -12.101
  574    H    ASN  70           H        ASN  70   4.287   0.232 -11.892
  575    HA   ASN  70           HA       ASN  70   4.286   2.147 -13.025
  576   1HB   ASN  70          1HB       ASN  70   4.020   2.110 -15.450
  577   2HB   ASN  70          2HB       ASN  70   5.030   0.791 -14.851
  578   1HD2  ASN  70          2HD2      ASN  70   3.020  -1.817 -16.099
  579   2HD2  ASN  70          1HD2      ASN  70   4.300  -1.391 -14.978
  580    QB   ASN  70           QB       ASN  70   4.525   1.451 -15.151
  581    QD2  ASN  70           QD2      ASN  70   3.660  -1.604 -15.538
  582    H    THR  71           H        THR  71   2.342   2.016 -11.340
  583    HA   THR  71           HA       THR  71   0.132   3.588 -12.477
  584    HB   THR  71           HB       THR  71  -0.064   1.074 -10.765
  585    HG1  THR  71          1HG       THR  71   0.106   0.627 -12.933
  586   1HG2  THR  71          3HG2      THR  71  -2.227   3.075 -11.449
  587   2HG2  THR  71          1HG2      THR  71  -2.555   1.402 -10.932
  588   3HG2  THR  71          2HG2      THR  71  -1.706   2.523  -9.858
  589    QG2  THR  71           QG2      THR  71  -2.163   2.333 -10.747
  590    H    CYS  72           H        CYS  72  -0.389   5.207 -10.993
  591    HA   CYS  72           HA       CYS  72   0.995   5.186  -8.336
  592   1HB   CYS  72          1HB       CYS  72   1.614   7.187  -9.344
  593   2HB   CYS  72          2HB       CYS  72   0.104   7.326 -10.240
  594    QB   CYS  72           QB       CYS  72   0.859   7.257  -9.792
  595    H    CYS  73           H        CYS  73  -0.321   4.447  -6.856
  596    HA   CYS  73           HA       CYS  73  -3.217   4.107  -7.362
  597   1HB   CYS  73          1HB       CYS  73  -2.095   2.738  -5.040
  598   2HB   CYS  73          2HB       CYS  73  -3.032   2.076  -6.361
  599    QB   CYS  73           QB       CYS  73  -2.564   2.407  -5.701
  600    H    ASN  74           H        ASN  74  -4.580   5.363  -6.156
  601    HA   ASN  74           HA       ASN  74  -3.465   7.188  -4.097
  602   1HB   ASN  74          1HB       ASN  74  -4.982   8.132  -5.789
  603   2HB   ASN  74          2HB       ASN  74  -6.182   6.889  -5.442
  604   1HD2  ASN  74          2HD2      ASN  74  -5.819  10.118  -2.957
  605   2HD2  ASN  74          1HD2      ASN  74  -4.435   9.624  -3.919
  606    QB   ASN  74           QB       ASN  74  -5.582   7.510  -5.616
  607    QD2  ASN  74           QD2      ASN  74  -5.127   9.871  -3.438
  608    H    ILE  75           H        ILE  75  -3.335   6.329  -2.066
  609    HA   ILE  75           HA       ILE  75  -5.189   4.236  -1.149
  610    HB   ILE  75           HB       ILE  75  -2.635   5.514  -0.187
  611   1HG1  ILE  75          1HG1      ILE  75  -2.034   3.125   0.100
  612   2HG1  ILE  75          2HG1      ILE  75  -3.648   2.656  -0.470
  613   1HG2  ILE  75          3HG2      ILE  75  -4.451   3.912   1.610
  614   2HG2  ILE  75          1HG2      ILE  75  -2.731   4.262   1.902
  615   3HG2  ILE  75          2HG2      ILE  75  -3.875   5.594   1.853
  616   1HD1  ILE  75          2HD1      ILE  75  -1.626   4.287  -2.017
  617   2HD1  ILE  75          3HD1      ILE  75  -1.820   2.523  -2.167
  618   3HD1  ILE  75          1HD1      ILE  75  -3.117   3.588  -2.692
  619    QG1  ILE  75           QG1      ILE  75  -2.841   2.891  -0.185
  620    QG2  ILE  75           QG2      ILE  75  -3.686   4.590   1.789
  621    QD1  ILE  75           QD1      ILE  75  -2.188   3.466  -2.292
  622    H    ASN  76           H        ASN  76  -7.216   5.165  -1.155
  623    HA   ASN  76           HA       ASN  76  -7.818   6.743   1.181
  624   1HB   ASN  76          1HB       ASN  76  -7.085   8.537  -0.520
  625   2HB   ASN  76          2HB       ASN  76  -8.495   8.100  -1.468
  626   1HD2  ASN  76          2HD2      ASN  76 -10.825   9.396   1.025
  627   2HD2  ASN  76          1HD2      ASN  76 -10.651   8.043  -0.092
  628    QB   ASN  76           QB       ASN  76  -7.790   8.318  -0.994
  629    QD2  ASN  76           QD2      ASN  76 -10.738   8.720   0.466
  630    H    THR  77           H        THR  77  -8.782   4.530   1.252
  631    HA   THR  77           HA       THR  77 -10.822   3.819  -0.626
  632    HB   THR  77           HB       THR  77  -9.533   2.704   1.698
  633    HG1  THR  77          1HG       THR  77 -10.899   1.732  -0.601
  634   1HG2  THR  77          2HG2      THR  77 -11.652   2.865   2.911
  635   2HG2  THR  77          3HG2      THR  77 -12.432   1.908   1.621
  636   3HG2  THR  77          1HG2      THR  77 -11.132   1.211   2.594
  637    QG2  THR  77           QG2      THR  77 -11.739   1.995   2.375
  638    H    GLY  78           H        GLY  78 -10.854   6.192   1.762
  639   1HA   GLY  78          1HA       GLY  78 -13.003   7.497   1.916
  640   2HA   GLY  78          2HA       GLY  78 -13.771   5.965   2.383
  641    QA   GLY  78           QA       GLY  78 -13.387   6.731   2.149
  642    H    PHE  79           H        PHE  79 -11.534   4.856   3.906
  643    HA   PHE  79           HA       PHE  79 -11.833   6.536   6.349
  644   1HB   PHE  79          1HB       PHE  79 -10.616   4.663   7.444
  645   2HB   PHE  79          2HB       PHE  79 -12.223   4.311   6.853
  646    HD1  PHE  79          1HD       PHE  79  -9.320   4.177   4.449
  647    HD2  PHE  79          2HD       PHE  79 -11.650   1.993   7.355
  648    HE1  PHE  79          1HE       PHE  79  -8.168   2.111   3.840
  649    HE2  PHE  79          2HE       PHE  79 -10.493  -0.080   6.712
  650   1HZ   PHE  79           HZ       PHE  79  -8.679  -0.012   5.025
  651    QB   PHE  79           QB       PHE  79 -11.420   4.487   7.149
  652    QG   PHE  79           QD       PHE  79 -10.485   3.085   5.902
  653    QZ   PHE  79           QE       PHE  79  -9.331   1.015   5.276
  654    QZ   PHE  79           QR       PHE  79  -9.662   1.638   5.476
  655    H    TYR  80           H        TYR  80 -10.199   7.104   7.698
  656    HA   TYR  80           HA       TYR  80  -7.913   8.014   6.180
  657   1HB   TYR  80          1HB       TYR  80  -8.815   9.494   7.871
  658   2HB   TYR  80          2HB       TYR  80  -8.609   8.277   9.129
  659    HD1  TYR  80          2HD       TYR  80  -6.216   7.500   9.699
  660    HD2  TYR  80          1HD       TYR  80  -6.974  10.976   7.280
  661    HE1  TYR  80          2HE       TYR  80  -3.993   8.403  10.310
  662    HE2  TYR  80          1HE       TYR  80  -4.691  11.797   7.771
  663    HH   TYR  80           HH       TYR  80  -2.642  11.202   8.692
  664    QB   TYR  80           QB       TYR  80  -8.712   8.885   8.500
  665    QG   TYR  80           QD       TYR  80  -6.595   9.238   8.490
  666    QZ   TYR  80           QE       TYR  80  -4.342  10.100   9.040
  667    QR   TYR  80           QR       TYR  80  -5.468   9.669   8.765
  668    H    ILE  81           H        ILE  81  -5.938   6.921   6.307
  669    HA   ILE  81           HA       ILE  81  -6.126   4.157   7.267
  670    HB   ILE  81           HB       ILE  81  -3.856   4.178   5.872
  671   1HG1  ILE  81          1HG1      ILE  81  -4.189   6.697   5.396
  672   2HG1  ILE  81          2HG1      ILE  81  -3.751   5.625   4.093
  673   1HG2  ILE  81          3HG2      ILE  81  -6.661   3.930   4.752
  674   2HG2  ILE  81          1HG2      ILE  81  -5.172   3.323   3.981
  675   3HG2  ILE  81          2HG2      ILE  81  -5.697   2.676   5.543
  676   1HD1  ILE  81          3HD1      ILE  81  -6.675   6.332   4.527
  677   2HD1  ILE  81          1HD1      ILE  81  -5.556   7.276   3.538
  678   3HD1  ILE  81          2HD1      ILE  81  -5.903   5.587   3.141
  679    QG1  ILE  81           QG1      ILE  81  -3.970   6.161   4.745
  680    QG2  ILE  81           QG2      ILE  81  -5.843   3.310   4.759
  681    QD1  ILE  81           QD1      ILE  81  -6.044   6.399   3.735
  682    H    ARG  82           H        ARG  82  -4.598   3.265   8.685
  683    HA   ARG  82           HA       ARG  82  -2.338   5.031   9.605
  684   1HB   ARG  82          1HB       ARG  82  -4.026   3.211  11.373
  685   2HB   ARG  82          2HB       ARG  82  -2.525   4.041  11.830
  686   1HG   ARG  82          1HG       ARG  82  -3.716   5.758  12.454
  687   2HG   ARG  82          2HG       ARG  82  -4.005   6.087  10.726
  688   1HD   ARG  82          1HD       ARG  82  -5.981   4.600  10.825
  689   2HD   ARG  82          2HD       ARG  82  -5.736   4.442  12.602
  690    HE   ARG  82           HE       ARG  82  -5.909   7.152  12.192
  691   1HH1  ARG  82          2HH2      ARG  82  -7.941   4.357  11.536
  692   2HH1  ARG  82          1HH2      ARG  82  -9.402   5.224  11.231
  693   1HH2  ARG  82          2HH1      ARG  82  -7.887   8.394  12.014
  694   2HH2  ARG  82          1HH1      ARG  82  -9.398   7.588  11.723
  695    QB   ARG  82           QB       ARG  82  -3.275   3.626  11.601
  696    QG   ARG  82           QG       ARG  82  -3.860   5.922  11.590
  697    QD   ARG  82           QD       ARG  82  -5.859   4.521  11.713
  698    QH1  ARG  82           QH2      ARG  82  -8.672   4.791  11.384
  699    QH2  ARG  82           QH1      ARG  82  -8.642   7.991  11.868
  700    H    SER  83           H        SER  83  -3.482   1.844   8.766
  701    HA   SER  83           HA       SER  83  -0.619   1.078   8.506
  702   1HB   SER  83          1HB       SER  83  -2.374  -0.984   9.700
  703   2HB   SER  83          2HB       SER  83  -0.643  -0.717   9.945
  704    HG   SER  83           HG       SER  83  -2.875   0.605  11.125
  705    QB   SER  83           QB       SER  83  -1.508  -0.850   9.822
  706    H    TYR  84           H        TYR  84  -0.215  -0.992   7.402
  707    HA   TYR  84           HA       TYR  84  -2.343  -2.362   6.106
  708   1HB   TYR  84          1HB       TYR  84  -1.828  -2.018   3.848
  709   2HB   TYR  84          2HB       TYR  84  -2.079  -0.428   4.526
  710    HD1  TYR  84          1HD       TYR  84   0.661   0.219   5.642
  711    HD2  TYR  84          2HD       TYR  84  -0.531  -1.662   1.950
  712    HE1  TYR  84          1HE       TYR  84   2.811   0.776   4.659
  713    HE2  TYR  84          2HE       TYR  84   1.702  -1.198   1.005
  714    HH   TYR  84           HH       TYR  84   4.357   0.261   2.885
  715    QB   TYR  84           QB       TYR  84  -1.954  -1.223   4.187
  716    QG   TYR  84           QD       TYR  84   0.065  -0.721   3.796
  717    QZ   TYR  84           QE       TYR  84   2.257  -0.211   2.832
  718    QR   TYR  84           QR       TYR  84   1.161  -0.466   3.314
  719    H    ARG  85           H        ARG  85  -1.275  -4.074   4.561
  720    HA   ARG  85           HA       ARG  85   1.512  -4.882   5.290
  721   1HB   ARG  85          1HB       ARG  85  -0.179  -5.986   6.830
  722   2HB   ARG  85          2HB       ARG  85  -1.049  -6.506   5.373
  723   1HG   ARG  85          1HG       ARG  85   1.262  -7.728   4.841
  724   2HG   ARG  85          2HG       ARG  85   1.377  -7.657   6.624
  725   1HD   ARG  85          1HD       ARG  85  -1.046  -8.459   6.646
  726   2HD   ARG  85          2HD       ARG  85  -0.777  -8.858   4.926
  727    HE   ARG  85           HE       ARG  85   1.283 -10.050   6.510
  728   1HH1  ARG  85          2HH2      ARG  85  -2.202 -10.519   5.828
  729   2HH1  ARG  85          1HH2      ARG  85  -2.231 -12.112   6.485
  730   1HH2  ARG  85          2HH1      ARG  85   1.217 -12.198   7.375
  731   2HH2  ARG  85          1HH1      ARG  85  -0.340 -12.944   7.614
  732    QB   ARG  85           QB       ARG  85  -0.614  -6.246   6.101
  733    QG   ARG  85           QG       ARG  85   1.319  -7.692   5.733
  734    QD   ARG  85           QD       ARG  85  -0.912  -8.659   5.786
  735    QH1  ARG  85           QH2      ARG  85  -2.216 -11.315   6.157
  736    QH2  ARG  85           QH1      ARG  85   0.439 -12.571   7.494
  737    H    ARG  86           H        ARG  86   2.500  -5.259   3.190
  738    HA   ARG  86           HA       ARG  86   0.777  -5.764   0.868
  739   1HB   ARG  86          1HB       ARG  86   2.764  -4.480   0.501
  740   2HB   ARG  86          2HB       ARG  86   3.758  -5.727   1.221
  741   1HG   ARG  86          1HG       ARG  86   2.891  -7.291  -0.690
  742   2HG   ARG  86          2HG       ARG  86   2.467  -5.783  -1.489
  743   1HD   ARG  86          1HD       ARG  86   4.869  -5.110  -1.375
  744   2HD   ARG  86          2HD       ARG  86   5.221  -6.477  -0.329
  745    HE   ARG  86           HE       ARG  86   4.015  -7.369  -2.796
  746   1HH1  ARG  86          2HH2      ARG  86   7.106  -6.097  -1.679
  747   2HH1  ARG  86          1HH2      ARG  86   8.049  -7.398  -2.359
  748   1HH2  ARG  86          2HH1      ARG  86   5.187  -8.962  -3.810
  749   2HH2  ARG  86          1HH1      ARG  86   6.942  -8.982  -3.811
  750    QB   ARG  86           QB       ARG  86   3.261  -5.104   0.861
  751    QG   ARG  86           QG       ARG  86   2.679  -6.537  -1.089
  752    QD   ARG  86           QD       ARG  86   5.045  -5.794  -0.852
  753    QH1  ARG  86           QH2      ARG  86   7.577  -6.747  -2.019
  754    QH2  ARG  86           QH1      ARG  86   6.065  -8.972  -3.811
  755    H    VAL  87           H        VAL  87   0.441  -7.744  -0.108
  756    HA   VAL  87           HA       VAL  87   1.177 -10.114   1.532
  757    HB   VAL  87           HB       VAL  87  -0.883 -11.153   0.695
  758   1HG1  VAL  87          1HG1      VAL  87  -1.211  -8.558   2.267
  759   2HG1  VAL  87          2HG1      VAL  87  -2.382  -9.882   2.189
  760   3HG1  VAL  87          3HG1      VAL  87  -0.791 -10.160   2.917
  761   1HG2  VAL  87          1HG2      VAL  87  -1.288  -9.723  -1.316
  762   2HG2  VAL  87          2HG2      VAL  87  -2.681  -9.829  -0.235
  763   3HG2  VAL  87          3HG2      VAL  87  -1.691  -8.369  -0.235
  764    QG1  VAL  87           QG1      VAL  87  -1.461  -9.533   2.457
  765    QG2  VAL  87           QG2      VAL  87  -1.887  -9.307  -0.596
  766    QQG  VAL  87           QQG      VAL  87  -1.674  -9.420   0.931
  767    H    GLU  88           H        GLU  88   1.189  -8.908  -1.852
  768    HA   GLU  88           HA       GLU  88   2.626 -11.390  -2.594
  769   1HB   GLU  88          1HB       GLU  88   1.327 -11.569  -4.634
  770   2HB   GLU  88          2HB       GLU  88   0.339 -11.826  -3.180
  771   1HG   GLU  88          1HG       GLU  88  -0.494  -9.486  -3.425
  772   2HG   GLU  88          2HG       GLU  88   0.418  -9.336  -4.935
  773    QB   GLU  88           QB       GLU  88   0.833 -11.698  -3.907
  774    QG   GLU  88           QG       GLU  88  -0.038  -9.411  -4.180
   
  No H/Q in entry =         774