*HEADER    TOXIN                                   08-DEC-98   1B3C              
*TITLE     SOLUTION STRUCTURE OF A BETA-NEUROTOXIN FROM THE NEW WORLD            
*TITLE    2 SCORPION CENTRUROIDES SCULPTURATUS EWING                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEUROTOXIN CSE-I;                                          
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: CENTRUROIDES SCULPTURATUS EWING;                
*SOURCE   3 ORGANISM_COMMON: SCORPION;                                           
*SOURCE   4 OTHER_DETAILS: SCORPIONS COLLECTED MESA, AZ, USA                     
*KEYWDS    SCORPION NEUROTOXIN, NEW WORLD TOXIN                                  
*EXPDTA    NMR                                                                   
*AUTHOR    M.J.JABLONSKY, P.L.JACKSON, J.O.TRENT, D.D.WATT, N.R.KRISHNA          
*REVDAT   2   29-DEC-99 1B3C    4       HEADER COMPND REMARK JRNL                
*REVDAT   2 2                   4       ATOM   SOURCE SEQRES                     
*REVDAT   1   16-DEC-98 1B3C    0                                                


!! Constraints
!! LYS-1
 assign ( resid 1 and name n )    ( resid 1 and name ca)
        ( resid 1 and name c )    ( resid 2 and name n )  1.0  110.0 90.0 2
!! ASP-2
 assign ( resid 1 and name c )    ( resid 2 and name n )  
        ( resid 2 and name ca)    ( resid 2 and name c )  1.0 -120.0 50.0 2
 assign ( resid 2 and name n )    ( resid 2 and name ca)
        ( resid 2 and name c )    ( resid 3 and name n )  1.0  110.0 90.0 2
!! GLY-3
 assign ( resid 2 and name c )    ( resid 3 and name n )  
        ( resid 3 and name ca)    ( resid 3 and name c )  1.0 -120.0 50.0 2
 assign ( resid 3 and name n )    ( resid 3 and name ca)
        ( resid 3 and name c )    ( resid 4 and name n )  1.0  110.0 90.0 2
!! TYR-4
 assign ( resid 3 and name c )    ( resid 4 and name n )  
        ( resid 4 and name ca)    ( resid 4 and name c )  1.0 -120. 50.0 2
 assign ( resid 4 and name n )    ( resid 4 and name ca)
        ( resid 4 and name c )    ( resid 5 and name n )  1.0  110.0 90.0 2
!! VAL-6
 assign ( resid 5 and name c )    ( resid 6 and name n )  
        ( resid 6 and name ca)    ( resid 6 and name c )  1.0 -120. 50.0 2
 assign ( resid 6 and name n )    ( resid 6 and name ca)
        ( resid 6 and name c )    ( resid 7 and name n )  1.0  110.0 90.0 2
!! GLU-7
 assign ( resid 6 and name c )    ( resid 7 and name n )  
        ( resid 7 and name ca)    ( resid 7 and name c )  1.0 -120. 50.0 2
 assign ( resid 7 and name n )    ( resid 7 and name ca)
        ( resid 7 and name c )    ( resid 8 and name n )  1.0  110.0 90.0 2
!! LYS-8
 assign ( resid 7 and name c )    ( resid 8 and name n )  
        ( resid 8 and name ca)    ( resid 8 and name c )  1.0  -60  50.0 2
!! THR-9
 assign ( resid 8 and name c )    ( resid 9 and name n )  
        ( resid 9 and name ca)    ( resid 9 and name c )  1.0  -60. 50.0 2
!! CYS-11
 assign ( resid 10 and name c )   ( resid 11 and name n )  
        ( resid 11 and name ca)   ( resid 11 and name c ) 1.0 -100. 50.0 2
 assign ( resid 11 and name n )   ( resid 11 and name ca)
        ( resid 11 and name c )   ( resid 12 and name n )  1.0  110.0 90.0 2
!! LYS-12 
 assign ( resid 11 and name c )   ( resid 12 and name n )
        ( resid 12 and name ca)   ( resid 12 and name c )  1.0 -60.0 50.0 2
 assign ( resid 12 and name n )   ( resid 12 and name ca)
        ( resid 12 and name c )   ( resid 13 and name n )  1.0  110.0 90.0 2
!! LYS-13
 assign ( resid 12 and name c )   ( resid 13 and name n )  
        ( resid 13 and name ca)   ( resid 13 and name c )  1.0 -120 50.0 2
 assign ( resid 13 and name n )   ( resid 13 and name ca)
        ( resid 13 and name c )   ( resid 14 and name n )  1.0  110.0 90.0 2
!! THR-14
 assign ( resid 13 and name c )   ( resid 14 and name n )  
        ( resid 14 and name ca)   ( resid 14 and name c )  1.0 -60. 50.0 2
 assign ( resid 14 and name n )   ( resid 14 and name ca)
        ( resid 14 and name c )   ( resid 15 and name n )  1.0  110.0 90.0 2
!! C15, code #27, J=9.64)
 assign ( resid 14 and name c )   ( resid 15 and name n )  
        ( resid 15 and name ca)   ( resid 15 and name c )  1.0 -120. 50.0 2
!! TYR-16, code #16, J=10.0)
 assign ( resid 15 and name c )   ( resid 16 and name n )  
        ( resid 16 and name ca)   ( resid 16 and name c )  1.0 -120. 50.0 2
!! LYS-17
 assign ( resid 16 and name c )   ( resid 17 and name n )  
        ( resid 17 and name ca)   ( resid 17 and name c )  1.0 -120. 50.0 2
 assign ( resid 17 and name n )   ( resid 17 and name ca)
        ( resid 17 and name c )   ( resid 18 and name n )  1.0  110.0 90.0 2
!! LEU-18
 assign ( resid 17 and name c )   ( resid 18 and name n )
        ( resid 18 and name ca)   ( resid 18 and name c )  1.0 -60. 50.0 2
 assign ( resid 18 and name n )   ( resid 18 and name ca)
        ( resid 18 and name c )   ( resid 19 and name n )  1.0  110.0 90.0 22
!! ASN-21
   assign ( resid 20 and name c )   ( resid 21 and name n )  
          ( resid 21 and name ca)   ( resid 21 and name c )  1.0 -120. 50.0 2
!! ASP-22
   assign ( resid 21 and name c )   ( resid 22 and name n )
          ( resid 22 and name ca)   ( resid 22 and name c )  1.0 -60. 50.0 2
!! PHE-23
 assign ( resid 22 and name c )   ( resid 23 and name n )  
        ( resid 23 and name ca)   ( resid 23 and name c )  1.0 -60. 20.0 2
!! CYS-24
 assign ( resid 23 and name c )   ( resid 24 and name n )
        ( resid 24 and name ca)   ( resid 24 and name c )  1.0 -60. 20.0 2
!! ASN-25 
 assign ( resid 24 and name c )   ( resid 25 and name n )  
        ( resid 25 and name ca)   ( resid 25 and name c )  1.0 -60. 20.0 2
!! ARG-26
 assign ( resid 25 and name c )   ( resid 26 and name n )
        ( resid 26 and name ca)   ( resid 26 and name c )  1.0 -60. 20.0 2
!! GLU-27
 assign ( resid 26 and name c )   ( resid 27 and name n )
        ( resid 27 and name ca)   ( resid 27 and name c )  1.0 -60. 20.0 2
!! CYS-28
 assign ( resid 27 and name c )   ( resid 28 and name n )
        ( resid 28 and name ca)   ( resid 28 and name c )  1.0 -60. 20.0 2
!! #18 (K29, code #41, J=9.3)
 assign ( resid 28 and name c )   ( resid 29 and name n )  
        ( resid 29 and name ca)   ( resid 29 and name c )  1.0 -80. 40.0 2
!! #21 (I33, code #40, J=11.8)
 assign ( resid 32 and name c )   ( resid 33 and name n )  
        ( resid 33 and name ca)   ( resid 33 and name c )  1.0 -120. 50.0 2
!! GLY-35
 assign ( resid 35 and name n )   ( resid 35 and name ca)
        ( resid 35 and name c )   ( resid 36 and name n )  1.0  110.0 90.0 2
!! #22 (S36, code #19, J=7.0)
 assign ( resid 35 and name c )   ( resid 36 and name n )  
        ( resid 36 and name ca)   ( resid 36 and name c )  1.0 -120. 50.0 2
!! #23 (Y37, code #13, J=8.0)
 assign ( resid 36 and name c )   ( resid 37 and name n )  
        ( resid 37 and name ca)   ( resid 37 and name c )  1.0 -120. 50.0 2
!! GLY-38
 assign ( resid 37 and name c )   ( resid 38 and name n )
        ( resid 38 and name ca)   ( resid 38 and name c )  1.0 -120. 50.0 2
!! Tyr-39
 assign ( resid 39 and name n )   ( resid 39 and name ca)
        ( resid 39 and name c )   ( resid 40 and name n )  1.0  110.0 90.0 2
!! #24 (C40, code #4, J=9.3)
 assign ( resid 39 and name c )   ( resid 40 and name n )  
        ( resid 40 and name ca)    (resid 40 and name c )  1.0 -120. 50.0 2
 assign ( resid 40 and name n )   ( resid 40 and name ca)
        ( resid 40 and name c )   ( resid 41 and name n )  1.0  110.0 90.0 2
!! #25 (Y41, code #7, J=9.4)
 assign ( resid 40 and name c )   ( resid 41 and name n )  
        ( resid 41 and name ca)   ( resid 41 and name c )  1.0 -120. 50.0 2
!! #27 (C45, code #62, J=10.)
 assign ( resid 44 and name c )   ( resid 45 and name n )  
        ( resid 45 and name ca)   ( resid 45 and name c )  1.0 -120. 50.0 2
 assign ( resid 45 and name n )   ( resid 45 and name ca)
        ( resid 45 and name c )   ( resid 46 and name n )  1.0  110.0 90.0 2
!! #28 (Y46, code #32, J=14)
 assign ( resid 45 and name c )   ( resid 46 and name n )  
        ( resid 46 and name ca)   ( resid 46 and name c )  1.0 -120. 50.0 2
 assign ( resid 46 and name n )   ( resid 46 and name ca)
        ( resid 46 and name c )   ( resid 47 and name n )  1.0  110.0 90.0 2
!! #29 (C47, code #2, J=11.0)
 assign ( resid 46 and name c )   ( resid 47 and name n )  
        ( resid 47 and name ca)   ( resid 47 and name c )  1.0 -120.0 50.0 2
 assign ( resid 47 and name n )   ( resid 47 and name ca)
        ( resid 47 and name c )   ( resid 48 and name n )  1.0  110.0 90.0 2
!! #30 (E48, code #11, J=12)
 assign ( resid 47 and name c )   ( resid 48 and name n )  
        ( resid 48 and name ca)   ( resid 48 and name c )  1.0 -120. 50.0 2
 assign ( resid 48 and name n )   ( resid 48 and name ca)
        ( resid 48 and name c )   ( resid 49 and name n )  1.0  110.0 90.0 2
!! #31 (L50, code #34, J=8.4)
 assign ( resid 49 and name c )   ( resid 50 and name n )  
        ( resid 50 and name ca)   ( resid 50 and name c )  1.0 -60.0 40.0 2
!! PRO 51
 assign ( resid 51 and name n )   ( resid 51 and name ca)
        ( resid 51 and name c )   ( resid 52 and name n )  1.0  110.0 90.0 2
!! #32 (D52)
 assign ( resid 51 and name c )   ( resid 52 and name n )
        ( resid 52 and name ca)   ( resid 52 and name c )  1.0 -60. 40.0 2
!! #32 (S53, code #39, J=7.5)
 assign ( resid 52 and name c )   ( resid 53 and name n )  
        ( resid 53 and name ca)   ( resid 53 and name c )  1.0 -60. 40.0 2
!! #33 (T54, code #52, J=6.5)
 assign ( resid 53 and name c )   ( resid 54 and name n )  
        ( resid 54 and name ca)   ( resid 54 and name c )  1.0 -60. 40.0 2
 assign ( resid 54 and name n )   ( resid 54 and name ca)
        ( resid 54 and name c )   ( resid 55 and name n )  1.0  110.0 90.0 2
!! Q55, code #33, J=8.0)
 assign ( resid 54 and name c )   ( resid 55 and name n )  
        ( resid 55 and name ca)   ( resid 55 and name c )  1.0 -60. 40.0 2
 assign ( resid 55 and name n )   ( resid 55 and name ca)
        ( resid 55 and name c )   ( resid 56 and name n )  1.0  110.0 90.0 2
!! T56, code #15, J=11.8)
 assign ( resid 55 and name c )   ( resid 56 and name n )  
        ( resid 56 and name ca)   ( resid 56 and name c )  1.0 -120.0 50.0 2
 assign ( resid 56 and name n )   ( resid 56 and name ca)
        ( resid 56 and name c )   ( resid 57 and name n )  1.0  110.0 90.0 2
!!TRP-57
 assign ( resid 56 and name c )   ( resid 57 and name n )
        ( resid 57 and name ca)   ( resid 57 and name c )  1.0 -60. 40.0 2
 assign ( resid 57 and name n )   ( resid 57 and name ca)
        ( resid 57 and name c )   ( resid 58 and name n )  1.0  110.0 90.0 2
!! PRO-58
 assign ( resid 58 and name n )   ( resid 58 and name ca)
        ( resid 58 and name c )   ( resid 59 and name n )  1.0  110.0 90.0 2
!! L59 
 assign ( resid 58 and name c )   ( resid 59 and name n )  
        ( resid 59 and name ca)   ( resid 59 and name c )  1.0 -80. 50.0 2
 assign ( resid 59 and name n )   ( resid 59 and name ca)
        ( resid 59 and name c )   ( resid 60 and name n )  1.0  110.0 90.0 2
!! PRO-60
 assign ( resid 60 and name n )   ( resid 60 and name ca)
        ( resid 60 and name c )   ( resid 61 and name n )  1.0  110.0 90.0 2
!! ASN-61, code #21, J=7.0)
 assign ( resid 60 and name c )   ( resid 61 and name n )  
        ( resid 61 and name ca)   ( resid 61 and name c )  1.0 -80.0 50.0 2
!! assign ( resid 61 and name n )   ( resid 61 and name ca)
!!        ( resid 61 and name c )   ( resid 62 and name n )  1.0  120.0 80.0 2
!! #36 (K62, code #22, J=8.63)
 assign ( resid 61 and name c )   ( resid 62 and name n )  
        ( resid 62 and name ca)   ( resid 62 and name c )  1.0 -110. 50.0 2
 assign ( resid 62 and name n )   ( resid 62 and name ca)
        ( resid 62 and name c )   ( resid 63 and name n )  1.0  110.0 90.0 2
!! #37 (T63, code #29, J=9.0)
 assign ( resid 62 and name c )   ( resid 63 and name n )  
        ( resid 63 and name ca)   ( resid 63 and name c )  1.0 -110. 50.0 2
 assign ( resid 63 and name n )   ( resid 63 and name ca)
        ( resid 63 and name c )   ( resid 64 and name n )  1.0  110.0 90.0 2
!! D2 t2g3
  assign (resid  2 and name n )   (resid  2 and name ca)
         (resid  2 and name cb)   (resid  2 and name cg)   1.0  -60. 60.0 2
!! Y4 g2t3 uf=b1 02oct98 t2g3
  assign (resid  4 and name n )   (resid  4 and name ca)
         (resid  4 and name cb)   (resid  4 and name cg)   1.0  -60. 60.0 2
!! Leu-5 x1=-60, x2=180
  assign (resid   5 and name n )  (resid   5 and name ca)
         (resid   5 and name cb)  (resid   5 and name cg)  1.0  -60. 60.0 2
!! Leu-5
  assign (resid   5 and name ca)  (resid   5 and name cb)
         (resid   5 and name cg)  (resid   5 and name cd1) 1.0  180. 60.0 2
!! Val-6  29sep98 g-
  assign (resid   6 and name n )  (resid   6 and name ca)
         (resid   6 and name cb)  (resid   6 and name hb) 1.0  180. 60.0 2
!! Thr-9
  assign (resid   9 and name n )  (resid   9 and name ca)
         (resid   9 and name cb)  (resid   9 and name cg2) 1.0  -60.0 60.0 2
!! C11 ( B1 upfield) g2t3
  assign (resid  11 and name n )  (resid  11 and name ca)
         (resid  11 and name cb)  (resid  11 and name sg)  1.0  -60.0 60.0 2
!! Thr-14
  assign (resid  14 and name n )  (resid  14 and name ca)
         (resid  14 and name cb)  (resid  14 and name cg2) 1.0  180.0 60.0 2
!! C15 (B2 downfield t2g3) 
  assign (resid  15 and name n )  (resid  15 and name ca)
         (resid  15 and name cb)  (resid  15 and name sg)  1.0   60.0 60.0 2
!! Y16 ( B1 upfield) t2g3  
  assign (resid  16 and name n )  (resid  16 and name ca)
         (resid  16 and name cb)  (resid  16 and name cg)  1.0  -60. 60.0 2
!! Leu-18 x1=-60, x2=180
  assign (resid  18 and name n )  (resid  18 and name ca)
         (resid  18 and name cb)  (resid  18 and name cg)  1.0  -60. 60.0 2
!! Leu-18
  assign (resid  18 and name ca)  (resid  18 and name cb)
         (resid  18 and name cg)  (resid  18 and name cd1) 1.0  180. 60.0 2
!! N21 (uf large cc)
  assign (resid  21 and name n )  (resid  21 and name ca)
         (resid  21 and name cb)  (resid  21 and name cg)  1.0  180. 60.0 2
!! D22 (upfield large cc)   
  assign (resid  22 and name n )  (resid  22 and name ca)
         (resid  22 and name cb)  (resid  22 and name cg)  1.0  -120 120. 2
!! F23 (B1 downfield)  g2t3 
  assign (resid  23 and name n )  (resid  23 and name ca)
         (resid  23 and name cb)  (resid  23 and name cg)  1.0 180.0 60.0 2
!! C24 (overlap N25)
  assign (resid  24 and name n )  (resid  24 and name ca)
         (resid  24 and name cb)  (resid  24 and name sg)  1.0  -60.0 60 2
!! C28 (df large cc) 13nov98 g2t3
  assign (resid  28 and name n )  (resid  28 and name ca)
         (resid  28 and name cb)  (resid  28 and name sg)  1.0 180.0 60.0 2
!!S36 () g2g3
  assign (resid  36 and name n )  (resid  36 and name ca)  
         (resid  36 and name cb)  (resid  36 and name og)  1.0   60.0 60.0 2
!! Y37 (uf = 10Hz)
  assign (resid  37 and name n )  (resid  37 and name ca)
         (resid  37 and name cb)  (resid  37 and name cg)  1.0 180.0 60.0 2  
!!Y39  g2g3
  assign (resid  39 and name n )  (resid  39 and name ca)
         (resid  39 and name cb)  (resid  39 and name cg)  1.0   60.0 60.0 2
!! C40 (df large cc) 
  assign (resid  40 and name n )  (resid  40 and name ca)
         (resid  40 and name cb)  (resid  40 and name sg)  1.0 180.0  60. 2
!!#53 Y41 (code # 7, B1 downfield) g2t3 
  assign (resid  41 and name n )  (resid  41 and name ca)
         (resid  41 and name cb)  (resid  41 and name cg)  1.0  180.0 60.0 2
!! F43 (uf large cc)
  assign (resid  43 and name n )  (resid  43 and name ca)
         (resid  43 and name cb)  (resid  43 and name cg)  1.0 -60.0  60.0 2
!! C45( B1 upfield) g2t3  
  assign (resid  45 and name n )  (resid  45 and name ca)
         (resid  45 and name cb)  (resid  45 and name sg)  1.0  -60. 60.0 2
!! Y46(B1 upfield) 
  assign (resid  46 and name n )  (resid  46 and name ca)
         (resid  46 and name cb)  (resid  46 and name cg)  1.0  180. 60.0 2
!! C47 (b2= upfield) t2g3  
  assign (resid  47 and name n )  (resid  47 and name ca)
         (resid  47 and name cb)  (resid  47 and name sg)  1.0 -60. 60.0  2
!! L50 t2g3 df=b2
  assign (resid  50 and name n )  (resid  50 and name ca)
         (resid  50 and name cb)  (resid  50 and name cg)  1.0 -60.0 120. 2
!! D52 uf=9Hz 
  assign (resid  52 and name n )  (resid  52 and name ca)
         (resid  52 and name cb)  (resid  52 and name cg)  1.0 -60. 60. 2
!! S53 t2g3  
  assign (resid  53 and name n )  (resid  53 and name ca)
         (resid  53 and name cb)  (resid  53 and name og)  1.0  -60. 60.0 2
!! Thr-54
  assign (resid  54 and name n )  (resid  54 and name ca)
         (resid  54 and name cb)  (resid  54 and name cg2) 1.0  180.0 60.0 2
!! Thr-56
  assign (resid  14 and name n )  (resid  14 and name ca)
         (resid  14 and name cb)  (resid  14 and name cg2) 1.0  180.0 60.0 2
!! W57 (B1 downfield)  g2t3
  assign (resid  57 and name n )  (resid  57 and name ca)
         (resid  57 and name cb)  (resid  57 and name cg)  1.0  180. 60.0 2
!! C64 (B1 downfield) g2t3 
  assign (resid  64 and name n )  (resid  64 and name ca)
         (resid  64 and name cb)  (resid  64 and name sg)  1.0  180  60.0 2
!! Proline omega angles; Pro 58 is cis .
!!#61 PRO 51
 assign (resid  50 and name ca)   (resid  50 and name c)
        (resid  51 and name n)    (resid  51 and name ca)  1.0  180.  5.0 2
!!#62 PRO 58
 assign (resid  57 and name ca)   (resid  57 and name c)
        (resid  58 and name n)    (resid  58 and name ca)  1.0  0.0  5.0 2
!!#63 PRO 60
 assign (resid  59 and name ca)   (resid  59 and name c)
        (resid  60 and name n)    (resid  60 and name ca)  1.0  180.  5.0 2
!!tox1_noe.tbl 
!! LYS-1
assign (resid    1 and  name HA  )(resid    2 and  name HN  ) 3.0 1.2 0.5
assign (resid    1 and  name HB1 )(resid    2 and  name HN  ) 4.0 2.2 1.0
assign (resid    1 and  name HB2 )(resid    2 and  name HN  ) 4.0 2.2 1.0
assign (resid    1 and  name HG1 )(resid    2 and  name HN  ) 4.0 2.2 1.0
assign (resid    1 and  name HG2 )(resid    2 and  name HN  ) 4.0 2.2 1.0
assign (resid    1 and  name HE# )(resid   50 and  name HD1#) 4.0 4.3 3.1
assign (resid    1 and  name HE# )(resid   50 and  name HD2#) 4.0 4.3 3.1
!! ASP-2 t2g3 w/ uf=HB2
assign (resid    2 and  name HN  )(resid    2 and  name HA  ) 4.0 2.2 1.0
assign (resid    2 and  name HN  )(resid    2 and  name HB1 ) 4.0 2.2 1.0
assign (resid    2 and  name HN  )(resid    2 and  name HB2 ) 3.0 1.2 0.5
assign (resid    2 and  name HA  )(resid    2 and  name HB1 ) 3.0 1.2 0.5
assign (resid    2 and  name HA  )(resid    2 and  name HB2 ) 4.0 2.2 1.0
assign (resid    2 and  name HA  )(resid    3 and  name HN  ) 2.5 0.7 0.2
assign (resid    2 and  name HN  )(resid    3 and  name HN  ) 4.0 2.2 1.0
assign (resid    2 and  name HB1 )(resid    3 and  name HN  ) 4.0 2.2 1.0
assign (resid    2 and  name HB2 )(resid    3 and  name HN  ) 4.0 2.2 1.0
assign (resid    2 and  name HB1 )(resid   46 and  name HD# ) 4.0 3.2 2.5
assign (resid    2 and  name HB2 )(resid   46 and  name HD# ) 4.0 3.2 2.5
assign (resid    2 and  name HB1 )(resid   46 and  name HE# ) 3.0 3.2 2.5
assign (resid    2 and  name HB2 )(resid   46 and  name HE# ) 3.0 3.2 2.5
assign (resid    2 and  name HA  )(resid   46 and  name HE# ) 4.0 4.2 3.0
assign (resid    2 and  name HA  )(resid   47 and  name HN  ) 4.0 2.2 1.0
assign (resid    2 and  name HA  )(resid   48 and  name HA  ) 3.0 1.2 0.5
assign (resid    2 and  name HB2 )(resid   48 and  name HA  ) 4.0 2.2 1.0
assign (resid    2 and  name HB1 )(resid   48 and  name HA  ) 4.0 2.2 1.0
assign (resid    2 and  name HA  )(resid   48 and  name HB# ) 4.0 3.2 2.0
assign (resid    2 and  name HA  )(resid   48 and  name HG# ) 4.0 3.2 2.0
assign (resid    2 and  name HA  )(resid   49 and  name HN  ) 3.0 1.2 0.5
assign (resid    2 and  name HA  )(resid   50 and  name HN  ) 4.0 2.2 1.0
assign (resid    2 and  name HA  )(resid   50 and  name HD1#) 4.0 3.3 2.1
assign (resid    2 and  name HA  )(resid   50 and  name HD2#) 4.0 3.3 2.1
!!Gly-3 
assign (resid    3 and  name HN  )(resid    3 and  name HA1 ) 3.0 1.2 0.5
assign (resid    3 and  name HN  )(resid    3 and  name HA2 ) 3.0 1.2 0.5
assign (resid    3 and  name HN  )(resid    4 and  name HN  ) 4.0 2.2 1.0
assign (resid    3 and  name HA1 )(resid    4 and  name HN  ) 2.5 0.7 0.2
assign (resid    3 and  name HA2 )(resid    4 and  name HN  ) 2.5 0.7 0.2
assign (resid    3 and  name HA1 )(resid    4 and  name HD# ) 4.0 4.2 3.0
assign (resid    3 and  name HA2 )(resid    4 and  name HD# ) 4.0 4.2 3.0
assign (resid    3 and  name HN  )(resid   46 and  name HD# ) 4.0 4.2 3.0
assign (resid    3 and  name HN  )(resid   46 and  name HE# ) 4.0 4.2 3.0
assign (resid    3 and  name HA1 )(resid   46 and  name HE# ) 3.0 3.2 2.5
assign (resid    3 and  name HA2 )(resid   46 and  name HE# ) 3.0 3.2 2.5
assign (resid    3 and  name HN  )(resid   46 and  name HA  ) 4.0 2.2 1.0
assign (resid    3 and  name HN  )(resid   47 and  name HN  ) 3.0 1.2 0.5
assign (resid    3 and  name HN  )(resid   48 and  name HA  ) 4.0 2.2 1.0
assign (resid    3 and  name HN  )(resid   50 and  name HD1#) 4.0 3.3 2.1
assign (resid    3 and  name HN  )(resid   50 and  name HD2#) 4.0 3.3 2.1
assign (resid    3 and  name HN  )(resid   50 and  name HG  ) 4.0 2.2 1.0
!!Tyr-4 t2g3 uf=b1
assign (resid    4 and  name HN  )(resid    4 and  name HA  ) 4.0 2.2 1.0
assign (resid    4 and  name HN  )(resid    4 and  name HB1 ) 4.0 2.2 1.0
assign (resid    4 and  name HN  )(resid    4 and  name HB2 ) 3.0 1.2 0.5 
assign (resid    4 and  name HN  )(resid    4 and  name HD# ) 2.5 2.7 2.2 
assign (resid    4 and  name HN  )(resid    4 and  name HE# ) 4.0 4.2 3.0
assign (resid    4 and  name HA  )(resid    4 and  name HB1 ) 3.0 1.2 0.5
assign (resid    4 and  name HA  )(resid    4 and  name HB2 ) 4.0 2.2 1.0
assign (resid    4 and  name HA  )(resid    4 and  name HD# ) 3.0 3.2 2.5
assign (resid    4 and  name HB1 )(resid    4 and  name HD# ) 3.0 3.2 2.5
assign (resid    4 and  name HB2 )(resid    4 and  name HD# ) 3.0 3.2 2.5
assign (resid    4 and  name HA  )(resid    4 and  name HE# ) 4.0 4.2 3.0
assign (resid    4 and  name HN  )(resid    5 and  name HN  ) 4.0 2.2 1.0
assign (resid    4 and  name HA  )(resid    5 and  name HN  ) 3.0 1.2 0.5
assign (resid    4 and  name HE# )(resid   41 and  name HN  ) 4.0 4.2 3.0
assign (resid    4 and  name HD# )(resid   44 and  name HA1 ) 4.0 4.2 3.0
assign (resid    4 and  name HD# )(resid   44 and  name HA2 ) 4.0 4.2 3.0
assign (resid    4 and  name HE# )(resid   44 and  name HA1 ) 4.0 4.2 3.0
assign (resid    4 and  name HE# )(resid   44 and  name HA2 ) 4.0 4.2 3.0
assign (resid    4 and  name HE# )(resid   44 and  name HN  ) 4.0 4.2 3.0
assign (resid    4 and  name HE# )(resid   45 and  name HA  ) 4.0 4.2 3.0
assign (resid    4 and  name HD# )(resid   45 and  name HN  ) 4.0 4.2 3.0
assign (resid    4 and  name HE# )(resid   45 and  name HN  ) 4.0 4.2 3.0
assign (resid    4 and  name HD1 )(resid   46 and  name HD2 ) 3.0 1.2 0.5
assign (resid    4 and  name HD2 )(resid   46 and  name HD2 ) 3.0 1.2 0.5
assign (resid    4 and  name HE1 )(resid   46 and  name HD2 ) 3.0 1.2 0.5
assign (resid    4 and  name HE2 )(resid   46 and  name HD2 ) 3.0 1.2 0.5
assign (resid    4 and  name HD# )(resid   46 and  name HE2 ) 4.0 4.2 3.0
assign (resid    4 and  name HE# )(resid   46 and  name HE2 ) 4.0 4.2 3.0
assign (resid    4 and  name HD# )(resid   46 and  name HA  ) 4.0 4.2 3.0
assign (resid    4 and  name HE# )(resid   46 and  name HA  ) 4.0 4.2 3.0
assign (resid    4 and  name HE# )(resid   46 and  name HB1 ) 4.0 4.2 3.0
assign (resid    4 and  name HE# )(resid   46 and  name HB2 ) 4.0 4.2 3.0
assign (resid    4 and  name HA  )(resid   46 and  name HA  ) 2.5 0.7 0.2
assign (resid    4 and  name HA  )(resid   46 and  name HD# ) 4.0 4.2 3.0
assign (resid    4 and  name HA  )(resid   46 and  name HE# ) 4.0 4.2 3.0
assign (resid    4 and  name HN  )(resid   46 and  name HD# ) 4.0 4.2 3.0
assign (resid    4 and  name HN  )(resid   46 and  name HE# ) 4.0 4.2 3.0
assign (resid    4 and  name HA  )(resid   47 and  name HN  ) 3.0 1.2 0.5
assign (resid    4 and  name HN  )(resid   47 and  name HN  ) 4.0 2.2 1.0
assign (resid    4 and  name HN  )(resid   56 and  name HA  ) 4.0 2.2 1.0
assign (resid    4 and  name HN  )(resid   56 and  name HB  ) 3.0 1.2 0.5
assign (resid    4 and  name HN  )(resid   56 and  name HG2#) 3.0 2.1 1.4
assign (resid    4 and  name HN  )(resid   57 and  name HB1 ) 4.0 2.2 1.0
assign (resid    4 and  name HN  )(resid   57 and  name HB2 ) 4.0 2.2 1.0
assign (resid    4 and  name HA  )(resid   57 and  name HB1 ) 4.0 2.2 1.0
assign (resid    4 and  name HA  )(resid   57 and  name HB2 ) 4.0 2.2 1.0
assign (resid    4 and  name HB1 )(resid   57 and  name HN  ) 4.0 2.2 1.0
assign (resid    4 and  name HB2 )(resid   57 and  name HN  ) 4.0 2.2 1.0
assign (resid    4 and  name HD# )(resid   57 and  name HB1 ) 4.0 4.2 3.0
assign (resid    4 and  name HD# )(resid   57 and  name HB2 ) 4.0 4.2 3.0
!!Leu-5 
assign (resid    5 and  name HN  )(resid    5 and  name HA  ) 4.0 2.2 1.0
assign (resid    5 and  name HN  )(resid    5 and  name HB# ) 3.0 2.2 1.5
assign (resid    5 and  name HN  )(resid    5 and  name HD1#) 4.0 3.3 2.1
assign (resid    5 and  name HN  )(resid    5 and  name HD2#) 4.0 3.3 2.1
assign (resid    5 and  name HA  )(resid    5 and  name HD1#) 4.0 3.3 2.1
assign (resid    5 and  name HA  )(resid    5 and  name HD2#) 4.0 3.3 2.1
assign (resid    5 and  name HA  )(resid    5 and  name HB# ) 2.5 1.7 1.2
assign (resid    5 and  name HA  )(resid    5 and  name HG  ) 4.0 2.8 1.6
assign (resid    5 and  name HB# )(resid    5 and  name HG  ) 3.0 3.3 2.3
assign (resid    5 and  name HA  )(resid    6 and  name HN  ) 2.5 0.7 0.2
assign (resid    5 and  name HN  )(resid    6 and  name HN  ) 4.0 2.2 1.0
assign (resid    5 and  name HB# )(resid    6 and  name HN  ) 2.5 1.7 1.2
assign (resid    5 and  name HG  )(resid    6 and  name HN  ) 4.0 2.2 1.0
assign (resid    5 and  name HD1#)(resid    6 and  name HN  ) 4.0 3.3 2.1
assign (resid    5 and  name HD2#)(resid    6 and  name HN  ) 4.0 3.3 2.1
assign (resid    5 and  name HD1#)(resid   28 and  name HA  ) 4.0 3.3 2.1
assign (resid    5 and  name HD2#)(resid   28 and  name HA  ) 4.0 3.3 2.1
assign (resid    5 and  name HN  )(resid   46 and  name HA  ) 4.0 2.2 1.0
assign (resid    5 and  name HA  )(resid   56 and  name HA  ) 4.0 2.2 1.0
assign (resid    5 and  name HA  )(resid   57 and  name HN  ) 4.0 2.2 1.0
!!Val-6, t, Jab=4.0
assign (resid    6 and  name HN  )(resid    6 and  name HA  ) 4.0 2.2 1.0
assign (resid    6 and  name HN  )(resid    6 and  name HB  ) 4.0 2.2 1.0
assign (resid    6 and  name HN  )(resid    6 and  name HG1#) 4.0 3.3 2.1
assign (resid    6 and  name HN  )(resid    6 and  name HG2#) 2.5 1.4 0.9
assign (resid    6 and  name HA  )(resid    6 and  name HB  ) 3.0 1.2 0.5
assign (resid    6 and  name HA  )(resid    6 and  name HG1#) 2.5 1.4 0.9
assign (resid    6 and  name HA  )(resid    6 and  name HG2#) 4.0 3.3 2.1
assign (resid    6 and  name HN  )(resid    7 and  name HN  ) 4.0 2.2 1.0
assign (resid    6 and  name HA  )(resid    7 and  name HN  ) 2.5 0.7 0.2
assign (resid    6 and  name HB  )(resid    7 and  name HN  ) 3.0 1.2 0.5
assign (resid    6 and  name HG1#)(resid    7 and  name HN  ) 3.0 2.1 1.4
assign (resid    6 and  name HG2#)(resid    7 and  name HN  ) 4.0 3.3 2.1
assign (resid    6 and  name HG1#)(resid   10 and  name HA1 ) 4.0 3.3 2.1
assign (resid    6 and  name HG1#)(resid   10 and  name HA2 ) 4.0 3.3 2.1
assign (resid    6 and  name HA  )(resid   12 and  name HA  ) 2.5 0.7 0.2
assign (resid    6 and  name HA  )(resid   13 and  name HN  ) 4.0 2.2 1.0
assign (resid    6 and  name HN  )(resid   56 and  name HA  ) 4.0 2.2 1.0
assign (resid    6 and  name HG2#)(resid   56 and  name HA  ) 4.0 3.3 2.1
assign (resid    6 and  name HG1#)(resid   57 and  name HA  ) 4.0 3.3 2.1
assign (resid    6 and  name HG2#)(resid   57 and  name HA  ) 4.0 3.3 2.1
assign (resid    6 and  name HB  )(resid   57 and  name HB1 ) 4.0 3.2 2.0
assign (resid    6 and  name HB  )(resid   57 and  name HB2 ) 4.0 3.2 2.0
assign (resid    6 and  name HA  )(resid   57 and  name HA  ) 4.0 2.2 1.0
assign (resid    6 and  name HA  )(resid   57 and  name HB1 ) 4.0 2.2 1.0
assign (resid    6 and  name HA  )(resid   57 and  name HB2 ) 4.0 2.2 1.0
assign (resid    6 and  name HG1#)(resid   57 and  name HN  ) 2.5 1.4 0.9
assign (resid    6 and  name HG2#)(resid   57 and  name HN  ) 4.0 3.3 2.1
assign (resid    6 and  name HG2#)(resid   57 and  name HD1 ) 4.0 3.3 2.1
assign (resid    6 and  name HG1#)(resid   57 and  name HD1 ) 2.5 1.4 0.9
assign (resid    6 and  name HB  )(resid   57 and  name HD1 ) 4.0 2.2 1.0
assign (resid    6 and  name HA  )(resid   57 and  name HD1 ) 4.0 2.2 1.0
assign (resid    6 and  name HB  )(resid   57 and  name HE1 ) 4.0 2.2 1.0
assign (resid    6 and  name HG1#)(resid   57 and  name HE1 ) 4.0 3.3 2.1
assign (resid    6 and  name HG1#)(resid   58 and  name HA  ) 4.0 3.3 2.1
assign (resid    6 and  name HG1#)(resid   59 and  name HN  ) 4.0 3.3 2.1 
!!Glu-7 
assign (resid    7 and  name HN  )(resid    7 and  name HA  ) 3.0 1.2 0.5
assign (resid    7 and  name HN  )(resid    7 and  name HB# ) 3.0 2.2 1.5
assign (resid    7 and  name HN  )(resid    7 and  name HG# ) 3.0 2.2 1.5
assign (resid    7 and  name HA  )(resid    7 and  name HB# ) 3.0 2.2 1.5
assign (resid    7 and  name HA  )(resid    7 and  name HG# ) 3.0 2.2 1.5
assign (resid    7 and  name HN  )(resid    8 and  name HN  ) 4.0 2.2 1.0
assign (resid    7 and  name HA  )(resid    8 and  name HN  ) 2.5 0.7 0.2
assign (resid    7 and  name HB# )(resid    8 and  name HN  ) 4.0 3.2 2.0
assign (resid    7 and  name HG# )(resid    8 and  name HN  ) 4.0 3.2 2.0
assign (resid    7 and  name HA  )(resid    9 and  name HN  ) 4.0 2.2 1.0
assign (resid    7 and  name HB# )(resid    9 and  name HN  ) 4.0 3.2 2.0
assign (resid    7 and  name HG# )(resid    9 and  name HN  ) 4.0 3.2 2.0
assign (resid    7 and  name HN  )(resid   10 and  name HN  ) 4.0 2.2 1.0
assign (resid    7 and  name HN  )(resid   11 and  name HN  ) 4.0 2.2 1.0
assign (resid    7 and  name HG# )(resid   13 and  name HA  ) 4.0 3.2 2.0
assign (resid    7 and  name HB# )(resid   13 and  name HA  ) 4.0 3.2 2.0
!!Lys-8 
assign (resid    8 and  name HN  )(resid    8 and  name HA  ) 3.0 1.2 0.5
assign (resid    8 and  name HN  )(resid    8 and  name HB# ) 3.0 2.2 1.5
assign (resid    8 and  name HN  )(resid    8 and  name HG# ) 4.0 3.3 2.0
assign (resid    8 and  name HA  )(resid    8 and  name HB# ) 3.0 2.2 1.5
assign (resid    8 and  name HN  )(resid    9 and  name HN  ) 3.0 1.2 0.5
assign (resid    8 and  name HB# )(resid    9 and  name HN  ) 4.0 3.2 2.0
assign (resid    8 and  name HG# )(resid    9 and  name HN  ) 4.0 3.2 2.0
!!Thr-9 
assign (resid    9 and  name HN  )(resid    9 and  name HA  ) 3.0 1.2 0.5
assign (resid    9 and  name HN  )(resid    9 and  name HG2#) 2.5 1.4 0.9
assign (resid    9 and  name HN  )(resid    9 and  name HB  ) 3.0 1.2 0.5
assign (resid    9 and  name HA  )(resid   10 and  name HN  ) 3.0 1.2 0.5
assign (resid    9 and  name HA  )(resid   10 and  name HN  ) 3.0 1.2 0.5
assign (resid    9 and  name HB  )(resid   10 and  name HN  ) 4.0 2.2 1.0
assign (resid    9 and  name HG2#)(resid   10 and  name HN  ) 4.0 3.3 2.1 
assign (resid    9 and  name HN  )(resid   11 and  name HN  ) 4.0 2.2 1.0 
assign (resid    9 and  name HB  )(resid   11 and  name HN  ) 4.0 2.2 1.0
!!Gly-10 
assign (resid   10 and  name HN  )(resid   10 and  name HA1 ) 3.0 1.2 0.5
assign (resid   10 and  name HN  )(resid   10 and  name HA2 ) 3.0 1.2 0.5
assign (resid   10 and  name HN  )(resid   11 and  name HN  ) 2.5 0.7 0.2
assign (resid   10 and  name HA1 )(resid   11 and  name HN  ) 4.0 2.2 1.0
assign (resid   10 and  name HA2 )(resid   11 and  name HN  ) 4.0 2.2 1.0
assign (resid   10 and  name HA1 )(resid   59 and  name HD# ) 4.0 4.8 3.6
assign (resid   10 and  name HA2 )(resid   59 and  name HD# ) 4.0 4.8 3.6
assign (resid   10 and  name HA# )(resid   64 and  name HN  ) 4.0 3.2 2.0
!!08oct t2g3 w/  B1 downfield 
assign (resid   11 and  name HN  )(resid   11 and  name HA  ) 3.0 1.2 0.5
assign (resid   11 and  name HN  )(resid   11 and  name HB1 ) 4.0 2.2 1.0
assign (resid   11 and  name HN  )(resid   11 and  name HB2 ) 3.0 1.2 0.5
assign (resid   11 and  name HA  )(resid   11 and  name HB1 ) 3.0 1.2 0.5
assign (resid   11 and  name HA  )(resid   11 and  name HB2 ) 4.0 2.2 1.0
assign (resid   11 and  name HN  )(resid   12 and  name HN  ) 4.0 2.2 1.0
assign (resid   11 and  name HA  )(resid   12 and  name HN  ) 2.5 0.7 0.2
assign (resid   11 and  name HB1 )(resid   12 and  name HN  ) 3.0 1.2 0.5
assign (resid   11 and  name HB2 )(resid   12 and  name HN  ) 4.0 2.2 1.0
assign (resid   11 and  name HA  )(resid   57 and  name HE1 ) 3.0 1.2 0.5
assign (resid   11 and  name HA  )(resid   57 and  name HD1 ) 4.0 2.2 1.0
assign (resid   11 and  name CB  )(resid   64 and  name SG  ) 3.0 0.1 0.1
assign (resid   11 and  name SG  )(resid   64 and  name SG  ) 2.0 0.1 0.1
assign (resid   11 and  name SG  )(resid   64 and  name CB  ) 3.0 0.1 0.1
assign (resid   11 and  name HA  )(resid   64 and  name HN  ) 4.0 2.2 1.0
assign (resid   11 and  name HA  )(resid   64 and  name HA  ) 4.0 2.2 1.0
assign (resid   11 and  name HN  )(resid   64 and  name HB2 ) 4.0 2.2 1.0
assign (resid   11 and  name HA  )(resid   64 and  name HB1 ) 4.0 2.0 1.0
assign (resid   11 and  name HA  )(resid   64 and  name HB2 ) 2.5 0.7 0.2
assign (resid   11 and  name HB1 )(resid   64 and  name HB2 ) 4.0 2.2 1.0
!!Lys-12 
assign (resid   12 and  name HN  )(resid   13 and  name HN  ) 4.0 2.2 1.0
assign (resid   12 and  name HN  )(resid   12 and  name HA  ) 3.0 1.2 0.5
assign (resid   12 and  name HN  )(resid   12 and  name HB1 ) 3.0 1.2 0.5
assign (resid   12 and  name HN  )(resid   12 and  name HB2 ) 3.0 1.2 0.5
assign (resid   12 and  name HN  )(resid   12 and  name HG1 ) 4.0 2.2 1.0
assign (resid   12 and  name HN  )(resid   12 and  name HG2 ) 4.0 2.2 1.0
assign (resid   12 and  name HN  )(resid   12 and  name HD1 ) 4.0 2.2 1.0
assign (resid   12 and  name HN  )(resid   12 and  name HD2 ) 4.0 2.2 1.0
assign (resid   12 and  name HA  )(resid   12 and  name HB1 ) 4.0 2.2 1.0
assign (resid   12 and  name HA  )(resid   12 and  name HB2 ) 4.0 2.2 1.0
assign (resid   12 and  name HA  )(resid   13 and  name HN  ) 2.5 0.7 0.2
assign (resid   12 and  name HB1 )(resid   13 and  name HN  ) 3.0 1.2 0.5
assign (resid   12 and  name HB2 )(resid   13 and  name HN  ) 3.0 1.2 0.5
assign (resid   12 and  name HG1 )(resid   13 and  name HN  ) 4.0 2.2 1.0
assign (resid   12 and  name HG2 )(resid   13 and  name HN  ) 4.0 2.2 1.0
assign (resid   12 and  name HN  )(resid   57 and  name HE1 ) 4.0 3.2 2.0 
assign (resid   12 and  name HN  )(resid   64 and  name HB1 ) 4.0 2.2 1.0
assign (resid   12 and  name HN  )(resid   64 and  name HB2 ) 4.0 2.2 1.0
!!Lys-13 
assign (resid   13 and  name HN  )(resid   13 and  name HA  ) 4.0 2.2 1.0
assign (resid   13 and  name HN  )(resid   13 and  name HB1 ) 4.0 2.2 1.0
assign (resid   13 and  name HN  )(resid   13 and  name HB2 ) 4.0 2.2 1.0
assign (resid   13 and  name HN  )(resid   13 and  name HG# ) 4.0 3.0 1.8
assign (resid   13 and  name HA  )(resid   13 and  name HB1 ) 3.0 1.2 0.5
assign (resid   13 and  name HA  )(resid   13 and  name HB2 ) 3.0 1.2 0.5
assign (resid   13 and  name HA  )(resid   13 and  name HG# ) 4.0 3.2 2.0
assign (resid   13 and  name HN  )(resid   14 and  name HN  ) 4.0 2.2 1.0
assign (resid   13 and  name HA  )(resid   14 and  name HN  ) 2.5 0.7 0.2
assign (resid   13 and  name HB1 )(resid   14 and  name HN  ) 4.0 2.2 1.0
assign (resid   13 and  name HB2 )(resid   14 and  name HN  ) 4.0 2.2 1.0
assign (resid   13 and  name HG# )(resid   14 and  name HN  ) 4.0 3.2 2.0
!!Thr-14 
assign (resid   14 and  name HN  )(resid   14 and  name HA  ) 3.0 1.2 0.5
assign (resid   14 and  name HN  )(resid   14 and  name HB  ) 2.5 0.7 0.2
assign (resid   14 and  name HN  )(resid   14 and  name HG2#) 3.0 2.1 1.4
assign (resid   14 and  name HA  )(resid   14 and  name HB  ) 3.0 1.2 0.5
assign (resid   14 and  name HA  )(resid   14 and  name HG2#) 3.0 2.2 1.5
assign (resid   14 and  name HN  )(resid   15 and  name HN  ) 4.0 2.2 1.0
assign (resid   14 and  name HA  )(resid   15 and  name HN  ) 2.5 0.7 0.2
assign (resid   14 and  name HB  )(resid   15 and  name HN  ) 4.0 2.2 1.0
assign (resid   14 and  name HG2#)(resid   15 and  name HN  ) 2.5 1.4 0.9
assign (resid   14 and  name HG2#)(resid   16 and  name HD# ) 4.0 5.3 4.1
assign (resid   14 and  name HG2#)(resid   16 and  name HE# ) 3.0 4.1 3.4
assign (resid   14 and  name HA  )(resid   44 and  name HA1 ) 3.0 1.2 0.5
assign (resid   14 and  name HA  )(resid   44 and  name HA2 ) 3.0 1.2 0.5
!!Cys-15
assign (resid   15 and  name HN  )(resid   15 and  name HA  ) 4.0 2.2 1.0
assign (resid   15 and  name HN  )(resid   15 and  name HB1 ) 3.0 1.2 0.5
assign (resid   15 and  name HN  )(resid   15 and  name HB2 ) 4.0 2.2 1.0
assign (resid   15 and  name HA  )(resid   15 and  name HB1 ) 3.0 1.2 0.5
assign (resid   15 and  name HA  )(resid   15 and  name HB2 ) 3.0 1.2 0.5
assign (resid   15 and  name HN  )(resid   16 and  name HN  ) 4.0 2.2 1.0
assign (resid   15 and  name HA  )(resid   16 and  name HN  ) 2.5 0.7 0.2
assign (resid   15 and  name HB1 )(resid   16 and  name HN  ) 4.0 2.2 1.0
assign (resid   15 and  name HB2 )(resid   16 and  name HN  ) 3.0 1.2 0.5
assign (resid   15 and  name HA  )(resid   21 and  name HD21) 4.0 2.2 1.0
assign (resid   15 and  name HA  )(resid   21 and  name HD22) 4.0 2.2 1.0
assign (resid   15 and  name HB1 )(resid   21 and  name HD21) 4.0 2.2 1.0
assign (resid   15 and  name HB1 )(resid   21 and  name HD22) 4.0 2.2 1.0
assign (resid   15 and  name HB2 )(resid   21 and  name HD21) 4.0 2.2 1.0
assign (resid   15 and  name HB2 )(resid   21 and  name HD22) 4.0 2.2 1.0
assign (resid   15 and  name HN  )(resid   43 and  name HA  ) 4.0 2.2 1.0
assign (resid   15 and  name HN  )(resid   43 and  name HB1 ) 4.0 2.2 1.0
assign (resid   15 and  name HN  )(resid   43 and  name HB2 ) 4.0 2.2 1.0
assign (resid   15 and  name CB  )(resid   40 and  name SG  ) 3.0 0.1 0.1
assign (resid   15 and  name SG  )(resid   40 and  name SG  ) 2.0 0.1 0.1
assign (resid   15 and  name SG  )(resid   40 and  name CB  ) 3.0 0.1 0.1
!!Tyr16 (UF=B1)
assign (resid   16 and  name HN  )(resid   16 and  name HA  ) 4.0 2.2 1.0
assign (resid   16 and  name HN  )(resid   16 and  name HB1 ) 4.0 2.2 1.0
assign (resid   16 and  name HN  )(resid   16 and  name HB2 ) 4.0 2.2 1.0
assign (resid   16 and  name HA  )(resid   16 and  name HB1 ) 3.0 1.2 0.5
assign (resid   16 and  name HA  )(resid   16 and  name HB2 ) 3.0 1.2 0.5
assign (resid   16 and  name HA  )(resid   16 and  name HD# ) 3.0 3.2 3.0
assign (resid   16 and  name HA  )(resid   16 and  name HE# ) 4.0 4.2 4.0
assign (resid   16 and  name HB1 )(resid   16 and  name HD# ) 2.5 2.7 2.2
assign (resid   16 and  name HB1 )(resid   16 and  name HE# ) 4.0 4.2 3.0
assign (resid   16 and  name HB2 )(resid   16 and  name HD# ) 2.5 2.7 2.2
assign (resid   16 and  name HB2 )(resid   16 and  name HE# ) 4.0 4.2 3.0
assign (resid   16 and  name HN  )(resid   17 and  name HN  ) 3.0 1.2 0.5
assign (resid   16 and  name HA  )(resid   17 and  name HN  ) 4.0 2.2 1.0
assign (resid   16 and  name HA  )(resid   43 and  name HD# ) 3.0 3.2 2.3
assign (resid   16 and  name HA  )(resid   43 and  name HE# ) 4.0 4.2 3.0
!!Lys-17 
assign (resid   17 and  name HN  )(resid   17 and  name HA  ) 4.0 2.2 1.0
assign (resid   17 and  name HN  )(resid   17 and  name HB# ) 3.0 2.2 1.5
assign (resid   17 and  name HA  )(resid   17 and  name HB# ) 3.0 2.2 1.5
assign (resid   17 and  name HN  )(resid   18 and  name HN  ) 4.0 2.2 1.0
assign (resid   17 and  name HA  )(resid   18 and  name HN  ) 2.5 0.7 0.2
assign (resid   17 and  name HB# )(resid   18 and  name HN  ) 3.0 2.2 1.5
!!Leu-18 
assign (resid   18 and  name HN  )(resid   18 and  name HA  ) 4.0 2.2 1.0
assign (resid   18 and  name HN  )(resid   18 and  name HB1 ) 4.0 2.2 1.0
assign (resid   18 and  name HN  )(resid   18 and  name HB2 ) 3.0 1.2 0.5
assign (resid   18 and  name HN  )(resid   18 and  name HG  ) 3.0 1.2 0.5
assign (resid   18 and  name HN  )(resid   18 and  name HD1#) 3.0 2.1 1.4
assign (resid   18 and  name HN  )(resid   18 and  name HD2#) 3.0 2.1 1.4  
assign (resid   18 and  name HA  )(resid   18 and  name HD1#) 4.0 4.2 3.0
assign (resid   18 and  name HA  )(resid   18 and  name HD2#) 2.5 2.7 2.2
assign (resid   18 and  name HA  )(resid   19 and  name HN  ) 2.5 0.7 0.2
assign (resid   18 and  name HN  )(resid   19 and  name HN  ) 4.0 2.2 1.0
assign (resid   18 and  name HB1 )(resid   19 and  name HN  ) 4.0 2.2 1.0
assign (resid   18 and  name HB2 )(resid   19 and  name HN  ) 4.0 2.2 1.0
assign (resid   18 and  name HG  )(resid   19 and  name HN  ) 4.0 2.2 1.0
assign (resid   18 and  name HD1#)(resid   19 and  name HN  ) 4.0 3.3 2.1
assign (resid   18 and  name HD2#)(resid   19 and  name HN  ) 3.0 2.1 1.4
assign (resid   18 and  name HA  )(resid   40 and  name HN  ) 4.0 2.2 1.0
assign (resid   18 and  name HA  )(resid   40 and  name HB1 ) 4.0 2.2 1.0
assign (resid   18 and  name HA  )(resid   40 and  name HB2 ) 4.0 2.2 1.0
assign (resid   18 and  name HD1#)(resid   41 and  name HA  ) 4.0 3.3 2.1
assign (resid   18 and  name HD2#)(resid   41 and  name HA  ) 4.0 3.3 2.1
assign (resid   18 and  name HD1#)(resid   42 and  name HA# ) 4.0 3.2 2.1
assign (resid   18 and  name HD2#)(resid   42 and  name HA# ) 4.0 3.2 2.1
assign (resid   18 and  name HD1#)(resid   42 and  name HN  ) 4.0 3.3 2.1
assign (resid   18 and  name HD2#)(resid   42 and  name HN  ) 3.0 2.1 1.4
assign (resid   18 and  name HD2#)(resid   43 and  name HN  ) 3.0 2.1 1.4
assign (resid   18 and  name HB1 )(resid   43 and  name HD# ) 4.0 4.2 3.0
assign (resid   18 and  name HB1 )(resid   43 and  name HE# ) 4.0 4.2 3.0
assign (resid   18 and  name HB2 )(resid   43 and  name HD# ) 4.0 4.2 3.0
assign (resid   18 and  name HB2 )(resid   43 and  name HE# ) 4.0 4.2 3.0
assign (resid   18 and  name HG  )(resid   43 and  name HD# ) 4.0 4.2 3.0
assign (resid   18 and  name HG  )(resid   43 and  name HE# ) 4.0 4.2 3.0
assign (resid   18 and  name HD1#)(resid   43 and  name HD# ) 4.0 5.3 4.1
assign (resid   18 and  name HD1#)(resid   43 and  name HE# ) 2.5 2.7 2.2
assign (resid   18 and  name HD2#)(resid   43 and  name HD# ) 3.0 4.1 3.4
assign (resid   18 and  name HD2#)(resid   43 and  name HE# ) 3.0 4.1 3.4
assign (resid   18 and  name HD2#)(resid   44 and  name HN  ) 3.0 2.1 1.4
!!Gly-19
assign (resid   19 and  name HN  )(resid   19 and  name HA1 ) 3.0 1.2 0.5
assign (resid   19 and  name HN  )(resid   19 and  name HA2 ) 3.0 1.2 0.5
assign (resid   19 and  name HA1 )(resid   20 and  name HN  ) 2.5 0.7 0.2
assign (resid   19 and  name HA2 )(resid   20 and  name HN  ) 2.5 0.7 0.2
assign (resid   19 and  name HN  )(resid   20 and  name HN  ) 4.0 2.2 1.0
assign (resid   19 and  name HA1 )(resid   21 and  name HN  ) 4.0 2.2 1.0
assign (resid   19 and  name HA2 )(resid   21 and  name HN  ) 4.0 2.2 1.0
assign (resid   19 and  name HA1 )(resid   39 and  name HD# ) 4.0 4.2 3.0
assign (resid   19 and  name HA2 )(resid   39 and  name HD# ) 4.0 4.2 3.0
assign (resid   19 and  name HN  )(resid   40 and  name HN  ) 4.0 2.2 1.0
assign (resid   19 and  name HA# )(resid   40 and  name HN  ) 4.0 3.2 2.0
assign (resid   19 and  name HN  )(resid   40 and  name HB1 ) 4.0 2.2 1.0
assign (resid   19 and  name HN  )(resid   40 and  name HB2 ) 4.0 2.2 1.0
!!Glu-20
assign (resid   20 and  name HN  )(resid   20 and  name HA  ) 4.0 2.2 1.0
assign (resid   20 and  name HN  )(resid   21 and  name HN  ) 4.0 2.2 1.0
assign (resid   20 and  name HA  )(resid   21 and  name HN  ) 3.0 1.2 0.5
assign (resid   20 and  name HB# )(resid   21 and  name HN  ) 4.0 3.2 2.0
assign (resid   20 and  name HG# )(resid   21 and  name HN  ) 4.0 3.2 2.0
assign (resid   20 and  name HA  )(resid   22 and  name HN  ) 4.0 2.2 1.0
assign (resid   20 and  name HA  )(resid   39 and  name HA  ) 4.0 2.2 1.0
assign (resid   20 and  name HA  )(resid   39 and  name HB# ) 3.0 2.2 1.5
assign (resid   20 and  name HA  )(resid   39 and  name HD# ) 4.0 4.2 3.0
!!Asn-21
assign (resid   21 and  name HN  )(resid   21 and  name HA  ) 4.0 2.2 1.0
assign (resid   21 and  name HN  )(resid   21 and  name HB1 ) 4.0 2.2 1.0
assign (resid   21 and  name HN  )(resid   21 and  name HB2 ) 4.0 2.2 1.0
assign (resid   21 and  name HA  )(resid   21 and  name HB1 ) 4.0 2.2 1.0
assign (resid   21 and  name HA  )(resid   21 and  name HB2 ) 4.0 2.2 1.0 
assign (resid   21 and  name HN  )(resid   22 and  name HN  ) 4.0 2.2 1.0
assign (resid   21 and  name HA  )(resid   22 and  name HN  ) 3.0 1.2 0.5
assign (resid   21 and  name HB1 )(resid   22 and  name HN  ) 4.0 2.2 1.0
assign (resid   21 and  name HB2 )(resid   22 and  name HN  ) 4.0 2.2 1.0
assign (resid   21 and  name HA  )(resid   23 and  name HN  ) 4.0 2.2 1.0
assign (resid   21 and  name HN  )(resid   39 and  name HA  ) 4.0 2.2 1.0
assign (resid   21 and  name HA  )(resid   40 and  name HN  ) 4.0 2.2 1.0
assign (resid   21 and  name HB1 )(resid   40 and  name HB1 ) 4.0 2.2 1.0
assign (resid   21 and  name HB1 )(resid   40 and  name HB2 ) 4.0 2.2 1.0
assign (resid   21 and  name HB2 )(resid   40 and  name HB1 ) 4.0 2.2 1.0
assign (resid   21 and  name HB2 )(resid   40 and  name HB2 ) 4.0 2.2 1.0
!!ASP-22 
assign (resid   22 and  name HN  )(resid   22 and  name HA  ) 4.0 2.2 1.0
assign (resid   22 and  name HN  )(resid   22 and  name HB1 ) 3.0 1.2 0.5
assign (resid   22 and  name HN  )(resid   22 and  name HB2 ) 3.0 1.2 0.5
assign (resid   22 and  name HA  )(resid   22 and  name HB1 ) 4.0 2.2 1.0 
assign (resid   22 and  name HA  )(resid   22 and  name HB2 ) 3.0 1.2 0.5
assign (resid   22 and  name HN  )(resid   23 and  name HN  ) 4.0 2.2 1.0
assign (resid   22 and  name HA  )(resid   23 and  name HN  ) 4.0 2.2 1.0
assign (resid   22 and  name HB1 )(resid   23 and  name HN  ) 4.0 2.2 1.0
assign (resid   22 and  name HB2 )(resid   23 and  name HN  ) 4.0 2.2 1.0
assign (resid   22 and  name HA  )(resid   24 and  name HN  ) 4.0 2.2 1.0
assign (resid   22 and  name HN  )(resid   24 and  name HN  ) 4.0 2.2 1.0
assign (resid   22 and  name HA  )(resid   25 and  name HN  ) 3.0 1.2 0.5
assign (resid   22 and  name HA  )(resid   25 and  name HD22) 4.0 2.2 1.0
assign (resid   22 and  name HA  )(resid   25 and  name HD21) 4.0 2.2 1.0
assign (resid   22 and  name HA  )(resid   26 and  name HN  ) 4.0 2.2 1.0
!!PHE-23 
assign (resid   23 and  name HN  )(resid   23 and  name HA  ) 3.0 1.2 0.5
assign (resid   23 and  name HN  )(resid   23 and  name HB1 ) 3.0 1.2 0.5
assign (resid   23 and  name HN  )(resid   23 and  name HB2 ) 3.0 1.2 0.5
assign (resid   23 and  name HN  )(resid   23 and  name HD# ) 4.0 3.2 3.0
assign (resid   23 and  name HA  )(resid   23 and  name HB1 ) 3.0 1.2 0.5
assign (resid   23 and  name HA  )(resid   23 and  name HB2 ) 3.0 1.2 0.5
assign (resid   23 and  name HA  )(resid   23 and  name HD# ) 2.5 2.7 2.2
assign (resid   23 and  name HB1 )(resid   23 and  name HD# ) 2.5 2.7 2.2
assign (resid   23 and  name HB2 )(resid   23 and  name HD# ) 2.5 2.7 2.2
assign (resid   23 and  name HN  )(resid   24 and  name HN  ) 2.5 0.7 2.2
assign (resid   23 and  name HA  )(resid   24 and  name HN  ) 4.0 2.2 1.0
assign (resid   23 and  name HB1 )(resid   24 and  name HN  ) 3.0 1.2 0.5
assign (resid   23 and  name HB2 )(resid   24 and  name HN  ) 3.0 1.2 0.5
assign (resid   23 and  name HD# )(resid   24 and  name HN  ) 3.0 3.2 2.5
assign (resid   23 and  name HN  )(resid   25 and  name HN  ) 4.0 2.2 1.0
assign (resid   23 and  name HA  )(resid   26 and  name HN  ) 4.0 2.2 1.0
assign (resid   23 and  name HA  )(resid   26 and  name HB1 ) 4.0 2.2 1.0
assign (resid   23 and  name HA  )(resid   26 and  name HB2 ) 4.0 2.2 1.0
assign (resid   23 and  name HA  )(resid   27 and  name HN  ) 4.0 2.2 1.0
!!CYS-24
assign (resid   24 and  name HN  )(resid   24 and  name HA  ) 3.0 1.2 0.5
assign (resid   24 and  name HN  )(resid   24 and  name HB1 ) 3.0 1.2 0.5
assign (resid   24 and  name HN  )(resid   24 and  name HB2 ) 3.0 1.2 0.5
assign (resid   24 and  name HA  )(resid   24 and  name HB1 ) 4.0 2.2 1.0
assign (resid   24 and  name HA  )(resid   24 and  name HB2 ) 4.0 2.2 1.0
assign (resid   24 and  name HN  )(resid   25 and  name HN  ) 4.0 2.2 1.0
assign (resid   24 and  name HA  )(resid   25 and  name HN  ) 4.0 2.2 1.0
assign (resid   24 and  name HB2 )(resid   25 and  name HN  ) 4.0 2.2 1.0
assign (resid   24 and  name HB1 )(resid   25 and  name HN  ) 4.0 2.2 1.0
assign (resid   24 and  name HA  )(resid   27 and  name HN  ) 3.0 1.2 0.5
assign (resid   24 and  name HA  )(resid   27 and  name HB1 ) 4.0 2.2 1.0
assign (resid   24 and  name HA  )(resid   27 and  name HB2 ) 4.0 2.2 1.0
assign (resid   24 and  name HB# )(resid   39 and  name HA  ) 4.0 3.2 2.0
assign (resid   24 and  name CB  )(resid   45 and  name SG  ) 3.0 0.1 0.1
assign (resid   24 and  name SG  )(resid   45 and  name SG  ) 2.0 0.1 0.1
assign (resid   24 and  name SG  )(resid   45 and  name CB  ) 3.0 0.1 0.1
!!ASN-25
assign (resid   25 and  name HN  )(resid   25 and  name HA  ) 3.0 1.2 0.5
assign (resid   25 and  name HN  )(resid   25 and  name HB# ) 4.0 3.2 2.0
assign (resid   25 and  name HA  )(resid   25 and  name HB# ) 4.0 3.2 2.0
assign (resid   25 and  name HN  )(resid   26 and  name HN  ) 3.0 1.2 0.5
assign (resid   25 and  name HA  )(resid   26 and  name HN  ) 4.0 2.2 1.0
assign (resid   25 and  name HB# )(resid   26 and  name HN  ) 3.0 1.2 0.5
assign (resid   25 and  name HN  )(resid   27 and  name HN  ) 4.0 2.2 1.0
assign (resid   25 and  name HA  )(resid   28 and  name HN  ) 4.0 2.2 1.0
assign (resid   25 and  name HA  )(resid   28 and  name HB# ) 4.0 3.2 2.0
assign (resid   25 and  name HA  )(resid   38 and  name HA1 ) 4.0 2.2 1.0
assign (resid   25 and  name HA  )(resid   38 and  name HA2 ) 4.0 2.2 1.0
!!ARG-26
assign (resid   26 and  name HN  )(resid   26 and  name HA  ) 3.0 1.2 0.5
assign (resid   26 and  name HN  )(resid   26 and  name HB1 ) 3.0 1.2 0.5
assign (resid   26 and  name HN  )(resid   26 and  name HB2 ) 3.0 1.2 0.5
assign (resid   26 and  name HN  )(resid   26 and  name HG1 ) 4.0 2.2 1.0 
assign (resid   26 and  name HN  )(resid   26 and  name HG2 ) 4.0 2.2 1.0
assign (resid   26 and  name HA  )(resid   26 and  name HB1 ) 4.0 2.2 1.0
assign (resid   26 and  name HA  )(resid   26 and  name HB2 ) 4.0 2.2 1.0
assign (resid   26 and  name HA  )(resid   26 and  name HG1 ) 4.0 2.2 1.0
assign (resid   26 and  name HA  )(resid   26 and  name HG2 ) 4.0 2.2 1.0
assign (resid   26 and  name HN  )(resid   27 and  name HN  ) 4.0 2.2 1.0
assign (resid   26 and  name HA  )(resid   27 and  name HN  ) 4.0 2.2 1.0
assign (resid   26 and  name HB1 )(resid   27 and  name HN  ) 4.0 2.2 1.0
assign (resid   26 and  name HB2 )(resid   27 and  name HN  ) 4.0 2.2 1.0
assign (resid   26 and  name HG1 )(resid   27 and  name HN  ) 4.0 2.2 1.0
assign (resid   26 and  name HG2 )(resid   27 and  name HN  ) 4.0 2.2 1.0
assign (resid   26 and  name HN  )(resid   28 and  name HN  ) 4.0 2.2 1.0
assign (resid   26 and  name HA  )(resid   29 and  name HN  ) 4.0 2.2 1.0
assign (resid   26 and  name HA  )(resid   29 and  name HB# ) 4.0 3.2 2.0
!!GLU-27         
assign (resid   27 and  name HN  )(resid   27 and  name HA  ) 3.0 1.2 0.5
assign (resid   27 and  name HN  )(resid   27 and  name HB1 ) 3.0 1.2 0.5
assign (resid   27 and  name HN  )(resid   27 and  name HB2 ) 3.0 1.2 0.5
assign (resid   27 and  name HN  )(resid   27 and  name HG1 ) 4.0 2.2 1.0
assign (resid   27 and  name HN  )(resid   27 and  name HG2 ) 4.0 2.2 1.0
assign (resid   27 and  name HA  )(resid   27 and  name HB1 ) 4.0 2.2 1.0
assign (resid   27 and  name HA  )(resid   27 and  name HB2 ) 4.0 2.2 1.0
assign (resid   27 and  name HN  )(resid   28 and  name HN  ) 3.0 1.2 0.5
assign (resid   27 and  name HA  )(resid   28 and  name HN  ) 4.0 2.2 1.0
assign (resid   27 and  name HB1 )(resid   28 and  name HN  ) 4.0 2.2 1.0
assign (resid   27 and  name HB2 )(resid   28 and  name HN  ) 4.0 2.2 1.0
assign (resid   27 and  name HN  )(resid   29 and  name HN  ) 4.0 2.2 1.0
assign (resid   27 and  name HA  )(resid   30 and  name HE1 ) 4.0 2.2 1.0
assign (resid   27 and  name HB# )(resid   30 and  name HE1 ) 4.0 3.2 2.0
!!CYS-28 
assign (resid   28 and  name CB  )(resid   47 and  name SG  ) 3.0 0.1 0.1
assign (resid   28 and  name SG  )(resid   47 and  name SG  ) 2.0 0.1 0.1
assign (resid   28 and  name SG  )(resid   47 and  name CB  ) 3.0 0.1 0.1
assign (resid   28 and  name HN  )(resid   28 and  name HA  ) 3.0 1.2 0.5
assign (resid   28 and  name HN  )(resid   28 and  name HB1 ) 4.0 2.2 1.0
assign (resid   28 and  name HN  )(resid   28 and  name HB2 ) 4.0 2.2 1.0
assign (resid   28 and  name HA  )(resid   28 and  name HB1 ) 3.0 1.2 0.5
assign (resid   28 and  name HA  )(resid   28 and  name HB2 ) 3.0 1.2 0.5
assign (resid   28 and  name HN  )(resid   29 and  name HN  ) 3.0 1.2 0.5
assign (resid   28 and  name HA  )(resid   29 and  name HN  ) 4.0 2.2 1.0
assign (resid   28 and  name HB1 )(resid   29 and  name HN  ) 4.0 2.2 1.0
assign (resid   28 and  name HB2 )(resid   29 and  name HN  ) 4.0 2.2 1.0
!!LYS-29
assign (resid   29 and  name HN  )(resid   29 and  name HA  ) 3.0 1.2 0.5
assign (resid   29 and  name HN  )(resid   29 and  name HB1 ) 4.0 2.2 1.0
assign (resid   29 and  name HN  )(resid   29 and  name HB2 ) 4.0 2.2 1.0
assign (resid   29 and  name HN  )(resid   29 and  name HG# ) 4.0 3.2 2.0
assign (resid   29 and  name HN  )(resid   29 and  name HD# ) 4.0 3.2 2.0
assign (resid   29 and  name HN  )(resid   30 and  name HN  ) 3.0 1.2 0.5
assign (resid   29 and  name HA  )(resid   30 and  name HN  ) 4.0 2.2 1.0
assign (resid   29 and  name HB1 )(resid   30 and  name HN  ) 4.0 2.2 1.0
assign (resid   29 and  name HB2 )(resid   30 and  name HN  ) 4.0 2.2 1.0
!!TRP-30
assign (resid   30 and  name HN  )(resid   30 and  name HA  ) 3.0 1.2 0.5
assign (resid   30 and  name HN  )(resid   30 and  name HB1 ) 4.0 2.2 1.0
assign (resid   30 and  name HN  )(resid   30 and  name HB2 ) 4.0 2.2 1.0
assign (resid   30 and  name HA  )(resid   30 and  name HD1 ) 4.0 2.2 1.0
assign (resid   30 and  name HA  )(resid   30 and  name HE3 ) 3.0 1.2 0.5
assign (resid   30 and  name HB1 )(resid   30 and  name HD1 ) 3.0 1.2 0.5
assign (resid   30 and  name HB2 )(resid   30 and  name HD1 ) 3.0 1.2 0.5
assign (resid   30 and  name HN  )(resid   31 and  name HN  ) 4.0 2.2 1.0
assign (resid   30 and  name HA  )(resid   31 and  name HN  ) 4.0 2.2 1.0
!!LYS-31
assign (resid   31 and  name HN  )(resid   31 and  name HA  ) 4.0 2.2 1.0
assign (resid   31 and  name HN  )(resid   31 and  name HB1 ) 4.0 2.2 1.0
assign (resid   31 and  name HN  )(resid   31 and  name HB2 ) 4.0 2.2 1.0
assign (resid   31 and  name HN  )(resid   31 and  name HB# ) 3.0 2.2 1.5
assign (resid   31 and  name HN  )(resid   31 and  name HG# ) 3.0 2.2 1.5
!!H32 
assign (resid   32 and  name HA  )(resid   32 and  name HB1 ) 3.0 1.2 0.5
assign (resid   32 and  name HA  )(resid   32 and  name HB2 ) 3.0 1.2 0.5
assign (resid   32 and  name HA  )(resid   32 and  name HE1 ) 2.5 0.7 0.2
assign (resid   32 and  name HA  )(resid   32 and  name HD2 ) 4.0 2.2 1.0
assign (resid   32 and  name HB1 )(resid   32 and  name HD2 ) 3.0 1.2 0.5
assign (resid   32 and  name HB2 )(resid   32 and  name HD2 ) 3.0 1.2 0.5
!!Ile33
assign (resid   33 and  name HN  )(resid   33 and  name HA  ) 3.0 1.2 0.5
assign (resid   33 and  name HN  )(resid   33 and  name HB  ) 3.0 1.2 0.5
assign (resid   33 and  name HN  )(resid   33 and  name HG1#) 4.0 3.3 2.1
assign (resid   33 and  name HN  )(resid   33 and  name HD1#) 4.0 3.3 2.1
assign (resid   33 and  name HN  )(resid   33 and  name HG2#) 4.0 3.3 2.1
assign (resid   33 and  name HA  )(resid   33 and  name HB  ) 4.0 2.2 1.0
assign (resid   33 and  name HA  )(resid   33 and  name HG2#) 3.0 2.1 1.4
assign (resid   33 and  name HA  )(resid   33 and  name HD1#) 3.0 2.1 1.4
assign (resid   33 and  name HN  )(resid   34 and  name HN  ) 2.5 0.7 0.2
assign (resid   33 and  name HA  )(resid   34 and  name HN  ) 4.0 2.2 1.0
assign (resid   33 and  name HB  )(resid   34 and  name HN  ) 3.0 1.2 0.5
assign (resid   33 and  name HG2#)(resid   34 and  name HN  ) 4.0 3.3 2.1
assign (resid   33 and  name HD1#)(resid   34 and  name HN  ) 4.0 3.3 2.1
assign (resid   33 and  name HN  )(resid   35 and  name HN  ) 4.0 2.2 1.0
assign (resid   33 and  name HA  )(resid   54 and  name HG2#) 4.0 3.3 2.1
!!Gly34 
assign (resid   34 and  name HN  )(resid   34 and  name HA1 ) 3.0 1.2 0.5
assign (resid   34 and  name HN  )(resid   34 and  name HA2 ) 3.0 1.2 0.5
assign (resid   34 and  name HN  )(resid   35 and  name HN  ) 3.0 1.2 0.5
assign (resid   34 and  name HA1 )(resid   35 and  name HN  ) 3.0 1.2 0.5
assign (resid   34 and  name HA2 )(resid   35 and  name HN  ) 3.0 1.2 0.5
assign (resid   34 and  name HA# )(resid   51 and  name HG1 ) 4.0 3.2 2.0
assign (resid   34 and  name HA# )(resid   51 and  name HG2 ) 4.0 3.2 2.0
assign (resid   34 and  name HA# )(resid   51 and  name HD# ) 4.0 4.2 3.0
!!Gly35 
assign (resid   35 and  name HN  )(resid   35 and  name HA1 ) 3.0 1.2 0.5
assign (resid   35 and  name HN  )(resid   35 and  name HA2 ) 3.0 1.2 0.5
assign (resid   35 and  name HN  )(resid   36 and  name HN  ) 4.0 2.2 1.0
assign (resid   35 and  name HA1 )(resid   36 and  name HN  ) 3.0 1.2 0.5
assign (resid   35 and  name HA2 )(resid   36 and  name HN  ) 3.0 1.2 0.5
assign (resid   35 and  name HA# )(resid   37 and  name HN  ) 4.0 3.2 2.0
!!Ser36
assign (resid   36 and  name HN  )(resid   36 and  name HA  ) 3.0 1.2 0.5 
assign (resid   36 and  name HN  )(resid   36 and  name HB1 ) 3.0 1.2 0.5
assign (resid   36 and  name HN  )(resid   36 and  name HB2 ) 3.0 1.2 0.5
assign (resid   36 and  name HA  )(resid   36 and  name HB1 ) 3.0 1.2 0.5
assign (resid   36 and  name HA  )(resid   36 and  name HB2 ) 3.0 1.2 0.5
assign (resid   36 and  name HN  )(resid   37 and  name HN  ) 4.0 2.2 1.0
assign (resid   36 and  name HA  )(resid   37 and  name HN  ) 4.0 2.2 1.0
assign (resid   36 and  name HB1 )(resid   37 and  name HN  ) 4.0 2.2 1.0
assign (resid   36 and  name HB2 )(resid   37 and  name HN  ) 4.0 2.2 1.0
assign (resid   36 and  name HN  )(resid   49 and  name HA1 ) 4.0 2.2 1.0
assign (resid   36 and  name HN  )(resid   49 and  name HA2 ) 4.0 2.2 1.0
!!Tyr37 
assign (resid   37 and  name HN  )(resid   37 and  name HA  ) 3.0 1.2 0.5
assign (resid   37 and  name HN  )(resid   37 and  name HB1 ) 3.0 1.2 0.5
assign (resid   37 and  name HN  )(resid   37 and  name HB2 ) 3.0 1.2 0.5
assign (resid   37 and  name HA  )(resid   37 and  name HB1 ) 4.0 2.2 1.0
assign (resid   37 and  name HA  )(resid   37 and  name HB2 ) 3.0 1.2 0.5
assign (resid   37 and  name HA  )(resid   37 and  name HD# ) 2.5 2.7 0.2
assign (resid   37 and  name HB1 )(resid   37 and  name HD# ) 2.5 2.7 0.2
assign (resid   37 and  name HB2 )(resid   37 and  name HD# ) 2.5 2.7 0.2
assign (resid   37 and  name HB1 )(resid   37 and  name HE# ) 4.0 4.2 3.0
assign (resid   37 and  name HB2 )(resid   37 and  name HE# ) 4.0 4.2 3.0
assign (resid   37 and  name HN  )(resid   38 and  name HN  ) 4.0 2.2 1.0
assign (resid   37 and  name HA  )(resid   38 and  name HN  ) 4.0 2.2 1.0
assign (resid   37 and  name HB1 )(resid   38 and  name HN  ) 4.0 2.2 1.0
assign (resid   37 and  name HB2 )(resid   38 and  name HN  ) 4.0 2.2 1.0
assign (resid   37 and  name HN  )(resid   47 and  name HA  ) 4.0 2.2 1.0
assign (resid   37 and  name HD# )(resid   39 and  name HE# ) 4.0 6.2 5.0
assign (resid   37 and  name HN  )(resid   48 and  name HN  ) 3.0 1.2 0.5
assign (resid   37 and  name HD# )(resid   48 and  name HB# ) 4.0 5.2 4.0
assign (resid   37 and  name HD# )(resid   48 and  name HG# ) 4.0 5.2 4.0
!!Gly38 
assign (resid   38 and  name HN  )(resid   38 and  name HA1 ) 3.0 1.2 0.5
assign (resid   38 and  name HN  )(resid   38 and  name HA2 ) 3.0 1.2 0.5
assign (resid   38 and  name HA1 )(resid   47 and  name HA  ) 3.0 1.2 0.5
assign (resid   38 and  name HA2 )(resid   47 and  name HA  ) 3.0 1.2 0.5
!!Tyr39 
assign (resid   39 and  name HA  )(resid   39 and  name HB1 ) 3.0 1.2 0.5
assign (resid   39 and  name HA  )(resid   39 and  name HB2 ) 3.0 1.2 0.5
assign (resid   39 and  name HA  )(resid   39 and  name HD# ) 4.0 4.2 3.0
assign (resid   39 and  name HB1 )(resid   39 and  name HD# ) 3.0 3.2 2.5
assign (resid   39 and  name HB2 )(resid   39 and  name HD# ) 3.0 3.2 2.5
assign (resid   39 and  name HA  )(resid   40 and  name HN  ) 3.0 1.2 0.5
assign (resid   39 and  name HD# )(resid   41 and  name HA  ) 4.0 4.2 3.0
assign (resid   39 and  name HE# )(resid   41 and  name HA  ) 4.0 4.2 3.0
assign (resid   39 and  name HD# )(resid   46 and  name HD1 ) 4.0 4.2 3.0
!!Cys40
assign (resid   40 and  name HN  )(resid   40 and  name HA  ) 4.0 2.2 1.0
assign (resid   40 and  name HN  )(resid   40 and  name HB1 ) 3.0 1.2 0.5
assign (resid   40 and  name HN  )(resid   40 and  name HB2 ) 3.0 1.2 0.5
assign (resid   40 and  name HA  )(resid   40 and  name HB1 ) 4.0 2.2 1.0
assign (resid   40 and  name HA  )(resid   40 and  name HB2 ) 3.0 1.2 0.5
assign (resid   40 and  name HN  )(resid   41 and  name HN  ) 4.0 2.2 1.0
assign (resid   40 and  name HA  )(resid   41 and  name HN  ) 3.0 1.2 0.5
assign (resid   40 and  name HB1 )(resid   41 and  name HN  ) 4.0 2.2 1.0
assign (resid   40 and  name HB2 )(resid   41 and  name HN  ) 4.0 2.2 1.0
assign (resid   40 and  name HA  )(resid   44 and  name HN  ) 4.0 2.2 1.0
assign (resid   40 and  name HA  )(resid   46 and  name HN  ) 4.0 2.2 1.0
!!Tyr41 
assign (resid   41 and  name HN  )(resid   41 and  name HA  ) 4.0 2.2 1.0
assign (resid   41 and  name HN  )(resid   41 and  name HB1 ) 3.0 1.2 0.5
assign (resid   41 and  name HN  )(resid   41 and  name HB2 ) 3.0 1.2 0.5
assign (resid   41 and  name HN  )(resid   41 and  name HD# ) 4.0 3.2 3.0
assign (resid   41 and  name HA  )(resid   41 and  name HB1 ) 4.0 2.2 1.0
assign (resid   41 and  name HA  )(resid   41 and  name HB2 ) 4.0 2.2 1.0 
assign (resid   41 and  name HA  )(resid   41 and  name HD# ) 3.0 3.2 2.5
assign (resid   41 and  name HB1 )(resid   41 and  name HD# ) 4.0 4.2 3.0
assign (resid   41 and  name HB2 )(resid   41 and  name HD# ) 4.0 4.2 3.0
assign (resid   41 and  name HB1 )(resid   41 and  name HE# ) 4.0 4.2 3.0
assign (resid   41 and  name HB2 )(resid   41 and  name HE# ) 4.0 4.2 3.0
assign (resid   41 and  name HA  )(resid   42 and  name HN  ) 2.5 0.7 0.2
assign (resid   41 and  name HB1 )(resid   42 and  name HN  ) 4.0 2.2 1.0
assign (resid   41 and  name HB2 )(resid   42 and  name HN  ) 4.0 2.2 1.0
assign (resid   41 and  name HN  )(resid   43 and  name HN  ) 4.0 2.2 1.0
assign (resid   41 and  name HN  )(resid   44 and  name HN  ) 3.0 1.2 0.5
assign (resid   41 and  name HA  )(resid   44 and  name HN  ) 4.0 2.2 1.0
assign (resid   41 and  name HN  )(resid   45 and  name HA  ) 4.0 2.2 1.0
assign (resid   41 and  name HN  )(resid   46 and  name HN  ) 4.0 2.2 1.0
assign (resid   41 and  name HN  )(resid   46 and  name HB1 ) 4.0 2.2 1.0
assign (resid   41 and  name HN  )(resid   46 and  name HB2 ) 4.0 2.2 1.0
assign (resid   41 and  name HB1 )(resid   46 and  name HB1 ) 4.0 2.2 1.0
assign (resid   41 and  name HB1 )(resid   46 and  name HB2 ) 4.0 2.2 1.0
assign (resid   41 and  name HB2 )(resid   46 and  name HB1 ) 4.0 2.2 1.0
assign (resid   41 and  name HB2 )(resid   46 and  name HB2 ) 4.0 2.2 1.0
assign (resid   41 and  name HB1 )(resid   46 and  name HD# ) 4.0 4.2 3.0
assign (resid   41 and  name HB1 )(resid   46 and  name HE# ) 4.0 4.2 3.0
assign (resid   41 and  name HB2 )(resid   46 and  name HD# ) 4.0 4.2 3.0
assign (resid   41 and  name HB2 )(resid   46 and  name HE# ) 4.0 4.2 3.0
assign (resid   41 and  name HD# )(resid   46 and  name HD# ) 4.0 6.2 5.0
!!Gly42
assign (resid   42 and  name HA# )(resid   42 and  name HN  ) 3.0 2.2 1.5
assign (resid   42 and  name HA# )(resid   43 and  name HN  ) 4.0 3.2 2.0
assign (resid   42 and  name HN  )(resid   43 and  name HN  ) 4.0 2.2 1.0
!!Phe43 
assign (resid   43 and  name HN  )(resid   43 and  name HA  ) 3.0 1.2 0.5
assign (resid   43 and  name HN  )(resid   43 and  name HB1 ) 4.0 2.2 1.0
assign (resid   43 and  name HN  )(resid   43 and  name HB2 ) 4.0 2.2 1.0
assign (resid   43 and  name HA  )(resid   43 and  name HB1 ) 3.0 1.2 0.5
assign (resid   43 and  name HA  )(resid   43 and  name HB2 ) 4.0 2.2 1.0
assign (resid   43 and  name HA  )(resid   43 and  name HD# ) 3.0 3.2 2.5
assign (resid   43 and  name HB1 )(resid   43 and  name HD# ) 3.0 3.2 2.5
assign (resid   43 and  name HB2 )(resid   43 and  name HD# ) 3.0 3.2 2.5
assign (resid   43 and  name HA  )(resid   44 and  name HN  ) 3.0 1.2 0.5
assign (resid   43 and  name HN  )(resid   44 and  name HN  ) 3.0 1.2 0.5
assign (resid   43 and  name HB1 )(resid   44 and  name HN  ) 4.0 3.2 2.0
assign (resid   43 and  name HB2 )(resid   44 and  name HN  ) 4.0 3.2 2.0 
!!Gly44
assign (resid   44 and  name HN  )(resid   44 and  name HA1 ) 3.0 1.2 0.5
assign (resid   44 and  name HN  )(resid   44 and  name HA2 ) 3.0 1.2 0.5
assign (resid   44 and  name HA1 )(resid   45 and  name HN  ) 3.0 1.2 0.5
assign (resid   44 and  name HA2 )(resid   45 and  name HN  ) 2.5 0.7 0.2
assign (resid   44 and  name HN  )(resid   45 and  name HN  ) 4.0 2.2 1.0
!!Cys45
assign (resid   45 and  name HN  )(resid   45 and  name HA  ) 4.0 2.2 1.0
assign (resid   45 and  name HN  )(resid   45 and  name HB1 ) 3.0 1.2 0.5
assign (resid   45 and  name HN  )(resid   45 and  name HB2 ) 4.0 2.2 1.0
assign (resid   45 and  name HA  )(resid   45 and  name HB1 ) 4.0 2.2 1.0
assign (resid   45 and  name HA  )(resid   45 and  name HB2 ) 4.0 2.2 1.0
assign (resid   45 and  name HA  )(resid   46 and  name HN  ) 2.5 0.7 0.2
assign (resid   45 and  name HN  )(resid   46 and  name HN  ) 4.0 2.2 1.0
assign (resid   45 and  name HB1 )(resid   46 and  name HN  ) 4.0 2.2 1.0
assign (resid   45 and  name HB2 )(resid   46 and  name HN  ) 4.0 2.2 1.0
!!Tyr46
assign (resid   46 and  name HN  )(resid   46 and  name HA  ) 4.0 2.2 1.0
assign (resid   46 and  name HN  )(resid   46 and  name HB1 ) 2.5 0.7 0.2
assign (resid   46 and  name HN  )(resid   46 and  name HB2 ) 3.0 1.2 0.5
assign (resid   46 and  name HA  )(resid   46 and  name HB1 ) 4.0 2.2 1.0
assign (resid   46 and  name HA  )(resid   46 and  name HB2 ) 4.0 2.2 1.0
assign (resid   46 and  name HA  )(resid   46 and  name HD# ) 3.0 3.2 2.5
assign (resid   46 and  name HA  )(resid   46 and  name HE# ) 4.0 4.2 3.0
assign (resid   46 and  name HB1 )(resid   46 and  name HD# ) 2.5 2.7 2.2
assign (resid   46 and  name HB2 )(resid   46 and  name HD# ) 2.5 2.7 2.2
assign (resid   46 and  name HB1 )(resid   46 and  name HE# ) 4.0 4.2 3.0
assign (resid   46 and  name HB2 )(resid   46 and  name HE# ) 4.0 4.2 3.0
assign (resid   46 and  name HN  )(resid   47 and  name HN  ) 4.0 2.2 1.0
assign (resid   46 and  name HA  )(resid   47 and  name HN  ) 2.5 0.7 0.2
assign (resid   46 and  name HB1 )(resid   47 and  name HN  ) 4.0 2.2 1.0
assign (resid   46 and  name HB2 )(resid   47 and  name HN  ) 4.0 2.2 1.0
assign (resid   46 and  name HD# )(resid   47 and  name HN  ) 3.0 3.2 2.5
assign (resid   46 and  name HE# )(resid   47 and  name HN  ) 4.0 4.2 3.0
assign (resid   46 and  name HD# )(resid   48 and  name HG# ) 4.0 5.2 4.0
assign (resid   46 and  name HE# )(resid   48 and  name HG# ) 2.5 3.7 3.2
!!Cys47 
assign (resid   47 and  name HN  )(resid   47 and  name HA  ) 4.0 2.2 1.0
assign (resid   47 and  name HN  )(resid   47 and  name HB1 ) 4.0 2.2 1.0  
assign (resid   47 and  name HN  )(resid   47 and  name HB2 ) 3.0 1.2 0.5
assign (resid   47 and  name HA  )(resid   47 and  name HB1 ) 3.0 1.2 0.5 
assign (resid   47 and  name HA  )(resid   47 and  name HB2 ) 4.0 2.2 1.0
assign (resid   47 and  name HA  )(resid   48 and  name HN  ) 3.0 1.2 0.5
assign (resid   47 and  name HB1 )(resid   48 and  name HN  ) 4.0 2.2 1.0
assign (resid   47 and  name HN  )(resid   50 and  name HD1#) 4.0 3.3 2.1
assign (resid   47 and  name HN  )(resid   50 and  name HD2#) 4.0 3.3 2.1
assign (resid   47 and  name HA  )(resid   50 and  name HD1#) 4.0 3.3 2.1
assign (resid   47 and  name HA  )(resid   50 and  name HD2#) 4.0 3.3 2.1
assign (resid   47 and  name HB1 )(resid   50 and  name HD1#) 4.0 3.3 2.1
assign (resid   47 and  name HB1 )(resid   50 and  name HD2#) 4.0 3.3 2.1
assign (resid   47 and  name HB2 )(resid   50 and  name HD1#) 4.0 3.3 2.1
assign (resid   47 and  name HB2 )(resid   50 and  name HD2#) 4.0 3.3 2.1
!!E48 
assign (resid   48 and  name HN  )(resid   48 and  name HA  ) 4.0 2.2 1.0
assign (resid   48 and  name HN  )(resid   48 and  name HB# ) 4.0 3.2 2.0
assign (resid   48 and  name HN  )(resid   48 and  name HG# ) 4.0 3.2 2.0
assign (resid   48 and  name HA  )(resid   48 and  name HB1 ) 4.0 2.2 1.0
assign (resid   48 and  name HA  )(resid   48 and  name HB2 ) 4.0 2.2 1.0
assign (resid   48 and  name HA  )(resid   48 and  name HG# ) 3.0 2.2 1.5
assign (resid   48 and  name HA  )(resid   49 and  name HN  ) 2.5 0.7 0.2
assign (resid   48 and  name HB1 )(resid   49 and  name HN  ) 4.0 2.2 1.0
assign (resid   48 and  name HB2 )(resid   49 and  name HN  ) 4.0 2.2 1.0
assign (resid   48 and  name HG# )(resid   49 and  name HN  ) 4.0 3.2 2.0
!!Gly49 
assign (resid   49 and  name HN  )(resid   49 and  name HA1 ) 3.0 1.2 0.5
assign (resid   49 and  name HN  )(resid   49 and  name HA2 ) 3.0 1.2 0.5
assign (resid   49 and  name HN  )(resid   50 and  name HN  ) 3.0 1.2 0.5
assign (resid   49 and  name HA1 )(resid   50 and  name HN  ) 3.0 1.2 0.5
assign (resid   49 and  name HA2 )(resid   50 and  name HN  ) 3.0 1.2 0.5
!!Leu50 
assign (resid   50 and  name HN  )(resid   50 and  name HA  ) 4.0 2.2 1.0
assign (resid   50 and  name HN  )(resid   50 and  name HB1 ) 4.0 2.2 1.0
assign (resid   50 and  name HN  )(resid   50 and  name HB2 ) 3.0 1.2 0.5
assign (resid   50 and  name HN  )(resid   50 and  name HG  ) 3.0 1.2 0.5
assign (resid   50 and  name HN  )(resid   50 and  name HD1#) 3.0 2.1 1.4
assign (resid   50 and  name HN  )(resid   50 and  name HD2#) 3.0 2.1 1.4
assign (resid   50 and  name HA  )(resid   50 and  name HD1#) 4.0 3.3 2.1
assign (resid   50 and  name HA  )(resid   50 and  name HD2#) 4.0 3.3 2.1
assign (resid   50 and  name HA  )(resid   50 and  name HB1 ) 4.0 2.2 1.0
assign (resid   50 and  name HA  )(resid   50 and  name HB2 ) 4.0 2.2 1.0
assign (resid   50 and  name HA  )(resid   50 and  name HG  ) 4.0 2.2 1.0
assign (resid   50 and  name HN  )(resid   51 and  name HD# ) 4.0 3.2 2.0
assign (resid   50 and  name HA  )(resid   51 and  name HD# ) 3.0 2.2 1.5
assign (resid   50 and  name HD1#)(resid   54 and  name HB  ) 4.0 3.3 2.1
assign (resid   50 and  name HD2#)(resid   54 and  name HB  ) 4.0 3.3 2.1
!!Pro51
assign (resid   51 and  name HA  )(resid   51 and  name HB1 ) 3.0 1.2 0.5
assign (resid   51 and  name HA  )(resid   51 and  name HB2 ) 3.0 1.2 0.5
assign (resid   51 and  name HB# )(resid   51 and  name HG# ) 3.0 3.2 2.5
assign (resid   51 and  name HD# )(resid   51 and  name HG# ) 3.0 3.2 2.5
assign (resid   51 and  name HD# )(resid   51 and  name HB# ) 4.0 4.2 3.0
assign (resid   51 and  name HA  )(resid   52 and  name HN  ) 2.5 0.7 0.2
assign (resid   51 and  name HB1 )(resid   52 and  name HN  ) 3.0 1.2 0.5
assign (resid   51 and  name HB2 )(resid   52 and  name HN  ) 3.0 1.2 0.5
assign (resid   51 and  name HA  )(resid   53 and  name HN  ) 4.0 2.2 1.0
assign (resid   51 and  name HB1 )(resid   53 and  name HN  ) 4.0 3.2 2.0
!!D52 
assign (resid   52 and  name HN  )(resid   52 and  name HA  ) 3.0 1.2 0.5
assign (resid   52 and  name HN  )(resid   52 and  name HB1 ) 3.0 1.2 0.5
assign (resid   52 and  name HN  )(resid   52 and  name HB2 ) 3.0 1.2 0.5
assign (resid   52 and  name HA  )(resid   52 and  name HB1 ) 3.0 1.2 0.5
assign (resid   52 and  name HA  )(resid   52 and  name HB2 ) 3.0 1.2 0.5
assign (resid   52 and  name HA  )(resid   53 and  name HN  ) 4.0 2.2 1.0
assign (resid   52 and  name HB1 )(resid   53 and  name HN  ) 4.0 2.2 1.0
assign (resid   52 and  name HB2 )(resid   53 and  name HN  ) 4.0 2.2 1.0
assign (resid   52 and  name HN  )(resid   53 and  name HN  ) 3.0 1.2 0.5
assign (resid   52 and  name HA  )(resid   54 and  name HN  ) 4.0 2.2 1.0
!!Ser53 
assign (resid   53 and  name HN  )(resid   53 and  name HA  ) 3.0 1.2 0.5
assign (resid   53 and  name HN  )(resid   53 and  name HB1 ) 3.0 1.2 0.5
assign (resid   53 and  name HN  )(resid   53 and  name HB2 ) 3.0 1.2 0.5
assign (resid   53 and  name HA  )(resid   53 and  name HB1 ) 3.0 1.2 0.5
assign (resid   53 and  name HA  )(resid   53 and  name HB2 ) 3.0 1.2 0.5
assign (resid   53 and  name HN  )(resid   54 and  name HN  ) 3.0 1.2 0.5
assign (resid   53 and  name HA  )(resid   54 and  name HN  ) 4.0 2.2 1.0
assign (resid   53 and  name HB1 )(resid   54 and  name HN  ) 4.0 2.2 1.0
assign (resid   53 and  name HB2 )(resid   54 and  name HN  ) 4.0 2.2 1.0
!!Thr54 
assign (resid   54 and  name HN  )(resid   54 and  name HA  ) 3.0 1.2 0.5
assign (resid   54 and  name HN  )(resid   54 and  name HB  ) 3.0 1.2 0.5
assign (resid   54 and  name HN  )(resid   54 and  name HG2#) 3.0 2.1 1.4
assign (resid   54 and  name HA  )(resid   54 and  name HB  ) 4.0 2.2 1.0
assign (resid   54 and  name HA  )(resid   54 and  name HG2#) 3.0 2.1 1.4
assign (resid   54 and  name HN  )(resid   55 and  name HN  ) 4.0 2.2 1.0
assign (resid   54 and  name HA  )(resid   55 and  name HN  ) 3.0 1.2 0.5
assign (resid   54 and  name HB  )(resid   55 and  name HN  ) 4.0 2.2 1.0
assign (resid   54 and  name HG2#)(resid   55 and  name HN  ) 2.5 1.4 0.9
!!Q55 
assign (resid   55 and  name HN  )(resid   55 and  name HA  ) 4.0 2.2 1.0
assign (resid   55 and  name HN  )(resid   55 and  name HB# ) 3.0 2.2 1.5
assign (resid   55 and  name HN  )(resid   55 and  name HG1 ) 4.0 2.2 1.0
assign (resid   55 and  name HN  )(resid   55 and  name HG2 ) 4.0 2.2 1.0
assign (resid   55 and  name HA  )(resid   55 and  name HB# ) 3.0 1.8 0.9
assign (resid   55 and  name HA  )(resid   55 and  name HG1 ) 4.0 2.2 1.0
assign (resid   55 and  name HA  )(resid   55 and  name HG2 ) 4.0 2.2 1.0
assign (resid   55 and  name HN  )(resid   56 and  name HN  ) 4.0 2.2 1.0
assign (resid   55 and  name HA  )(resid   56 and  name HN  ) 3.0 1.2 0.5
assign (resid   55 and  name HB# )(resid   56 and  name HN  ) 4.0 3.2 2.0
assign (resid   55 and  name HG1 )(resid   56 and  name HN  ) 4.0 2.2 1.0
assign (resid   55 and  name HG2 )(resid   56 and  name HN  ) 4.0 2.2 1.0
assign (resid   55 and  name HE21)(resid   56 and  name HN  ) 4.0 2.2 1.0
assign (resid   55 and  name HE22)(resid   56 and  name HN  ) 4.0 2.2 1.0
assign (resid   55 and  name HE21)(resid   59 and  name HD# ) 4.0 4.8 3.6
assign (resid   55 and  name HE22)(resid   59 and  name HD# ) 4.0 4.8 3.6
!!Thr56 
assign (resid   56 and  name HN  )(resid   56 and  name HA  ) 3.0 1.2 0.5
assign (resid   56 and  name HN  )(resid   56 and  name HB  ) 3.0 1.2 0.5
assign (resid   56 and  name HN  )(resid   56 and  name HG2#) 3.0 2.1 1.4
assign (resid   56 and  name HG2#)(resid   56 and  name HA  ) 3.0 2.1 1.4
assign (resid   56 and  name HB  )(resid   56 and  name HA  ) 4.0 2.2 1.0
assign (resid   56 and  name HN  )(resid   57 and  name HN  ) 4.0 2.2 1.0
assign (resid   56 and  name HA  )(resid   57 and  name HN  ) 2.5 0.7 0.2
assign (resid   56 and  name HB  )(resid   57 and  name HN  ) 4.0 2.2 1.0
assign (resid   56 and  name HG2#)(resid   57 and  name HN  ) 3.0 2.1 1.4
!!Trp57 
assign (resid   57 and  name HN  )(resid   57 and  name HA  ) 4.0 2.2 1.0
assign (resid   57 and  name HN  )(resid   57 and  name HB1 ) 2.5 0.7 0.2
assign (resid   57 and  name HN  )(resid   57 and  name HB2 ) 3.0 1.2 0.5
assign (resid   57 and  name HA  )(resid   57 and  name HB1 ) 4.0 2.2 1.0
assign (resid   57 and  name HA  )(resid   57 and  name HB2 ) 4.0 2.2 1.0
assign (resid   57 and  name HA  )(resid   57 and  name HE3 ) 4.0 2.2 1.0
assign (resid   57 and  name HA  )(resid   57 and  name HD1 ) 3.0 1.2 0.5
assign (resid   57 and  name HB1 )(resid   57 and  name HD1 ) 4.0 2.2 1.0
assign (resid   57 and  name HB2 )(resid   57 and  name HD1 ) 3.0 1.2 0.5
assign (resid   57 and  name HB1 )(resid   57 and  name HE3 ) 2.5 0.7 0.2
assign (resid   57 and  name HB2 )(resid   57 and  name HE3 ) 4.0 2.2 1.0
assign (resid   57 and  name HN  )(resid   58 and  name HA  ) 4.0 2.2 1.0
assign (resid   57 and  name HA  )(resid   58 and  name HA  ) 2.5 0.7 0.2
assign (resid   57 and  name HB1 )(resid   58 and  name HA  ) 4.0 2.2 1.0
assign (resid   57 and  name HB2 )(resid   58 and  name HA  ) 4.0 2.2 1.0
assign (resid   57 and  name HD1 )(resid   58 and  name HA  ) 3.0 1.2 0.5
assign (resid   57 and  name HE1 )(resid   58 and  name HA  ) 4.0 2.2 1.0
assign (resid   57 and  name HA  )(resid   59 and  name HN  ) 3.0 1.2 0.5
assign (resid   57 and  name HE1 )(resid   64 and  name HB1 ) 4.0 2.2 1.0
assign (resid   57 and  name HE1 )(resid   64 and  name HB2 ) 4.0 2.2 1.0
assign (resid   57 and  name HE1 )(resid   64 and  name HN  ) 4.0 2.2 1.0
!!Pro58
assign (resid   58 and  name HA  )(resid   58 and  name HB1 ) 3.0 1.2 0.5
assign (resid   58 and  name HA  )(resid   58 and  name HB2 ) 3.0 1.2 0.5
assign (resid   58 and  name HB# )(resid   58 and  name HG# ) 3.0 3.2 2.5
assign (resid   58 and  name HD# )(resid   58 and  name HG# ) 3.0 3.2 2.5
assign (resid   58 and  name HD# )(resid   58 and  name HB# ) 4.0 4.2 3.0
assign (resid   58 and  name HA  )(resid   59 and  name HN  ) 2.5 0.7 0.2
assign (resid   58 and  name HB1 )(resid   59 and  name HN  ) 4.0 2.2 1.0
assign (resid   58 and  name HB2 )(resid   59 and  name HN  ) 4.0 2.2 1.0
!!Leu59
assign (resid   59 and  name HN  )(resid   59 and  name HA  ) 4.0 2.2 1.0
assign (resid   59 and  name HN  )(resid   59 and  name HB1 ) 3.0 1.2 0.5
assign (resid   59 and  name HN  )(resid   59 and  name HB2 ) 3.0 1.2 0.5
assign (resid   59 and  name HN  )(resid   59 and  name HG  ) 4.0 2.2 1.0
assign (resid   59 and  name HN  )(resid   59 and  name HD# ) 3.0 3.6 2.9
assign (resid   59 and  name HA  )(resid   59 and  name HB1 ) 4.0 2.2 1.0
assign (resid   59 and  name HA  )(resid   59 and  name HB2 ) 4.0 2.2 1.0
assign (resid   59 and  name HA  )(resid   59 and  name HG  ) 4.0 2.2 1.0
assign (resid   59 and  name HA  )(resid   59 and  name HD1#) 4.0 3.3 2.1
assign (resid   59 and  name HA  )(resid   59 and  name HD2#) 4.0 3.3 2.1
assign (resid   59 and  name HA  )(resid   60 and  name HD1 ) 2.5 0.7 0.2
assign (resid   59 and  name HA  )(resid   60 and  name HD2 ) 2.5 0.7 0.2
assign (resid   59 and  name HA  )(resid   60 and  name HG# ) 4.0 3.2 2.0
assign (resid   59 and  name HD# )(resid   60 and  name HD1 ) 4.0 4.8 3.6
assign (resid   59 and  name HD# )(resid   60 and  name HD2 ) 4.0 4.8 3.6
!!Pro60
assign (resid   60 and  name HA  )(resid   60 and  name HB1 ) 3.0 1.2 0.5
assign (resid   60 and  name HA  )(resid   60 and  name HB2 ) 3.0 1.2 0.5
assign (resid   60 and  name HB# )(resid   60 and  name HG# ) 3.0 3.2 2.5
assign (resid   60 and  name HD# )(resid   60 and  name HG# ) 3.0 3.2 2.5
assign (resid   60 and  name HD# )(resid   60 and  name HB# ) 4.0 4.2 3.0
assign (resid   60 and  name HA  )(resid   61 and  name HN  ) 2.5 0.7 0.2
assign (resid   60 and  name HB1 )(resid   61 and  name HN  ) 3.0 1.2 0.5
assign (resid   60 and  name HB2 )(resid   61 and  name HN  ) 3.0 1.2 0.5
assign (resid   60 and  name HG# )(resid   61 and  name HN  ) 4.0 3.2 2.0
!!Asn61 
assign (resid   61 and  name HN  )(resid   61 and  name HA  ) 3.0 1.2 0.5
assign (resid   61 and  name HN  )(resid   61 and  name HB# ) 3.0 2.2 1.5
assign (resid   61 and  name HN  )(resid   62 and  name HN  ) 2.5 0.7 0.2
assign (resid   61 and  name HB# )(resid   62 and  name HN  ) 4.0 3.2 2.0 
!!Lys62 
assign (resid   62 and  name HN  )(resid   62 and  name HA  ) 4.0 2.2 1.0
assign (resid   62 and  name HN  )(resid   62 and  name HB# ) 3.0 2.2 1.5
assign (resid   62 and  name HN  )(resid   62 and  name HG# ) 4.0 3.2 2.0 
assign (resid   62 and  name HA  )(resid   62 and  name HB# ) 3.0 2.2 1.5
assign (resid   62 and  name HA  )(resid   62 and  name HG# ) 4.0 3.2 2.0
assign (resid   62 and  name HA  )(resid   63 and  name HN  ) 2.5 0.7 0.2
assign (resid   62 and  name HB# )(resid   63 and  name HN  ) 4.0 3.0 2.0
assign (resid   62 and  name HG# )(resid   63 and  name HN  ) 4.0 3.0 2.0
assign (resid   62 and  name HN  )(resid   63 and  name HN  ) 4.0 2.2 1.0
!!Thr63
assign (resid   63 and  name HN  )(resid   63 and  name HA  ) 3.0 1.2 0.5
assign (resid   63 and  name HN  )(resid   63 and  name HB  ) 2.5 0.7 0.2
assign (resid   63 and  name HN  )(resid   63 and  name HG2#) 3.0 2.1 1.4
assign (resid   63 and  name HA  )(resid   63 and  name HB  ) 3.0 1.2 0.5
assign (resid   63 and  name HA  )(resid   63 and  name HG2#) 3.0 2.1 1.4
assign (resid   63 and  name HA  )(resid   64 and  name HN  ) 2.5 0.7 0.2
assign (resid   63 and  name HB  )(resid   64 and  name HN  ) 3.0 1.2 0.5
assign (resid   63 and  name HG2#)(resid   64 and  name HN  ) 3.0 2.1 1.4
assign (resid   63 and  name HN  )(resid   64 and  name HN  ) 4.0 2.2 1.0
!!Cys64
assign (resid   64 and  name HN  )(resid   64 and  name HA  ) 3.0 1.2 0.5
assign (resid   64 and  name HN  )(resid   64 and  name HB1 ) 2.5 0.7 0.2
assign (resid   64 and  name HN  )(resid   64 and  name HB2 ) 2.5 0.7 0.2
assign (resid   64 and  name HA  )(resid   64 and  name HB1 ) 4.0 2.2 1.0
assign (resid   64 and  name HA  )(resid   64 and  name HB2 ) 3.0 1.2 0.5
!! H bonds
assign (resid    3 and  name HN  )(resid   47 and  name  O  ) 2.1 0.6 0.2
assign (resid    3 and  name  N  )(resid   47 and  name  O  ) 3.1 0.6 0.2
assign (resid   47 and  name HN  )(resid    3 and  name  O  ) 2.1 0.6 0.2
assign (resid   47 and  name  N  )(resid    3 and  name  O  ) 3.1 0.6 0.2 
assign (resid   39 and  name  O  )(resid   46 and  name HN  ) 2.1 0.6 0.2
assign (resid   39 and  name  O  )(resid   46 and  name  N  ) 3.1 0.6 0.2
assign (resid   46 and  name  O  )(resid   39 and  name HN  ) 2.1 0.6 0.2
assign (resid   46 and  name  O  )(resid   39 and  name  N  ) 3.1 0.6 0.2
assign (resid   48 and  name HN  )(resid   37 and  name  O  ) 2.1 0.6 0.2
assign (resid   48 and  name  N  )(resid   37 and  name  O  ) 3.1 0.6 0.2
assign (resid   22 and  name  O  )(resid   26 and  name HN  ) 2.1 0.6 0.2
assign (resid   22 and  name  O  )(resid   26 and  name N   ) 3.1 0.6 0.2
assign (resid   23 and  name  O  )(resid   27 and  name HN  ) 2.1 0.6 0.2
assign (resid   23 and  name  O  )(resid   27 and  name N   ) 3.1 0.6 0.2
assign (resid   24 and  name  O  )(resid   28 and  name HN  ) 2.1 0.6 0.2
assign (resid   24 and  name  O  )(resid   28 and  name N   ) 3.1 0.6 0.2
assign (resid   25 and  name  O  )(resid   29 and  name HN  ) 2.1 0.6 0.2
assign (resid   25 and  name  O  )(resid   29 and  name N   ) 3.1 0.6 0.2
assign (resid   7  and  name  O  )(resid  10  and  name HN  ) 2.1 0.6 0.2
assign (resid   7  and  name  O  )(resid  10  and  name N   ) 3.1 0.6 0.2
assign (resid   41 and  name HN  )(resid   44 and  name O   ) 2.1 0.6 0.2
assign (resid   41 and  name  N  )(resid   44 and  name O   ) 3.1 0.6 0.2
assign (resid   51 and  name  O  )(resid   54 and  name N   ) 3.1 0.6 0.2
assign (resid   51 and  name  O  )(resid   54 and  name HN  ) 2.1 0.6 0.2
assign (resid  57 and  name N  )(resid   4 and  name O    ) 3.1 0.6 0.2
assign (resid  57 and  name HN )(resid   4 and  name O    ) 2.1 0.6 0.2
assign (resid   17 and  name  O  )(resid   21 and  name HD21) 2.1 0.6 0.2
assign (resid   17 and  name  O  )(resid   21 and  name ND2 ) 3.1 0.6 0.2




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    LYS   1          1H        LYS   1   3.210   4.698  11.821
    2   2H    LYS   1          2H        LYS   1   4.859   5.107  11.818
    3   3H    LYS   1          3H        LYS   1   3.689   6.311  12.056
    4    HA   LYS   1           HA       LYS   1   3.053   6.351   9.843
    5   1HB   LYS   1          1HB       LYS   1   5.840   6.269  10.588
    6   2HB   LYS   1          2HB       LYS   1   5.660   5.672   8.938
    7   1HG   LYS   1          1HG       LYS   1   4.943   7.696   8.137
    8   2HG   LYS   1          2HG       LYS   1   4.098   8.105   9.629
    9   1HD   LYS   1          1HD       LYS   1   5.834   9.519   9.996
   10   2HD   LYS   1          2HD       LYS   1   6.726   8.066  10.451
   11   1HE   LYS   1          1HE       LYS   1   7.167   7.879   7.847
   12   2HE   LYS   1          2HE       LYS   1   6.832   9.622   7.882
   13   1HZ   LYS   1          1HZ       LYS   1   8.352   9.436  10.022
   14   2HZ   LYS   1          2HZ       LYS   1   8.996   8.123   9.156
   15   3HZ   LYS   1          3HZ       LYS   1   9.014   9.676   8.475
   16    H    ASP   2           H        ASP   2   1.707   4.282   9.830
   17    HA   ASP   2           HA       ASP   2   2.931   2.325   7.934
   18   1HB   ASP   2          1HB       ASP   2   1.234   1.389  10.239
   19   2HB   ASP   2          2HB       ASP   2   2.447   0.496   9.324
   20    H    GLY   3           H        GLY   3   1.542   2.269   6.198
   21   1HA   GLY   3          1HA       GLY   3  -1.374   2.145   6.740
   22   2HA   GLY   3          2HA       GLY   3  -0.797   3.419   5.666
   23    H    TYR   4           H        TYR   4  -2.470   1.927   4.378
   24    HA   TYR   4           HA       TYR   4  -0.982  -0.292   3.032
   25   1HB   TYR   4          1HB       TYR   4  -3.853   0.435   3.533
   26   2HB   TYR   4          2HB       TYR   4  -3.467  -0.606   2.163
   27    HD1  TYR   4           HD1      TYR   4  -3.352  -0.272   5.842
   28    HD2  TYR   4           HD2      TYR   4  -2.624  -2.857   2.489
   29    HE1  TYR   4           HE1      TYR   4  -3.118  -2.204   7.381
   30    HE2  TYR   4           HE2      TYR   4  -2.389  -4.786   4.028
   31    HH   TYR   4           HH       TYR   4  -3.481  -4.978   6.921
   32    H    LEU   5           H        LEU   5  -1.899  -0.419   0.579
   33    HA   LEU   5           HA       LEU   5  -1.266   2.236  -0.627
   34   1HB   LEU   5          1HB       LEU   5  -0.840  -0.611  -1.229
   35   2HB   LEU   5          2HB       LEU   5  -1.333   0.338  -2.633
   36    HG   LEU   5           HG       LEU   5   0.726   1.575  -0.889
   37   1HD1  LEU   5          1HD1      LEU   5   1.461  -0.785  -0.942
   38   2HD1  LEU   5          2HD1      LEU   5   1.340  -0.781  -2.702
   39   3HD1  LEU   5          3HD1      LEU   5   2.536   0.235  -1.897
   40   1HD2  LEU   5          1HD2      LEU   5  -0.196   1.583  -3.684
   41   2HD2  LEU   5          2HD2      LEU   5   0.577   2.866  -2.753
   42   3HD2  LEU   5          3HD2      LEU   5   1.560   1.618  -3.519
   43    H    VAL   6           H        VAL   6  -2.691   3.193  -2.134
   44    HA   VAL   6           HA       VAL   6  -5.474   2.096  -2.133
   45    HB   VAL   6           HB       VAL   6  -6.132   4.377  -2.494
   46   1HG1  VAL   6          1HG1      VAL   6  -5.302   3.839  -0.207
   47   2HG1  VAL   6          2HG1      VAL   6  -3.703   4.413  -0.678
   48   3HG1  VAL   6          3HG1      VAL   6  -5.063   5.534  -0.625
   49   1HG2  VAL   6          1HG2      VAL   6  -3.536   4.513  -3.770
   50   2HG2  VAL   6          2HG2      VAL   6  -4.898   5.624  -3.911
   51   3HG2  VAL   6          3HG2      VAL   6  -3.717   5.836  -2.618
   52    H    GLU   7           H        GLU   7  -6.485   3.340  -4.350
   53    HA   GLU   7           HA       GLU   7  -4.766   2.676  -6.680
   54   1HB   GLU   7          1HB       GLU   7  -7.157   1.175  -5.688
   55   2HB   GLU   7          2HB       GLU   7  -6.956   1.333  -7.433
   56   1HG   GLU   7          1HG       GLU   7  -4.413   0.670  -6.643
   57   2HG   GLU   7          2HG       GLU   7  -5.394  -0.252  -5.502
   58    H    LYS   8           H        LYS   8  -6.148   3.154  -8.770
   59    HA   LYS   8           HA       LYS   8  -6.854   5.815  -8.990
   60   1HB   LYS   8          1HB       LYS   8  -6.683   4.358 -10.905
   61   2HB   LYS   8          2HB       LYS   8  -8.002   3.344 -10.320
   62   1HG   LYS   8          1HG       LYS   8  -9.439   5.500 -10.445
   63   2HG   LYS   8          2HG       LYS   8  -8.143   6.134 -11.459
   64   1HD   LYS   8          1HD       LYS   8  -9.574   3.515 -11.986
   65   2HD   LYS   8          2HD       LYS   8 -10.002   5.043 -12.757
   66   1HE   LYS   8          1HE       LYS   8  -7.207   4.809 -13.081
   67   2HE   LYS   8          2HE       LYS   8  -7.875   3.208 -13.459
   68   1HZ   LYS   8          1HZ       LYS   8  -9.621   4.412 -14.766
   69   2HZ   LYS   8          2HZ       LYS   8  -8.702   5.825 -14.589
   70   3HZ   LYS   8          3HZ       LYS   8  -8.058   4.495 -15.426
   71    H    THR   9           H        THR   9  -9.250   3.191  -8.471
   72    HA   THR   9           HA       THR   9 -11.383   5.063  -7.831
   73    HB   THR   9           HB       THR   9 -12.371   2.735  -7.050
   74    HG1  THR   9           HG1      THR   9 -11.227   1.021  -7.897
   75   1HG2  THR   9          1HG2      THR   9 -11.620   3.589  -9.840
   76   2HG2  THR   9          2HG2      THR   9 -12.548   2.116  -9.557
   77   3HG2  THR   9          3HG2      THR   9 -13.194   3.677  -9.048
   78    H    GLY  10           H        GLY  10  -8.775   3.714  -6.059
   79   1HA   GLY  10          1HA       GLY  10  -8.259   4.547  -3.828
   80   2HA   GLY  10          2HA       GLY  10  -9.989   4.739  -3.540
   81    H    CYS  11           H        CYS  11  -9.649   1.842  -5.101
   82    HA   CYS  11           HA       CYS  11 -10.218   0.306  -2.700
   83   1HB   CYS  11          1HB       CYS  11  -9.850  -0.184  -5.639
   84   2HB   CYS  11          2HB       CYS  11  -9.892  -1.566  -4.543
   85    H    LYS  12           H        LYS  12  -8.769  -0.777  -1.418
   86    HA   LYS  12           HA       LYS  12  -5.988  -0.388  -1.480
   87   1HB   LYS  12          1HB       LYS  12  -6.017  -2.511  -0.052
   88   2HB   LYS  12          2HB       LYS  12  -7.096  -1.221   0.473
   89   1HG   LYS  12          1HG       LYS  12  -8.631  -2.677  -1.346
   90   2HG   LYS  12          2HG       LYS  12  -7.745  -3.912  -0.452
   91   1HD   LYS  12          1HD       LYS  12  -8.487  -2.893   1.679
   92   2HD   LYS  12          2HD       LYS  12  -9.394  -1.680   0.774
   93   1HE   LYS  12          1HE       LYS  12 -10.791  -3.446  -0.232
   94   2HE   LYS  12          2HE       LYS  12  -9.867  -4.683   0.645
   95   1HZ   LYS  12          1HZ       LYS  12 -10.395  -3.165   2.670
   96   2HZ   LYS  12          2HZ       LYS  12 -11.684  -2.624   1.705
   97   3HZ   LYS  12          3HZ       LYS  12 -11.563  -4.267   2.122
   98    H    LYS  13           H        LYS  13  -4.577  -2.663  -1.533
   99    HA   LYS  13           HA       LYS  13  -5.106  -3.911  -4.212
  100   1HB   LYS  13          1HB       LYS  13  -3.382  -2.186  -4.382
  101   2HB   LYS  13          2HB       LYS  13  -2.512  -2.885  -3.016
  102   1HG   LYS  13          1HG       LYS  13  -1.431  -3.649  -5.038
  103   2HG   LYS  13          2HG       LYS  13  -2.300  -5.019  -4.345
  104   1HD   LYS  13          1HD       LYS  13  -3.980  -4.945  -5.972
  105   2HD   LYS  13          2HD       LYS  13  -3.658  -3.256  -6.368
  106   1HE   LYS  13          1HE       LYS  13  -1.822  -5.597  -6.995
  107   2HE   LYS  13          2HE       LYS  13  -2.805  -4.700  -8.170
  108   1HZ   LYS  13          1HZ       LYS  13  -1.646  -2.670  -7.016
  109   2HZ   LYS  13          2HZ       LYS  13  -0.446  -3.820  -6.664
  110   3HZ   LYS  13          3HZ       LYS  13  -0.877  -3.503  -8.277
  111    H    THR  14           H        THR  14  -5.883  -5.859  -3.221
  112    HA   THR  14           HA       THR  14  -4.536  -7.226  -1.076
  113    HB   THR  14           HB       THR  14  -6.192  -8.553  -3.215
  114    HG1  THR  14           HG1      THR  14  -8.008  -7.629  -2.307
  115   1HG2  THR  14          1HG2      THR  14  -5.201  -9.576  -0.982
  116   2HG2  THR  14          2HG2      THR  14  -6.596  -8.776  -0.259
  117   3HG2  THR  14          3HG2      THR  14  -6.830  -9.991  -1.515
  118    H    CYS  15           H        CYS  15  -2.937  -8.831  -1.161
  119    HA   CYS  15           HA       CYS  15  -1.807  -9.461  -3.870
  120   1HB   CYS  15          1HB       CYS  15   0.384  -9.165  -2.923
  121   2HB   CYS  15          2HB       CYS  15  -0.572  -7.775  -2.408
  122    H    TYR  16           H        TYR  16  -0.610 -11.538  -3.919
  123    HA   TYR  16           HA       TYR  16  -1.780 -13.528  -2.013
  124   1HB   TYR  16          1HB       TYR  16  -0.642 -13.717  -4.821
  125   2HB   TYR  16          2HB       TYR  16  -1.206 -15.108  -3.893
  126    HD1  TYR  16           HD1      TYR  16  -3.571 -14.053  -2.515
  127    HD2  TYR  16           HD2      TYR  16  -2.219 -13.407  -6.541
  128    HE1  TYR  16           HE1      TYR  16  -5.901 -13.581  -3.222
  129    HE2  TYR  16           HE2      TYR  16  -4.548 -12.934  -7.248
  130    HH   TYR  16           HH       TYR  16  -7.263 -13.369  -5.034
  131    H    LYS  17           H        LYS  17   0.728 -11.770  -1.719
  132    HA   LYS  17           HA       LYS  17   2.591 -14.015  -1.050
  133   1HB   LYS  17          1HB       LYS  17   3.100 -11.497  -2.653
  134   2HB   LYS  17          2HB       LYS  17   4.410 -12.432  -1.931
  135   1HG   LYS  17          1HG       LYS  17   2.864 -14.366  -3.189
  136   2HG   LYS  17          2HG       LYS  17   2.818 -13.009  -4.315
  137   1HD   LYS  17          1HD       LYS  17   4.762 -14.226  -4.925
  138   2HD   LYS  17          2HD       LYS  17   5.364 -12.862  -3.980
  139   1HE   LYS  17          1HE       LYS  17   6.457 -14.459  -2.763
  140   2HE   LYS  17          2HE       LYS  17   4.871 -14.765  -2.027
  141   1HZ   LYS  17          1HZ       LYS  17   5.632 -15.974  -4.616
  142   2HZ   LYS  17          2HZ       LYS  17   6.033 -16.725  -3.149
  143   3HZ   LYS  17          3HZ       LYS  17   4.403 -16.451  -3.545
  144    H    LEU  18           H        LEU  18   2.369 -13.775   1.202
  145    HA   LEU  18           HA       LEU  18   2.292 -11.173   2.514
  146   1HB   LEU  18          1HB       LEU  18   2.670 -14.040   3.426
  147   2HB   LEU  18          2HB       LEU  18   2.532 -12.683   4.545
  148    HG   LEU  18           HG       LEU  18   0.455 -13.212   2.416
  149   1HD1  LEU  18          1HD1      LEU  18   0.708 -15.209   3.905
  150   2HD1  LEU  18          2HD1      LEU  18   0.417 -14.164   5.295
  151   3HD1  LEU  18          3HD1      LEU  18  -0.851 -14.405   4.093
  152   1HD2  LEU  18          1HD2      LEU  18   0.737 -11.486   4.856
  153   2HD2  LEU  18          2HD2      LEU  18   0.117 -11.066   3.260
  154   3HD2  LEU  18          3HD2      LEU  18  -0.870 -12.022   4.365
  155    H    GLY  19           H        GLY  19   3.985 -10.580   4.177
  156   1HA   GLY  19          1HA       GLY  19   6.223 -10.321   4.889
  157   2HA   GLY  19          2HA       GLY  19   6.637 -11.747   3.944
  158    H    GLU  20           H        GLU  20   8.550 -10.424   3.392
  159    HA   GLU  20           HA       GLU  20   8.639  -8.005   2.010
  160   1HB   GLU  20          1HB       GLU  20  10.203 -10.573   1.601
  161   2HB   GLU  20          2HB       GLU  20  10.704  -9.002   0.974
  162   1HG   GLU  20          1HG       GLU  20  10.064  -9.312   3.895
  163   2HG   GLU  20          2HG       GLU  20  11.642  -9.806   3.284
  164    H    ASN  21           H        ASN  21   6.680  -7.919   0.667
  165    HA   ASN  21           HA       ASN  21   6.585  -9.755  -1.667
  166   1HB   ASN  21          1HB       ASN  21   4.588  -9.164  -0.245
  167   2HB   ASN  21          2HB       ASN  21   4.735  -7.504  -0.822
  168   1HD2  ASN  21          2HD2      ASN  21   2.441  -9.248  -1.356
  169   2HD2  ASN  21          1HD2      ASN  21   2.371  -9.477  -3.037
  170    H    ASP  22           H        ASP  22   8.432  -8.921  -2.848
  171    HA   ASP  22           HA       ASP  22   9.191  -6.335  -3.442
  172   1HB   ASP  22          1HB       ASP  22   8.875  -8.642  -5.396
  173   2HB   ASP  22          2HB       ASP  22   9.996  -7.291  -5.562
  174    H    PHE  23           H        PHE  23   6.636  -8.166  -5.184
  175    HA   PHE  23           HA       PHE  23   5.802  -6.288  -7.053
  176   1HB   PHE  23          1HB       PHE  23   4.854  -8.646  -5.895
  177   2HB   PHE  23          2HB       PHE  23   3.570  -7.479  -5.578
  178    HD1  PHE  23           HD1      PHE  23   5.666  -8.982  -8.262
  179    HD2  PHE  23           HD2      PHE  23   2.174  -6.660  -7.330
  180    HE1  PHE  23           HE1      PHE  23   4.922  -9.152 -10.621
  181    HE2  PHE  23           HE2      PHE  23   1.431  -6.832  -9.690
  182    HZ   PHE  23           HZ       PHE  23   2.805  -8.078 -11.335
  183    H    CYS  24           H        CYS  24   5.206  -6.314  -3.563
  184    HA   CYS  24           HA       CYS  24   3.469  -3.952  -3.621
  185   1HB   CYS  24          1HB       CYS  24   3.577  -5.950  -1.949
  186   2HB   CYS  24          2HB       CYS  24   4.945  -5.089  -1.242
  187    H    ASN  25           H        ASN  25   6.877  -4.699  -3.086
  188    HA   ASN  25           HA       ASN  25   7.688  -2.145  -2.042
  189   1HB   ASN  25          1HB       ASN  25   8.882  -4.439  -2.112
  190   2HB   ASN  25          2HB       ASN  25   9.336  -4.010  -3.761
  191   1HD2  ASN  25          2HD2      ASN  25  10.911  -4.198  -1.072
  192   2HD2  ASN  25          1HD2      ASN  25  11.777  -2.741  -1.031
  193    H    ARG  26           H        ARG  26   7.651  -3.502  -5.352
  194    HA   ARG  26           HA       ARG  26   8.645  -1.107  -6.629
  195   1HB   ARG  26          1HB       ARG  26   7.573  -3.760  -7.320
  196   2HB   ARG  26          2HB       ARG  26   7.195  -2.518  -8.515
  197   1HG   ARG  26          1HG       ARG  26   9.660  -1.857  -8.410
  198   2HG   ARG  26          2HG       ARG  26   9.923  -3.351  -7.510
  199   1HD   ARG  26          1HD       ARG  26   8.642  -4.480  -9.502
  200   2HD   ARG  26          2HD       ARG  26   9.083  -3.004 -10.380
  201    HE   ARG  26           HE       ARG  26  11.421  -3.780  -9.066
  202   1HH1  ARG  26          1HH1      ARG  26   9.180  -5.171 -11.295
  203   2HH1  ARG  26          2HH1      ARG  26  10.361  -6.191 -12.045
  204   1HH2  ARG  26          1HH2      ARG  26  12.972  -5.094 -10.042
  205   2HH2  ARG  26          2HH2      ARG  26  12.508  -6.145 -11.338
  206    H    GLU  27           H        GLU  27   5.421  -2.320  -5.797
  207    HA   GLU  27           HA       GLU  27   3.972  -0.272  -7.282
  208   1HB   GLU  27          1HB       GLU  27   3.159  -2.572  -6.587
  209   2HB   GLU  27          2HB       GLU  27   3.089  -1.972  -4.929
  210   1HG   GLU  27          1HG       GLU  27   1.688  -0.017  -6.041
  211   2HG   GLU  27          2HG       GLU  27   1.391  -1.233  -7.285
  212    H    CYS  28           H        CYS  28   5.146  -0.674  -3.961
  213    HA   CYS  28           HA       CYS  28   3.834   1.744  -2.967
  214   1HB   CYS  28          1HB       CYS  28   4.441  -0.313  -1.635
  215   2HB   CYS  28          2HB       CYS  28   6.138   0.122  -1.834
  216    H    LYS  29           H        LYS  29   7.045   0.846  -4.181
  217    HA   LYS  29           HA       LYS  29   8.236   3.446  -3.561
  218   1HB   LYS  29          1HB       LYS  29   9.382   1.171  -3.719
  219   2HB   LYS  29          2HB       LYS  29   9.192   1.293  -5.469
  220   1HG   LYS  29          1HG       LYS  29  11.082   2.511  -5.537
  221   2HG   LYS  29          2HG       LYS  29  10.246   3.774  -4.633
  222   1HD   LYS  29          1HD       LYS  29  11.717   3.401  -2.964
  223   2HD   LYS  29          2HD       LYS  29  10.896   1.862  -2.701
  224   1HE   LYS  29          1HE       LYS  29  12.801   0.799  -3.307
  225   2HE   LYS  29          2HE       LYS  29  12.640   1.504  -4.928
  226   1HZ   LYS  29          1HZ       LYS  29  13.646   3.125  -2.678
  227   2HZ   LYS  29          2HZ       LYS  29  14.703   2.109  -3.535
  228   3HZ   LYS  29          3HZ       LYS  29  13.878   3.356  -4.342
  229    H    TRP  30           H        TRP  30   5.929   3.998  -4.967
  230    HA   TRP  30           HA       TRP  30   6.838   4.570  -7.766
  231   1HB   TRP  30          1HB       TRP  30   4.369   3.676  -6.468
  232   2HB   TRP  30          2HB       TRP  30   4.100   5.029  -7.566
  233    HD1  TRP  30           HD1      TRP  30   3.786   1.565  -7.757
  234    HE1  TRP  30           HE1      TRP  30   4.392   0.591 -10.066
  235    HE3  TRP  30           HE3      TRP  30   6.413   5.486  -9.714
  236    HZ2  TRP  30           HZ2      TRP  30   5.802   1.368 -12.429
  237    HZ3  TRP  30           HZ3      TRP  30   7.375   5.340 -11.995
  238    HH2  TRP  30           HH2      TRP  30   7.073   3.288 -13.352
  239    H    LYS  31           H        LYS  31   4.204   6.129  -5.998
  240    HA   LYS  31           HA       LYS  31   5.170   8.785  -6.718
  241   1HB   LYS  31          1HB       LYS  31   2.926   7.704  -4.987
  242   2HB   LYS  31          2HB       LYS  31   3.145   9.423  -5.321
  243   1HG   LYS  31          1HG       LYS  31   3.307   8.397  -7.840
  244   2HG   LYS  31          2HG       LYS  31   2.174   7.267  -7.098
  245   1HD   LYS  31          1HD       LYS  31   0.682   9.042  -6.475
  246   2HD   LYS  31          2HD       LYS  31   1.869  10.274  -6.912
  247   1HE   LYS  31          1HE       LYS  31   1.235  10.218  -9.091
  248   2HE   LYS  31          2HE       LYS  31   1.322   8.446  -9.132
  249   1HZ   LYS  31          1HZ       LYS  31  -0.821   9.689  -7.573
  250   2HZ   LYS  31          2HZ       LYS  31  -0.979   9.687  -9.266
  251   3HZ   LYS  31          3HZ       LYS  31  -0.818   8.220  -8.428
  252    H    HIS  32           H        HIS  32   6.534  10.044  -5.499
  253    HA   HIS  32           HA       HIS  32   7.698  10.873  -3.606
  254   1HB   HIS  32          1HB       HIS  32   5.181   9.952  -2.732
  255   2HB   HIS  32          2HB       HIS  32   6.346   9.265  -1.598
  256    HD1  HIS  32           HD1      HIS  32   8.102  11.072  -0.556
  257    HD2  HIS  32           HD2      HIS  32   4.649  12.640  -2.284
  258    HE1  HIS  32           HE1      HIS  32   7.894  13.451   0.290
  259    H    ILE  33           H        ILE  33   9.220  10.000  -1.874
  260    HA   ILE  33           HA       ILE  33   9.884   7.111  -2.302
  261    HB   ILE  33           HB       ILE  33  11.470   9.600  -2.792
  262   1HG1  ILE  33          1HG1      ILE  33  12.405   7.652  -4.449
  263   2HG1  ILE  33          2HG1      ILE  33  10.773   7.057  -4.148
  264   1HG2  ILE  33          1HG2      ILE  33  12.750   8.431  -1.020
  265   2HG2  ILE  33          2HG2      ILE  33  12.715   6.952  -1.980
  266   3HG2  ILE  33          3HG2      ILE  33  13.590   8.365  -2.569
  267   1HD1  ILE  33          1HD1      ILE  33   9.975   9.437  -4.685
  268   2HD1  ILE  33          2HD1      ILE  33  11.598   9.720  -5.315
  269   3HD1  ILE  33          3HD1      ILE  33  10.572   8.483  -6.043
  270    H    GLY  34           H        GLY  34   9.193   9.519  -0.090
  271   1HA   GLY  34          1HA       GLY  34  11.081   9.196   1.978
  272   2HA   GLY  34          2HA       GLY  34   9.383   9.584   2.253
  273    H    GLY  35           H        GLY  35   8.635   6.998   0.834
  274   1HA   GLY  35          1HA       GLY  35   8.228   5.365   3.096
  275   2HA   GLY  35          2HA       GLY  35   8.191   4.772   1.436
  276    H    SER  36           H        SER  36   9.318   3.473   3.857
  277    HA   SER  36           HA       SER  36  12.124   3.134   2.853
  278   1HB   SER  36          1HB       SER  36  12.270   2.609   5.533
  279   2HB   SER  36          2HB       SER  36  12.613   4.181   4.817
  280    HG   SER  36           HG       SER  36  10.868   3.784   6.601
  281    H    TYR  37           H        TYR  37   9.255   1.670   4.293
  282    HA   TYR  37           HA       TYR  37  10.406  -1.033   3.684
  283   1HB   TYR  37          1HB       TYR  37  10.431  -0.340   6.120
  284   2HB   TYR  37          2HB       TYR  37   8.670  -0.282   6.051
  285    HD1  TYR  37           HD1      TYR  37  11.342  -2.626   4.818
  286    HD2  TYR  37           HD2      TYR  37   7.635  -2.152   6.935
  287    HE1  TYR  37           HE1      TYR  37  11.239  -5.077   5.188
  288    HE2  TYR  37           HE2      TYR  37   7.529  -4.601   7.303
  289    HH   TYR  37           HH       TYR  37  10.182  -6.654   6.773
  290    H    GLY  38           H        GLY  38   9.094  -2.012   2.181
  291   1HA   GLY  38          1HA       GLY  38   6.158  -1.482   2.358
  292   2HA   GLY  38          2HA       GLY  38   6.984  -1.482   0.800
  293    H    TYR  39           H        TYR  39   5.387  -3.419   3.092
  294    HA   TYR  39           HA       TYR  39   6.011  -5.846   1.476
  295   1HB   TYR  39          1HB       TYR  39   6.587  -7.099   3.435
  296   2HB   TYR  39          2HB       TYR  39   7.479  -5.585   3.563
  297    HD1  TYR  39           HD1      TYR  39   6.165  -3.619   4.781
  298    HD2  TYR  39           HD2      TYR  39   5.328  -7.804   5.267
  299    HE1  TYR  39           HE1      TYR  39   5.050  -3.144   6.945
  300    HE2  TYR  39           HE2      TYR  39   4.215  -7.330   7.432
  301    HH   TYR  39           HH       TYR  39   3.061  -4.597   8.339
  302    H    CYS  40           H        CYS  40   4.343  -7.573   1.868
  303    HA   CYS  40           HA       CYS  40   1.685  -6.348   2.221
  304   1HB   CYS  40          1HB       CYS  40   2.897  -8.470   0.757
  305   2HB   CYS  40          2HB       CYS  40   1.635  -9.177   1.766
  306    H    TYR  41           H        TYR  41   0.192  -6.952   3.802
  307    HA   TYR  41           HA       TYR  41   0.991  -8.926   5.882
  308   1HB   TYR  41          1HB       TYR  41   1.864  -6.940   6.823
  309   2HB   TYR  41          2HB       TYR  41   0.547  -5.956   6.187
  310    HD1  TYR  41           HD1      TYR  41   0.315  -9.227   7.972
  311    HD2  TYR  41           HD2      TYR  41  -0.392  -4.992   8.139
  312    HE1  TYR  41           HE1      TYR  41  -0.939  -9.518  10.092
  313    HE2  TYR  41           HE2      TYR  41  -1.644  -5.284  10.259
  314    HH   TYR  41           HH       TYR  41  -1.707  -6.969  12.137
  315    H    GLY  42           H        GLY  42  -0.801 -10.271   5.585
  316   1HA   GLY  42          1HA       GLY  42  -3.067 -10.857   6.045
  317   2HA   GLY  42          2HA       GLY  42  -3.443  -9.143   6.242
  318    H    PHE  43           H        PHE  43  -1.790 -10.645   3.504
  319    HA   PHE  43           HA       PHE  43  -2.331 -10.681   1.213
  320   1HB   PHE  43          1HB       PHE  43  -4.958 -10.952   2.666
  321   2HB   PHE  43          2HB       PHE  43  -4.914 -10.919   0.904
  322    HD1  PHE  43           HD1      PHE  43  -3.821 -12.760   3.924
  323    HD2  PHE  43           HD2      PHE  43  -3.965 -12.748  -0.371
  324    HE1  PHE  43           HE1      PHE  43  -3.147 -15.147   3.893
  325    HE2  PHE  43           HE2      PHE  43  -3.290 -15.135  -0.399
  326    HZ   PHE  43           HZ       PHE  43  -2.882 -16.334   1.732
  327    H    GLY  44           H        GLY  44  -1.698  -8.159   2.132
  328   1HA   GLY  44          1HA       GLY  44  -3.222  -6.465   0.299
  329   2HA   GLY  44          2HA       GLY  44  -3.421  -6.025   1.996
  330    H    CYS  45           H        CYS  45  -2.006  -4.595  -0.267
  331    HA   CYS  45           HA       CYS  45   0.843  -4.730   0.256
  332   1HB   CYS  45          1HB       CYS  45  -1.019  -3.439  -1.501
  333   2HB   CYS  45          2HB       CYS  45   0.038  -2.206  -0.814
  334    H    TYR  46           H        TYR  46   1.902  -3.841   1.997
  335    HA   TYR  46           HA       TYR  46   0.568  -1.579   3.448
  336   1HB   TYR  46          1HB       TYR  46   0.570  -3.988   4.431
  337   2HB   TYR  46          2HB       TYR  46   2.284  -3.701   4.728
  338    HD1  TYR  46           HD1      TYR  46  -0.914  -1.772   5.063
  339    HD2  TYR  46           HD2      TYR  46   2.789  -2.955   6.882
  340    HE1  TYR  46           HE1      TYR  46  -1.506  -0.482   7.098
  341    HE2  TYR  46           HE2      TYR  46   2.199  -1.666   8.919
  342    HH   TYR  46           HH       TYR  46  -0.666  -0.786   9.769
  343    H    CYS  47           H        CYS  47   1.878   0.206   3.578
  344    HA   CYS  47           HA       CYS  47   4.819  -0.160   3.124
  345   1HB   CYS  47          1HB       CYS  47   2.937   2.178   2.678
  346   2HB   CYS  47          2HB       CYS  47   4.673   2.226   2.374
  347    H    GLU  48           H        GLU  48   6.217   0.584   4.725
  348    HA   GLU  48           HA       GLU  48   4.978   2.036   7.043
  349   1HB   GLU  48          1HB       GLU  48   5.678  -0.551   7.058
  350   2HB   GLU  48          2HB       GLU  48   7.261   0.145   7.406
  351   1HG   GLU  48          1HG       GLU  48   5.959   1.569   9.172
  352   2HG   GLU  48          2HG       GLU  48   4.731   0.312   9.019
  353    H    GLY  49           H        GLY  49   6.054   3.903   7.569
  354   1HA   GLY  49          1HA       GLY  49   8.269   4.921   8.120
  355   2HA   GLY  49          2HA       GLY  49   8.887   4.180   6.646
  356    H    LEU  50           H        LEU  50   5.899   5.126   5.756
  357    HA   LEU  50           HA       LEU  50   6.951   7.680   4.646
  358   1HB   LEU  50          1HB       LEU  50   4.868   7.357   3.172
  359   2HB   LEU  50          2HB       LEU  50   6.156   6.172   2.986
  360    HG   LEU  50           HG       LEU  50   4.191   5.505   5.079
  361   1HD1  LEU  50          1HD1      LEU  50   3.307   6.313   2.418
  362   2HD1  LEU  50          2HD1      LEU  50   2.884   4.638   2.773
  363   3HD1  LEU  50          3HD1      LEU  50   2.347   5.929   3.847
  364   1HD2  LEU  50          1HD2      LEU  50   6.000   3.999   4.268
  365   2HD2  LEU  50          2HD2      LEU  50   4.402   3.296   4.024
  366   3HD2  LEU  50          3HD2      LEU  50   5.267   4.010   2.664
  367    HA   PRO  51           HA       PRO  51   4.436   9.834   7.656
  368   1HB   PRO  51          1HB       PRO  51   4.608  12.225   6.080
  369   2HB   PRO  51          2HB       PRO  51   5.533  11.814   7.528
  370   1HG   PRO  51          1HG       PRO  51   6.461  11.936   4.809
  371   2HG   PRO  51          2HG       PRO  51   7.389  11.555   6.262
  372   1HD   PRO  51          1HD       PRO  51   6.574   9.751   4.166
  373   2HD   PRO  51          2HD       PRO  51   7.494   9.365   5.641
  374    H    ASP  52           H        ASP  52   2.369  11.169   7.560
  375    HA   ASP  52           HA       ASP  52   0.372   9.965   5.950
  376   1HB   ASP  52          1HB       ASP  52   0.374  12.749   7.154
  377   2HB   ASP  52          2HB       ASP  52  -1.030  11.724   6.856
  378    H    SER  53           H        SER  53   2.474  12.722   5.324
  379    HA   SER  53           HA       SER  53   1.181  14.120   3.298
  380   1HB   SER  53          1HB       SER  53   3.362  14.805   2.686
  381   2HB   SER  53          2HB       SER  53   3.541  14.312   4.368
  382    HG   SER  53           HG       SER  53   4.836  12.798   3.721
  383    H    THR  54           H        THR  54   2.911  11.019   2.997
  384    HA   THR  54           HA       THR  54   2.610  10.765   0.144
  385    HB   THR  54           HB       THR  54   2.715   8.233   1.510
  386    HG1  THR  54           HG1      THR  54   4.558  10.142   2.486
  387   1HG2  THR  54          1HG2      THR  54   3.936   9.453  -0.600
  388   2HG2  THR  54          2HG2      THR  54   5.220   9.512   0.607
  389   3HG2  THR  54          3HG2      THR  54   4.516   7.963   0.145
  390    H    GLN  55           H        GLN  55   1.285   8.853  -0.779
  391    HA   GLN  55           HA       GLN  55  -1.519   9.147   0.134
  392   1HB   GLN  55          1HB       GLN  55  -0.891   9.405  -2.235
  393   2HB   GLN  55          2HB       GLN  55  -0.208   7.779  -2.241
  394   1HG   GLN  55          1HG       GLN  55  -2.313   7.330  -3.092
  395   2HG   GLN  55          2HG       GLN  55  -2.630   7.128  -1.368
  396   1HE2  GLN  55          2HE2      GLN  55  -4.275   8.412  -0.507
  397   2HE2  GLN  55          1HE2      GLN  55  -4.936   9.778  -1.268
  398    H    THR  56           H        THR  56  -2.549   7.530   1.312
  399    HA   THR  56           HA       THR  56  -1.618   4.736   1.092
  400    HB   THR  56           HB       THR  56  -1.652   5.153   3.834
  401    HG1  THR  56           HG1      THR  56   0.116   7.077   3.198
  402   1HG2  THR  56          1HG2      THR  56   0.006   4.039   2.031
  403   2HG2  THR  56          2HG2      THR  56   0.937   5.488   2.414
  404   3HG2  THR  56          3HG2      THR  56   0.495   4.359   3.695
  405    H    TRP  57           H        TRP  57  -3.189   3.255   1.770
  406    HA   TRP  57           HA       TRP  57  -5.942   4.214   2.055
  407   1HB   TRP  57          1HB       TRP  57  -4.762   2.090   0.920
  408   2HB   TRP  57          2HB       TRP  57  -5.039   1.389   2.508
  409    HD1  TRP  57           HD1      TRP  57  -7.053   3.229  -0.239
  410    HE1  TRP  57           HE1      TRP  57  -9.452   2.291  -0.230
  411    HE3  TRP  57           HE3      TRP  57  -6.727  -0.003   3.707
  412    HZ2  TRP  57           HZ2      TRP  57 -11.026   0.422   1.248
  413    HZ3  TRP  57           HZ3      TRP  57  -8.693  -1.349   4.391
  414    HH2  TRP  57           HH2      TRP  57 -10.839  -1.141   3.167
  415    HA   PRO  58           HA       PRO  58  -7.804   3.281   2.873
  416   1HB   PRO  58          1HB       PRO  58  -9.459   4.571   4.761
  417   2HB   PRO  58          2HB       PRO  58  -9.422   2.846   4.385
  418   1HG   PRO  58          1HG       PRO  58  -8.530   4.166   6.790
  419   2HG   PRO  58          2HG       PRO  58  -8.567   2.435   6.441
  420   1HD   PRO  58          1HD       PRO  58  -6.262   4.197   6.534
  421   2HD   PRO  58          2HD       PRO  58  -6.295   2.435   6.278
  422    H    LEU  59           H        LEU  59  -8.328   4.918   1.462
  423    HA   LEU  59           HA       LEU  59  -7.102   7.482   1.525
  424   1HB   LEU  59          1HB       LEU  59  -8.274   7.716  -0.497
  425   2HB   LEU  59          2HB       LEU  59  -8.293   5.974  -0.294
  426    HG   LEU  59           HG       LEU  59 -10.541   7.676   0.782
  427   1HD1  LEU  59          1HD1      LEU  59  -9.855   7.102  -1.999
  428   2HD1  LEU  59          2HD1      LEU  59 -11.445   6.480  -1.558
  429   3HD1  LEU  59          3HD1      LEU  59 -11.079   8.193  -1.351
  430   1HD2  LEU  59          1HD2      LEU  59 -10.201   4.771  -0.022
  431   2HD2  LEU  59          2HD2      LEU  59 -10.428   5.393   1.612
  432   3HD2  LEU  59          3HD2      LEU  59 -11.744   5.486   0.442
  433    HA   PRO  60           HA       PRO  60  -9.527  10.318   3.905
  434   1HB   PRO  60          1HB       PRO  60 -11.242  11.228   1.695
  435   2HB   PRO  60          2HB       PRO  60 -10.080  12.141   2.664
  436   1HG   PRO  60          1HG       PRO  60  -9.715  11.276   0.006
  437   2HG   PRO  60          2HG       PRO  60  -8.471  11.931   1.076
  438   1HD   PRO  60          1HD       PRO  60  -8.722   9.231   0.105
  439   2HD   PRO  60          2HD       PRO  60  -7.465   9.884   1.178
  440    H    ASN  61           H        ASN  61 -11.989  10.927   4.369
  441    HA   ASN  61           HA       ASN  61 -13.406   8.698   5.236
  442   1HB   ASN  61          1HB       ASN  61 -13.930  11.539   4.626
  443   2HB   ASN  61          2HB       ASN  61 -15.374  10.527   4.640
  444   1HD2  ASN  61          2HD2      ASN  61 -12.392  10.976   6.640
  445   2HD2  ASN  61          1HD2      ASN  61 -13.196  10.813   8.126
  446    H    LYS  62           H        LYS  62 -13.258  10.062   2.024
  447    HA   LYS  62           HA       LYS  62 -15.588   8.712   0.940
  448   1HB   LYS  62          1HB       LYS  62 -13.169  10.175  -0.055
  449   2HB   LYS  62          2HB       LYS  62 -14.107   9.230  -1.213
  450   1HG   LYS  62          1HG       LYS  62 -16.173  10.438  -0.255
  451   2HG   LYS  62          2HG       LYS  62 -15.024  11.561   0.473
  452   1HD   LYS  62          1HD       LYS  62 -14.921  12.655  -1.489
  453   2HD   LYS  62          2HD       LYS  62 -14.201  11.216  -2.211
  454   1HE   LYS  62          1HE       LYS  62 -17.086  10.910  -1.897
  455   2HE   LYS  62          2HE       LYS  62 -16.675  12.310  -2.907
  456   1HZ   LYS  62          1HZ       LYS  62 -15.323   9.695  -3.215
  457   2HZ   LYS  62          2HZ       LYS  62 -16.745  10.071  -4.066
  458   3HZ   LYS  62          3HZ       LYS  62 -15.345  11.000  -4.302
  459    H    THR  63           H        THR  63 -15.611   6.461   1.085
  460    HA   THR  63           HA       THR  63 -13.334   4.753   1.111
  461    HB   THR  63           HB       THR  63 -15.659   4.186   1.804
  462    HG1  THR  63           HG1      THR  63 -14.062   2.588   1.115
  463   1HG2  THR  63          1HG2      THR  63 -16.225   5.091  -0.842
  464   2HG2  THR  63          2HG2      THR  63 -16.709   3.398  -0.728
  465   3HG2  THR  63          3HG2      THR  63 -17.367   4.581   0.403
  466    H    CYS  64           H        CYS  64 -13.623   2.876  -0.842
  467    HA   CYS  64           HA       CYS  64 -12.426   4.186  -3.164
  468   1HB   CYS  64          1HB       CYS  64 -11.583   2.057  -2.451
  469   2HB   CYS  64          2HB       CYS  64 -13.196   1.350  -2.430
  Start of MODEL    2
    1   1H    LYS   1          1H        LYS   1   6.137   4.917  10.277
    2   2H    LYS   1          2H        LYS   1   6.006   6.504   9.686
    3   3H    LYS   1          3H        LYS   1   5.953   6.217  11.355
    4    HA   LYS   1           HA       LYS   1   3.803   5.439  11.317
    5   1HB   LYS   1          1HB       LYS   1   4.027   7.814  10.623
    6   2HB   LYS   1          2HB       LYS   1   4.076   7.302   8.935
    7   1HG   LYS   1          1HG       LYS   1   1.827   6.194   9.313
    8   2HG   LYS   1          2HG       LYS   1   1.774   7.004  10.879
    9   1HD   LYS   1          1HD       LYS   1   0.924   8.807   9.827
   10   2HD   LYS   1          2HD       LYS   1   2.494   9.007   9.048
   11   1HE   LYS   1          1HE       LYS   1   1.197   6.939   7.619
   12   2HE   LYS   1          2HE       LYS   1  -0.013   8.218   7.842
   13   1HZ   LYS   1          1HZ       LYS   1   1.699   9.836   7.163
   14   2HZ   LYS   1          2HZ       LYS   1   2.753   8.554   6.811
   15   3HZ   LYS   1          3HZ       LYS   1   1.316   8.742   5.927
   16    H    ASP   2           H        ASP   2   2.706   3.645  10.624
   17    HA   ASP   2           HA       ASP   2   3.444   2.348   8.086
   18   1HB   ASP   2          1HB       ASP   2   1.391   1.669  10.222
   19   2HB   ASP   2          2HB       ASP   2   1.967   0.578   8.962
   20    H    GLY   3           H        GLY   3   1.981   2.050   6.320
   21   1HA   GLY   3          1HA       GLY   3  -0.706   3.248   6.489
   22   2HA   GLY   3          2HA       GLY   3   0.408   4.030   5.366
   23    H    TYR   4           H        TYR   4  -1.485   3.227   3.921
   24    HA   TYR   4           HA       TYR   4  -0.669   0.595   2.743
   25   1HB   TYR   4          1HB       TYR   4  -3.172   1.379   4.060
   26   2HB   TYR   4          2HB       TYR   4  -3.423   0.756   2.431
   27    HD1  TYR   4           HD1      TYR   4  -1.689  -1.356   1.945
   28    HD2  TYR   4           HD2      TYR   4  -3.400  -0.216   5.714
   29    HE1  TYR   4           HE1      TYR   4  -1.404  -3.676   2.776
   30    HE2  TYR   4           HE2      TYR   4  -3.122  -2.535   6.543
   31    HH   TYR   4           HH       TYR   4  -2.111  -4.521   6.137
   32    H    LEU   5           H        LEU   5  -0.660   0.693   0.475
   33    HA   LEU   5           HA       LEU   5  -1.189   3.297  -0.773
   34   1HB   LEU   5          1HB       LEU   5  -0.210   0.587  -1.673
   35   2HB   LEU   5          2HB       LEU   5  -0.497   1.892  -2.824
   36    HG   LEU   5           HG       LEU   5   1.110   2.530  -0.393
   37   1HD1  LEU   5          1HD1      LEU   5   1.849   0.272  -1.514
   38   2HD1  LEU   5          2HD1      LEU   5   2.471   1.330  -2.783
   39   3HD1  LEU   5          3HD1      LEU   5   3.061   1.493  -1.130
   40   1HD2  LEU   5          1HD2      LEU   5   0.500   4.226  -2.114
   41   2HD2  LEU   5          2HD2      LEU   5   2.246   4.003  -1.994
   42   3HD2  LEU   5          3HD2      LEU   5   1.352   3.273  -3.328
   43    H    VAL   6           H        VAL   6  -3.044   3.826  -1.846
   44    HA   VAL   6           HA       VAL   6  -5.267   1.876  -1.883
   45    HB   VAL   6           HB       VAL   6  -6.584   3.850  -2.479
   46   1HG1  VAL   6          1HG1      VAL   6  -4.929   3.609  -0.166
   47   2HG1  VAL   6          2HG1      VAL   6  -5.061   5.318  -0.577
   48   3HG1  VAL   6          3HG1      VAL   6  -6.517   4.362  -0.301
   49   1HG2  VAL   6          1HG2      VAL   6  -3.894   5.239  -2.704
   50   2HG2  VAL   6          2HG2      VAL   6  -4.969   4.857  -4.051
   51   3HG2  VAL   6          3HG2      VAL   6  -5.466   6.028  -2.829
   52    H    GLU   7           H        GLU   7  -6.681   2.350  -4.096
   53    HA   GLU   7           HA       GLU   7  -4.807   2.078  -6.417
   54   1HB   GLU   7          1HB       GLU   7  -5.809  -0.083  -5.370
   55   2HB   GLU   7          2HB       GLU   7  -7.329   0.451  -6.094
   56   1HG   GLU   7          1HG       GLU   7  -6.622   0.026  -8.217
   57   2HG   GLU   7          2HG       GLU   7  -4.976   0.562  -7.880
   58    H    LYS   8           H        LYS   8  -6.225   2.190  -8.535
   59    HA   LYS   8           HA       LYS   8  -7.345   4.704  -8.877
   60   1HB   LYS   8          1HB       LYS   8  -7.603   2.030 -10.176
   61   2HB   LYS   8          2HB       LYS   8  -8.751   3.274 -10.673
   62   1HG   LYS   8          1HG       LYS   8  -7.124   4.590 -11.628
   63   2HG   LYS   8          2HG       LYS   8  -5.889   4.078 -10.479
   64   1HD   LYS   8          1HD       LYS   8  -6.267   1.731 -11.706
   65   2HD   LYS   8          2HD       LYS   8  -6.755   2.794 -13.028
   66   1HE   LYS   8          1HE       LYS   8  -4.375   3.887 -11.859
   67   2HE   LYS   8          2HE       LYS   8  -4.093   2.167 -12.202
   68   1HZ   LYS   8          1HZ       LYS   8  -5.586   3.712 -14.182
   69   2HZ   LYS   8          2HZ       LYS   8  -3.913   3.999 -14.084
   70   3HZ   LYS   8          3HZ       LYS   8  -4.488   2.436 -14.408
   71    H    THR   9           H        THR   9  -9.249   1.714  -8.303
   72    HA   THR   9           HA       THR   9 -11.769   3.015  -7.979
   73    HB   THR   9           HB       THR   9 -12.371   0.836  -6.942
   74    HG1  THR   9           HG1      THR   9  -9.610   0.764  -6.666
   75   1HG2  THR   9          1HG2      THR   9 -10.543   0.774  -9.349
   76   2HG2  THR   9          2HG2      THR   9 -11.486  -0.620  -8.826
   77   3HG2  THR   9          3HG2      THR   9 -12.304   0.856  -9.337
   78    H    GLY  10           H        GLY  10  -9.033   2.699  -5.850
   79   1HA   GLY  10          1HA       GLY  10  -8.994   4.364  -3.971
   80   2HA   GLY  10          2HA       GLY  10 -10.660   3.894  -3.641
   81    H    CYS  11           H        CYS  11 -10.207   1.040  -4.082
   82    HA   CYS  11           HA       CYS  11  -9.271   0.372  -1.415
   83   1HB   CYS  11          1HB       CYS  11 -10.130  -1.199  -3.858
   84   2HB   CYS  11          2HB       CYS  11  -9.650  -1.991  -2.360
   85    H    LYS  12           H        LYS  12  -7.244  -0.273  -0.817
   86    HA   LYS  12           HA       LYS  12  -4.933   0.110  -2.365
   87   1HB   LYS  12          1HB       LYS  12  -3.912  -1.386  -0.610
   88   2HB   LYS  12          2HB       LYS  12  -4.941  -0.119   0.053
   89   1HG   LYS  12          1HG       LYS  12  -5.746  -1.979   1.203
   90   2HG   LYS  12          2HG       LYS  12  -6.829  -1.953  -0.187
   91   1HD   LYS  12          1HD       LYS  12  -5.722  -3.718  -1.254
   92   2HD   LYS  12          2HD       LYS  12  -4.245  -3.483  -0.320
   93   1HE   LYS  12          1HE       LYS  12  -5.545  -5.504   0.415
   94   2HE   LYS  12          2HE       LYS  12  -5.373  -4.306   1.711
   95   1HZ   LYS  12          1HZ       LYS  12  -7.604  -3.728   0.027
   96   2HZ   LYS  12          2HZ       LYS  12  -7.740  -5.279   0.708
   97   3HZ   LYS  12          3HZ       LYS  12  -7.555  -3.926   1.714
   98    H    LYS  13           H        LYS  13  -3.390  -2.122  -2.413
   99    HA   LYS  13           HA       LYS  13  -4.772  -3.852  -4.426
  100   1HB   LYS  13          1HB       LYS  13  -2.501  -2.381  -4.623
  101   2HB   LYS  13          2HB       LYS  13  -1.821  -3.906  -4.050
  102   1HG   LYS  13          1HG       LYS  13  -3.634  -3.572  -6.461
  103   2HG   LYS  13          2HG       LYS  13  -1.896  -3.863  -6.512
  104   1HD   LYS  13          1HD       LYS  13  -2.869  -5.877  -4.841
  105   2HD   LYS  13          2HD       LYS  13  -4.071  -5.765  -6.129
  106   1HE   LYS  13          1HE       LYS  13  -2.667  -6.863  -7.522
  107   2HE   LYS  13          2HE       LYS  13  -1.463  -5.576  -7.315
  108   1HZ   LYS  13          1HZ       LYS  13  -0.923  -6.623  -5.126
  109   2HZ   LYS  13          2HZ       LYS  13  -1.880  -7.951  -5.586
  110   3HZ   LYS  13          3HZ       LYS  13  -0.492  -7.558  -6.478
  111    H    THR  14           H        THR  14  -5.394  -5.809  -3.620
  112    HA   THR  14           HA       THR  14  -4.262  -6.887  -1.142
  113    HB   THR  14           HB       THR  14  -6.199  -8.002  -3.202
  114    HG1  THR  14           HG1      THR  14  -6.766  -6.014  -2.092
  115   1HG2  THR  14          1HG2      THR  14  -5.245  -8.950  -0.525
  116   2HG2  THR  14          2HG2      THR  14  -6.923  -9.248  -0.981
  117   3HG2  THR  14          3HG2      THR  14  -5.612  -9.884  -1.976
  118    H    CYS  15           H        CYS  15  -3.031  -8.856  -1.010
  119    HA   CYS  15           HA       CYS  15  -1.843  -9.791  -3.600
  120   1HB   CYS  15          1HB       CYS  15   0.213 -10.132  -1.893
  121   2HB   CYS  15          2HB       CYS  15  -0.036  -8.627  -2.770
  122    H    TYR  16           H        TYR  16  -1.795 -11.985  -3.834
  123    HA   TYR  16           HA       TYR  16  -3.044 -13.679  -1.794
  124   1HB   TYR  16          1HB       TYR  16  -1.833 -14.096  -4.539
  125   2HB   TYR  16          2HB       TYR  16  -2.547 -15.412  -3.607
  126    HD1  TYR  16           HD1      TYR  16  -3.283 -12.026  -5.002
  127    HD2  TYR  16           HD2      TYR  16  -4.875 -15.758  -3.593
  128    HE1  TYR  16           HE1      TYR  16  -5.543 -11.350  -5.764
  129    HE2  TYR  16           HE2      TYR  16  -7.137 -15.082  -4.356
  130    HH   TYR  16           HH       TYR  16  -8.369 -13.030  -4.843
  131    H    LYS  17           H        LYS  17   0.153 -12.661  -2.508
  132    HA   LYS  17           HA       LYS  17   1.321 -15.055  -1.138
  133   1HB   LYS  17          1HB       LYS  17   2.339 -12.964  -3.066
  134   2HB   LYS  17          2HB       LYS  17   3.453 -13.987  -2.156
  135   1HG   LYS  17          1HG       LYS  17   3.118 -15.670  -3.607
  136   2HG   LYS  17          2HG       LYS  17   1.391 -15.647  -3.247
  137   1HD   LYS  17          1HD       LYS  17   2.427 -13.504  -5.040
  138   2HD   LYS  17          2HD       LYS  17   2.334 -15.135  -5.706
  139   1HE   LYS  17          1HE       LYS  17  -0.085 -15.141  -4.684
  140   2HE   LYS  17          2HE       LYS  17   0.102 -13.377  -4.708
  141   1HZ   LYS  17          1HZ       LYS  17   1.129 -14.147  -7.098
  142   2HZ   LYS  17          2HZ       LYS  17  -0.179 -15.211  -6.911
  143   3HZ   LYS  17          3HZ       LYS  17  -0.436 -13.533  -6.860
  144    H    LEU  18           H        LEU  18   1.277 -14.553   1.057
  145    HA   LEU  18           HA       LEU  18   1.691 -11.872   2.091
  146   1HB   LEU  18          1HB       LEU  18   1.831 -14.613   3.392
  147   2HB   LEU  18          2HB       LEU  18   1.669 -13.082   4.251
  148    HG   LEU  18           HG       LEU  18  -0.319 -14.320   2.330
  149   1HD1  LEU  18          1HD1      LEU  18  -0.344 -13.654   5.286
  150   2HD1  LEU  18          2HD1      LEU  18  -1.797 -14.076   4.377
  151   3HD1  LEU  18          3HD1      LEU  18  -0.489 -15.248   4.547
  152   1HD2  LEU  18          1HD2      LEU  18  -0.129 -11.550   3.522
  153   2HD2  LEU  18          2HD2      LEU  18  -0.401 -11.999   1.840
  154   3HD2  LEU  18          3HD2      LEU  18  -1.677 -12.237   3.032
  155    H    GLY  19           H        GLY  19   3.532 -11.594   3.812
  156   1HA   GLY  19          1HA       GLY  19   5.829 -11.939   4.450
  157   2HA   GLY  19          2HA       GLY  19   6.028 -12.995   3.051
  158    H    GLU  20           H        GLU  20   8.022 -11.560   2.857
  159    HA   GLU  20           HA       GLU  20   7.832  -8.800   2.123
  160   1HB   GLU  20          1HB       GLU  20   9.799 -10.569   2.704
  161   2HB   GLU  20          2HB       GLU  20   9.960 -10.506   0.947
  162   1HG   GLU  20          1HG       GLU  20   9.869  -7.933   1.235
  163   2HG   GLU  20          2HG       GLU  20  10.213  -8.254   2.935
  164    H    ASN  21           H        ASN  21   5.816  -9.239   0.653
  165    HA   ASN  21           HA       ASN  21   6.276 -10.421  -1.968
  166   1HB   ASN  21          1HB       ASN  21   4.099 -10.169  -0.648
  167   2HB   ASN  21          2HB       ASN  21   4.126  -8.467  -1.108
  168   1HD2  ASN  21          2HD2      ASN  21   2.339 -10.868  -1.973
  169   2HD2  ASN  21          1HD2      ASN  21   2.363 -10.780  -3.668
  170    H    ASP  22           H        ASP  22   8.105  -9.291  -2.845
  171    HA   ASP  22           HA       ASP  22   8.739  -6.612  -2.912
  172   1HB   ASP  22          1HB       ASP  22   8.878  -8.839  -4.929
  173   2HB   ASP  22          2HB       ASP  22   9.474  -7.236  -5.356
  174    H    PHE  23           H        PHE  23   6.312  -8.200  -5.006
  175    HA   PHE  23           HA       PHE  23   5.625  -6.258  -6.820
  176   1HB   PHE  23          1HB       PHE  23   4.455  -8.519  -5.639
  177   2HB   PHE  23          2HB       PHE  23   3.247  -7.245  -5.473
  178    HD1  PHE  23           HD1      PHE  23   5.243  -9.235  -7.846
  179    HD2  PHE  23           HD2      PHE  23   2.243  -6.191  -7.426
  180    HE1  PHE  23           HE1      PHE  23   4.687  -9.452 -10.252
  181    HE2  PHE  23           HE2      PHE  23   1.686  -6.406  -9.831
  182    HZ   PHE  23           HZ       PHE  23   2.908  -8.038 -11.245
  183    H    CYS  24           H        CYS  24   4.369  -6.315  -3.451
  184    HA   CYS  24           HA       CYS  24   2.980  -3.820  -3.611
  185   1HB   CYS  24          1HB       CYS  24   4.263  -5.356  -1.328
  186   2HB   CYS  24          2HB       CYS  24   3.195  -3.974  -1.092
  187    H    ASN  25           H        ASN  25   6.102  -4.480  -1.958
  188    HA   ASN  25           HA       ASN  25   6.905  -1.841  -1.490
  189   1HB   ASN  25          1HB       ASN  25   8.219  -3.595  -0.609
  190   2HB   ASN  25          2HB       ASN  25   8.340  -4.407  -2.170
  191   1HD2  ASN  25          2HD2      ASN  25  10.744  -4.369  -1.842
  192   2HD2  ASN  25          1HD2      ASN  25  11.606  -2.945  -2.171
  193    H    ARG  26           H        ARG  26   7.411  -3.797  -4.437
  194    HA   ARG  26           HA       ARG  26   8.901  -2.051  -6.023
  195   1HB   ARG  26          1HB       ARG  26   6.822  -4.138  -6.400
  196   2HB   ARG  26          2HB       ARG  26   7.108  -3.092  -7.791
  197   1HG   ARG  26          1HG       ARG  26   9.479  -4.218  -6.351
  198   2HG   ARG  26          2HG       ARG  26   8.564  -5.280  -7.422
  199   1HD   ARG  26          1HD       ARG  26   9.075  -4.019  -9.328
  200   2HD   ARG  26          2HD       ARG  26   9.384  -2.548  -8.389
  201    HE   ARG  26           HE       ARG  26  11.262  -4.386  -7.455
  202   1HH1  ARG  26          1HH1      ARG  26  10.332  -3.070 -10.511
  203   2HH1  ARG  26          2HH1      ARG  26  11.927  -3.157 -11.177
  204   1HH2  ARG  26          1HH2      ARG  26  13.345  -4.505  -8.320
  205   2HH2  ARG  26          2HH2      ARG  26  13.626  -3.969  -9.943
  206    H    GLU  27           H        GLU  27   5.353  -2.049  -5.548
  207    HA   GLU  27           HA       GLU  27   4.989   0.367  -7.166
  208   1HB   GLU  27          1HB       GLU  27   3.364  -1.580  -5.595
  209   2HB   GLU  27          2HB       GLU  27   2.658   0.014  -5.857
  210   1HG   GLU  27          1HG       GLU  27   3.776  -0.774  -8.335
  211   2HG   GLU  27          2HG       GLU  27   2.897  -2.173  -7.718
  212    H    CYS  28           H        CYS  28   5.643  -0.388  -3.840
  213    HA   CYS  28           HA       CYS  28   4.627   2.124  -2.736
  214   1HB   CYS  28          1HB       CYS  28   4.832  -0.169  -1.621
  215   2HB   CYS  28          2HB       CYS  28   6.566   0.141  -1.523
  216    H    LYS  29           H        LYS  29   7.544   1.125  -4.305
  217    HA   LYS  29           HA       LYS  29   9.020   3.464  -3.154
  218   1HB   LYS  29          1HB       LYS  29   9.977   1.202  -2.837
  219   2HB   LYS  29          2HB       LYS  29   9.987   0.968  -4.586
  220   1HG   LYS  29          1HG       LYS  29  11.738   2.437  -4.915
  221   2HG   LYS  29          2HG       LYS  29  11.327   3.407  -3.501
  222   1HD   LYS  29          1HD       LYS  29  13.202   2.322  -2.691
  223   2HD   LYS  29          2HD       LYS  29  11.961   1.161  -2.217
  224   1HE   LYS  29          1HE       LYS  29  12.379   0.101  -4.569
  225   2HE   LYS  29          2HE       LYS  29  13.908   1.002  -4.514
  226   1HZ   LYS  29          1HZ       LYS  29  12.979  -0.608  -2.213
  227   2HZ   LYS  29          2HZ       LYS  29  13.882  -1.312  -3.468
  228   3HZ   LYS  29          3HZ       LYS  29  14.546  -0.047  -2.546
  229    H    TRP  30           H        TRP  30   7.167   2.829  -5.802
  230    HA   TRP  30           HA       TRP  30   9.003   3.936  -7.817
  231   1HB   TRP  30          1HB       TRP  30   7.421   3.208  -9.350
  232   2HB   TRP  30          2HB       TRP  30   7.140   2.096  -8.020
  233    HD1  TRP  30           HD1      TRP  30   4.969   2.999 -10.231
  234    HE1  TRP  30           HE1      TRP  30   2.730   3.972  -9.413
  235    HE3  TRP  30           HE3      TRP  30   6.304   4.486  -5.527
  236    HZ2  TRP  30           HZ2      TRP  30   1.646   5.213  -7.084
  237    HZ3  TRP  30           HZ3      TRP  30   4.646   5.554  -4.033
  238    HH2  TRP  30           HH2      TRP  30   2.320   5.922  -4.804
  239    H    LYS  31           H        LYS  31   8.882   5.791  -5.905
  240    HA   LYS  31           HA       LYS  31   7.892   8.141  -7.241
  241   1HB   LYS  31          1HB       LYS  31   6.157   6.710  -5.322
  242   2HB   LYS  31          2HB       LYS  31   6.305   8.440  -5.025
  243   1HG   LYS  31          1HG       LYS  31   5.970   7.871  -7.860
  244   2HG   LYS  31          2HG       LYS  31   4.630   7.233  -6.906
  245   1HD   LYS  31          1HD       LYS  31   4.106   9.521  -7.525
  246   2HD   LYS  31          2HD       LYS  31   4.434   9.473  -5.794
  247   1HE   LYS  31          1HE       LYS  31   6.148  10.933  -6.035
  248   2HE   LYS  31          2HE       LYS  31   6.902   9.898  -7.263
  249   1HZ   LYS  31          1HZ       LYS  31   4.834  10.806  -8.636
  250   2HZ   LYS  31          2HZ       LYS  31   5.055  12.132  -7.601
  251   3HZ   LYS  31          3HZ       LYS  31   6.325  11.614  -8.603
  252    H    HIS  32           H        HIS  32   8.295  10.110  -5.837
  253    HA   HIS  32           HA       HIS  32  10.575   9.571  -4.002
  254   1HB   HIS  32          1HB       HIS  32  10.364  11.267  -6.040
  255   2HB   HIS  32          2HB       HIS  32   9.638  12.301  -4.807
  256    HD1  HIS  32           HD1      HIS  32  12.136  13.501  -5.611
  257    HD2  HIS  32           HD2      HIS  32  12.164  10.325  -2.912
  258    HE1  HIS  32           HE1      HIS  32  14.355  13.613  -4.396
  259    H    ILE  33           H        ILE  33   8.802   8.754  -2.404
  260    HA   ILE  33           HA       ILE  33   7.758  11.096  -0.853
  261    HB   ILE  33           HB       ILE  33   6.104   9.102  -0.117
  262   1HG1  ILE  33          1HG1      ILE  33   5.506   7.834  -2.236
  263   2HG1  ILE  33          2HG1      ILE  33   7.039   8.379  -2.912
  264   1HG2  ILE  33          1HG2      ILE  33   5.444  11.275  -1.059
  265   2HG2  ILE  33          2HG2      ILE  33   5.855  10.704  -2.676
  266   3HG2  ILE  33          3HG2      ILE  33   4.517   9.967  -1.794
  267   1HD1  ILE  33          1HD1      ILE  33   7.405   7.286  -0.247
  268   2HD1  ILE  33          2HD1      ILE  33   6.629   6.114  -1.311
  269   3HD1  ILE  33          3HD1      ILE  33   8.183   6.817  -1.759
  270    H    GLY  34           H        GLY  34   9.306   7.931  -0.779
  271   1HA   GLY  34          1HA       GLY  34  11.043   7.695   1.029
  272   2HA   GLY  34          2HA       GLY  34   9.829   8.341   2.135
  273    H    GLY  35           H        GLY  35  10.986   5.501   0.554
  274   1HA   GLY  35          1HA       GLY  35   8.724   3.952   1.758
  275   2HA   GLY  35          2HA       GLY  35   9.554   3.453   0.284
  276    H    SER  36           H        SER  36   9.632   3.385   3.732
  277    HA   SER  36           HA       SER  36  12.409   2.343   3.802
  278   1HB   SER  36          1HB       SER  36  12.018   2.520   6.244
  279   2HB   SER  36          2HB       SER  36  11.621   4.026   5.426
  280    HG   SER  36           HG       SER  36  10.066   2.936   7.021
  281    H    TYR  37           H        TYR  37   9.063   1.324   4.477
  282    HA   TYR  37           HA       TYR  37   9.978  -1.519   4.304
  283   1HB   TYR  37          1HB       TYR  37   9.165  -0.087   6.619
  284   2HB   TYR  37          2HB       TYR  37   7.848  -1.190   6.219
  285    HD1  TYR  37           HD1      TYR  37   8.385  -3.647   5.834
  286    HD2  TYR  37           HD2      TYR  37  11.189  -0.890   7.563
  287    HE1  TYR  37           HE1      TYR  37   9.699  -5.548   6.736
  288    HE2  TYR  37           HE2      TYR  37  12.502  -2.792   8.466
  289    HH   TYR  37           HH       TYR  37  12.522  -5.643   7.478
  290    H    GLY  38           H        GLY  38   8.584  -2.768   3.066
  291   1HA   GLY  38          1HA       GLY  38   5.771  -2.013   2.739
  292   2HA   GLY  38          2HA       GLY  38   6.743  -1.807   1.281
  293    H    TYR  39           H        TYR  39   4.878  -4.004   3.012
  294    HA   TYR  39           HA       TYR  39   5.710  -6.193   1.201
  295   1HB   TYR  39          1HB       TYR  39   6.066  -7.720   3.117
  296   2HB   TYR  39          2HB       TYR  39   7.178  -6.354   3.180
  297    HD1  TYR  39           HD1      TYR  39   6.630  -4.385   4.677
  298    HD2  TYR  39           HD2      TYR  39   4.492  -8.106   4.855
  299    HE1  TYR  39           HE1      TYR  39   5.769  -3.781   6.923
  300    HE2  TYR  39           HE2      TYR  39   3.628  -7.501   7.099
  301    HH   TYR  39           HH       TYR  39   4.878  -5.375   9.036
  302    H    CYS  40           H        CYS  40   4.178  -8.155   1.630
  303    HA   CYS  40           HA       CYS  40   1.426  -7.124   1.681
  304   1HB   CYS  40          1HB       CYS  40   2.284  -8.780   0.037
  305   2HB   CYS  40          2HB       CYS  40   2.566  -9.919   1.354
  306    H    TYR  41           H        TYR  41   0.374  -6.914   3.608
  307    HA   TYR  41           HA       TYR  41   0.866  -8.984   5.726
  308   1HB   TYR  41          1HB       TYR  41   1.845  -6.842   6.348
  309   2HB   TYR  41          2HB       TYR  41   0.357  -5.996   5.923
  310    HD1  TYR  41           HD1      TYR  41   1.963  -8.256   8.360
  311    HD2  TYR  41           HD2      TYR  41  -1.605  -6.086   7.355
  312    HE1  TYR  41           HE1      TYR  41   1.083  -8.642  10.647
  313    HE2  TYR  41           HE2      TYR  41  -2.485  -6.472   9.641
  314    HH   TYR  41           HH       TYR  41  -2.024  -8.353  11.494
  315    H    GLY  42           H        GLY  42  -0.978 -10.248   5.644
  316   1HA   GLY  42          1HA       GLY  42  -3.259 -10.770   5.904
  317   2HA   GLY  42          2HA       GLY  42  -3.547  -9.070   6.285
  318    H    PHE  43           H        PHE  43  -2.095 -10.450   3.352
  319    HA   PHE  43           HA       PHE  43  -2.735 -10.251   1.091
  320   1HB   PHE  43          1HB       PHE  43  -5.396 -10.203   2.544
  321   2HB   PHE  43          2HB       PHE  43  -5.256 -10.313   0.790
  322    HD1  PHE  43           HD1      PHE  43  -4.448 -12.012   3.991
  323    HD2  PHE  43           HD2      PHE  43  -4.565 -12.333  -0.291
  324    HE1  PHE  43           HE1      PHE  43  -4.057 -14.455   4.163
  325    HE2  PHE  43           HE2      PHE  43  -4.170 -14.775  -0.119
  326    HZ   PHE  43           HZ       PHE  43  -3.918 -15.837   2.107
  327    H    GLY  44           H        GLY  44  -1.667  -7.963   1.780
  328   1HA   GLY  44          1HA       GLY  44  -3.039  -5.961   0.258
  329   2HA   GLY  44          2HA       GLY  44  -3.226  -5.618   1.979
  330    H    CYS  45           H        CYS  45  -1.551  -4.356  -0.302
  331    HA   CYS  45           HA       CYS  45   1.225  -4.781   0.463
  332   1HB   CYS  45          1HB       CYS  45  -0.203  -2.635  -1.139
  333   2HB   CYS  45          2HB       CYS  45   1.545  -2.856  -1.092
  334    H    TYR  46           H        TYR  46   1.465  -4.279   2.699
  335    HA   TYR  46           HA       TYR  46   0.591  -1.606   3.653
  336   1HB   TYR  46          1HB       TYR  46   0.401  -3.954   4.824
  337   2HB   TYR  46          2HB       TYR  46   2.091  -3.677   5.243
  338    HD1  TYR  46           HD1      TYR  46  -0.617  -1.131   4.918
  339    HD2  TYR  46           HD2      TYR  46   1.980  -3.275   7.579
  340    HE1  TYR  46           HE1      TYR  46  -1.319   0.341   6.782
  341    HE2  TYR  46           HE2      TYR  46   1.277  -1.802   9.447
  342    HH   TYR  46           HH       TYR  46  -0.576   1.070   8.924
  343    H    CYS  47           H        CYS  47   2.089   0.012   4.257
  344    HA   CYS  47           HA       CYS  47   4.994  -0.612   3.869
  345   1HB   CYS  47          1HB       CYS  47   3.198   1.069   2.300
  346   2HB   CYS  47          2HB       CYS  47   4.578   1.983   2.910
  347    H    GLU  48           H        GLU  48   6.408   0.892   4.998
  348    HA   GLU  48           HA       GLU  48   5.045   2.518   7.119
  349   1HB   GLU  48          1HB       GLU  48   7.528   0.777   7.311
  350   2HB   GLU  48          2HB       GLU  48   6.838   1.722   8.631
  351   1HG   GLU  48          1HG       GLU  48   4.909   0.372   8.752
  352   2HG   GLU  48          2HG       GLU  48   5.180  -0.313   7.148
  353    H    GLY  49           H        GLY  49   6.253   4.414   7.780
  354   1HA   GLY  49          1HA       GLY  49   8.011   6.024   7.604
  355   2HA   GLY  49          2HA       GLY  49   8.716   5.073   6.297
  356    H    LEU  50           H        LEU  50   5.354   6.138   6.514
  357    HA   LEU  50           HA       LEU  50   5.662   7.472   3.880
  358   1HB   LEU  50          1HB       LEU  50   3.171   6.981   5.527
  359   2HB   LEU  50          2HB       LEU  50   3.273   7.241   3.785
  360    HG   LEU  50           HG       LEU  50   4.398   4.863   5.296
  361   1HD1  LEU  50          1HD1      LEU  50   1.789   5.384   4.435
  362   2HD1  LEU  50          2HD1      LEU  50   2.470   4.353   3.177
  363   3HD1  LEU  50          3HD1      LEU  50   2.455   3.807   4.852
  364   1HD2  LEU  50          1HD2      LEU  50   4.528   5.744   2.410
  365   2HD2  LEU  50          2HD2      LEU  50   5.846   5.208   3.453
  366   3HD2  LEU  50          3HD2      LEU  50   4.668   4.041   2.851
  367    HA   PRO  51           HA       PRO  51   6.014  11.382   6.088
  368   1HB   PRO  51          1HB       PRO  51   5.348  12.662   3.564
  369   2HB   PRO  51          2HB       PRO  51   6.894  12.641   4.417
  370   1HG   PRO  51          1HG       PRO  51   6.252  11.258   2.027
  371   2HG   PRO  51          2HG       PRO  51   7.725  11.096   2.987
  372   1HD   PRO  51          1HD       PRO  51   5.561   9.183   2.688
  373   2HD   PRO  51          2HD       PRO  51   7.093   8.986   3.574
  374    H    ASP  52           H        ASP  52   4.498  13.056   6.712
  375    HA   ASP  52           HA       ASP  52   1.713  12.252   6.700
  376   1HB   ASP  52          1HB       ASP  52   3.425  13.908   8.155
  377   2HB   ASP  52          2HB       ASP  52   2.294  15.030   7.398
  378    H    SER  53           H        SER  53   3.599  13.828   4.378
  379    HA   SER  53           HA       SER  53   1.459  15.615   3.398
  380   1HB   SER  53          1HB       SER  53   4.210  15.633   3.391
  381   2HB   SER  53          2HB       SER  53   3.849  15.115   1.746
  382    HG   SER  53           HG       SER  53   3.113  17.480   3.096
  383    H    THR  54           H        THR  54   2.252  12.342   3.061
  384    HA   THR  54           HA       THR  54   1.204  12.174   0.276
  385    HB   THR  54           HB       THR  54   2.322  10.009   2.078
  386    HG1  THR  54           HG1      THR  54   3.869  11.180   0.099
  387   1HG2  THR  54          1HG2      THR  54   1.307  10.142  -0.644
  388   2HG2  THR  54          2HG2      THR  54   2.971   9.562  -0.602
  389   3HG2  THR  54          3HG2      THR  54   1.725   8.730   0.326
  390    H    GLN  55           H        GLN  55  -0.549  10.646  -0.166
  391    HA   GLN  55           HA       GLN  55  -2.482  10.449   2.094
  392   1HB   GLN  55          1HB       GLN  55  -2.636  10.274  -0.925
  393   2HB   GLN  55          2HB       GLN  55  -4.018   9.914   0.112
  394   1HG   GLN  55          1HG       GLN  55  -2.465  12.516   0.216
  395   2HG   GLN  55          2HG       GLN  55  -3.958  12.298  -0.699
  396   1HE2  GLN  55          2HE2      GLN  55  -2.622  12.229   2.621
  397   2HE2  GLN  55          1HE2      GLN  55  -4.113  12.465   3.398
  398    H    THR  56           H        THR  56  -3.761   8.348   2.197
  399    HA   THR  56           HA       THR  56  -2.651   5.962   0.950
  400    HB   THR  56           HB       THR  56  -0.853   6.416   2.500
  401    HG1  THR  56           HG1      THR  56  -1.670   4.252   2.380
  402   1HG2  THR  56          1HG2      THR  56  -3.048   7.340   4.158
  403   2HG2  THR  56          2HG2      THR  56  -2.001   6.235   5.049
  404   3HG2  THR  56          3HG2      THR  56  -1.322   7.681   4.301
  405    H    TRP  57           H        TRP  57  -3.565   3.956   2.036
  406    HA   TRP  57           HA       TRP  57  -6.447   4.236   2.463
  407   1HB   TRP  57          1HB       TRP  57  -4.863   2.439   1.302
  408   2HB   TRP  57          2HB       TRP  57  -4.810   1.771   2.924
  409    HD1  TRP  57           HD1      TRP  57  -7.567   3.008   0.506
  410    HE1  TRP  57           HE1      TRP  57  -9.563   1.390   0.705
  411    HE3  TRP  57           HE3      TRP  57  -5.770  -0.164   4.073
  412    HZ2  TRP  57           HZ2      TRP  57 -10.300  -0.951   2.190
  413    HZ3  TRP  57           HZ3      TRP  57  -7.132  -2.078   4.863
  414    HH2  TRP  57           HH2      TRP  57  -9.394  -2.474   3.928
  415    HA   PRO  58           HA       PRO  58  -7.915   3.159   3.248
  416   1HB   PRO  58          1HB       PRO  58  -9.856   3.137   5.201
  417   2HB   PRO  58          2HB       PRO  58  -8.939   1.708   4.705
  418   1HG   PRO  58          1HG       PRO  58  -8.795   3.201   7.224
  419   2HG   PRO  58          2HG       PRO  58  -8.142   1.604   6.836
  420   1HD   PRO  58          1HD       PRO  58  -6.716   4.135   6.995
  421   2HD   PRO  58          2HD       PRO  58  -6.046   2.510   6.694
  422    H    LEU  59           H        LEU  59  -9.958   4.497   2.915
  423    HA   LEU  59           HA       LEU  59  -9.535   7.291   3.904
  424   1HB   LEU  59          1HB       LEU  59 -10.144   6.035   1.302
  425   2HB   LEU  59          2HB       LEU  59 -11.117   7.463   1.661
  426    HG   LEU  59           HG       LEU  59  -8.790   8.484   2.389
  427   1HD1  LEU  59          1HD1      LEU  59  -8.109   6.028   0.833
  428   2HD1  LEU  59          2HD1      LEU  59  -7.157   7.480   0.519
  429   3HD1  LEU  59          3HD1      LEU  59  -7.227   6.805   2.148
  430   1HD2  LEU  59          1HD2      LEU  59  -9.940   8.120  -0.368
  431   2HD2  LEU  59          2HD2      LEU  59  -9.894   9.571   0.633
  432   3HD2  LEU  59          3HD2      LEU  59  -8.428   9.003  -0.163
  433    HA   PRO  60           HA       PRO  60 -13.361   6.964   6.149
  434   1HB   PRO  60          1HB       PRO  60 -13.930   9.727   5.430
  435   2HB   PRO  60          2HB       PRO  60 -13.504   9.053   7.006
  436   1HG   PRO  60          1HG       PRO  60 -11.850  10.634   5.339
  437   2HG   PRO  60          2HG       PRO  60 -11.370   9.783   6.811
  438   1HD   PRO  60          1HD       PRO  60 -10.641   9.167   4.074
  439   2HD   PRO  60          2HD       PRO  60 -10.116   8.345   5.564
  440    H    ASN  61           H        ASN  61 -15.608   8.546   5.479
  441    HA   ASN  61           HA       ASN  61 -17.212   7.069   3.829
  442   1HB   ASN  61          1HB       ASN  61 -17.168   9.668   4.952
  443   2HB   ASN  61          2HB       ASN  61 -17.623   9.877   3.260
  444   1HD2  ASN  61          2HD2      ASN  61 -18.382   7.469   5.858
  445   2HD2  ASN  61          1HD2      ASN  61 -20.052   7.464   5.558
  446    H    LYS  62           H        LYS  62 -14.599   9.145   2.831
  447    HA   LYS  62           HA       LYS  62 -15.166   9.549   0.079
  448   1HB   LYS  62          1HB       LYS  62 -12.555   9.001   1.527
  449   2HB   LYS  62          2HB       LYS  62 -12.692   9.748  -0.066
  450   1HG   LYS  62          1HG       LYS  62 -14.066  10.882   2.378
  451   2HG   LYS  62          2HG       LYS  62 -12.437  11.361   1.902
  452   1HD   LYS  62          1HD       LYS  62 -13.167  12.376  -0.074
  453   2HD   LYS  62          2HD       LYS  62 -14.659  11.435  -0.120
  454   1HE   LYS  62          1HE       LYS  62 -14.167  13.373   2.142
  455   2HE   LYS  62          2HE       LYS  62 -14.827  13.938   0.595
  456   1HZ   LYS  62          1HZ       LYS  62 -16.459  12.092   0.748
  457   2HZ   LYS  62          2HZ       LYS  62 -15.917  11.783   2.324
  458   3HZ   LYS  62          3HZ       LYS  62 -16.653  13.271   1.956
  459    H    THR  63           H        THR  63 -12.984   8.249  -1.204
  460    HA   THR  63           HA       THR  63 -14.162   5.859  -2.142
  461    HB   THR  63           HB       THR  63 -12.241   7.330  -3.048
  462    HG1  THR  63           HG1      THR  63 -11.948   5.757  -4.407
  463   1HG2  THR  63          1HG2      THR  63 -10.957   6.628  -0.788
  464   2HG2  THR  63          2HG2      THR  63 -10.374   5.352  -1.854
  465   3HG2  THR  63          3HG2      THR  63 -10.104   7.044  -2.273
  466    H    CYS  64           H        CYS  64 -12.150   3.909  -1.999
  467    HA   CYS  64           HA       CYS  64 -12.870   2.396   0.255
  468   1HB   CYS  64          1HB       CYS  64 -11.505   1.983  -2.012
  469   2HB   CYS  64          2HB       CYS  64 -10.142   2.146  -0.920
  Start of MODEL    3
    1   1H    LYS   1          1H        LYS   1   5.867   6.355   9.092
    2   2H    LYS   1          2H        LYS   1   5.622   7.764  10.002
    3   3H    LYS   1          3H        LYS   1   6.039   6.314  10.782
    4    HA   LYS   1           HA       LYS   1   3.816   6.190  11.160
    5   1HB   LYS   1          1HB       LYS   1   3.926   8.507   9.806
    6   2HB   LYS   1          2HB       LYS   1   3.090   7.534   8.594
    7   1HG   LYS   1          1HG       LYS   1   1.598   6.803  10.640
    8   2HG   LYS   1          2HG       LYS   1   2.195   8.301  11.354
    9   1HD   LYS   1          1HD       LYS   1   0.112   8.766  10.184
   10   2HD   LYS   1          2HD       LYS   1   1.442   9.523   9.305
   11   1HE   LYS   1          1HE       LYS   1   1.251   6.909   8.256
   12   2HE   LYS   1          2HE       LYS   1  -0.415   7.508   8.369
   13   1HZ   LYS   1          1HZ       LYS   1   0.457   9.647   7.420
   14   2HZ   LYS   1          2HZ       LYS   1   1.901   8.831   7.068
   15   3HZ   LYS   1          3HZ       LYS   1   0.450   8.333   6.342
   16    H    ASP   2           H        ASP   2   2.868   4.226  10.776
   17    HA   ASP   2           HA       ASP   2   3.386   2.868   8.182
   18   1HB   ASP   2          1HB       ASP   2   2.066   1.816  10.698
   19   2HB   ASP   2          2HB       ASP   2   2.851   0.880   9.426
   20    H    GLY   3           H        GLY   3   1.620   2.047   6.900
   21   1HA   GLY   3          1HA       GLY   3  -1.141   2.536   7.739
   22   2HA   GLY   3          2HA       GLY   3  -0.595   3.602   6.445
   23    H    TYR   4           H        TYR   4  -2.420   2.390   5.336
   24    HA   TYR   4           HA       TYR   4  -1.437  -0.200   4.188
   25   1HB   TYR   4          1HB       TYR   4  -4.008   0.800   5.227
   26   2HB   TYR   4          2HB       TYR   4  -4.141  -0.035   3.680
   27    HD1  TYR   4           HD1      TYR   4  -2.690  -2.282   3.524
   28    HD2  TYR   4           HD2      TYR   4  -4.093  -0.485   7.167
   29    HE1  TYR   4           HE1      TYR   4  -2.481  -4.464   4.683
   30    HE2  TYR   4           HE2      TYR   4  -3.882  -2.669   8.323
   31    HH   TYR   4           HH       TYR   4  -3.678  -5.531   6.821
   32    H    LEU   5           H        LEU   5  -1.328  -0.331   1.935
   33    HA   LEU   5           HA       LEU   5  -1.451   2.165   0.415
   34   1HB   LEU   5          1HB       LEU   5  -0.932  -0.744  -0.253
   35   2HB   LEU   5          2HB       LEU   5  -0.811   0.554  -1.441
   36    HG   LEU   5           HG       LEU   5   0.727   0.514   1.169
   37   1HD1  LEU   5          1HD1      LEU   5   1.201  -0.827  -1.394
   38   2HD1  LEU   5          2HD1      LEU   5   2.533   0.222  -0.912
   39   3HD1  LEU   5          3HD1      LEU   5   1.996  -1.068   0.162
   40   1HD2  LEU   5          1HD2      LEU   5   0.133   2.608  -0.522
   41   2HD2  LEU   5          2HD2      LEU   5   1.537   2.543   0.545
   42   3HD2  LEU   5          3HD2      LEU   5   1.691   2.060  -1.145
   43    H    VAL   6           H        VAL   6  -3.167   2.852  -0.822
   44    HA   VAL   6           HA       VAL   6  -5.644   1.246  -0.809
   45    HB   VAL   6           HB       VAL   6  -6.617   3.311  -1.674
   46   1HG1  VAL   6          1HG1      VAL   6  -5.083   3.115   0.726
   47   2HG1  VAL   6          2HG1      VAL   6  -4.909   4.757   0.103
   48   3HG1  VAL   6          3HG1      VAL   6  -6.516   4.101   0.425
   49   1HG2  VAL   6          1HG2      VAL   6  -3.859   3.727  -2.560
   50   2HG2  VAL   6          2HG2      VAL   6  -5.348   4.459  -3.159
   51   3HG2  VAL   6          3HG2      VAL   6  -4.525   5.150  -1.760
   52    H    GLU   7           H        GLU   7  -6.848   1.674  -3.139
   53    HA   GLU   7           HA       GLU   7  -5.043   0.384  -5.149
   54   1HB   GLU   7          1HB       GLU   7  -7.193  -0.690  -4.272
   55   2HB   GLU   7          2HB       GLU   7  -8.068   0.577  -5.133
   56   1HG   GLU   7          1HG       GLU   7  -7.930  -1.367  -6.579
   57   2HG   GLU   7          2HG       GLU   7  -6.871  -0.115  -7.231
   58    H    LYS   8           H        LYS   8  -5.224   1.143  -7.399
   59    HA   LYS   8           HA       LYS   8  -4.939   3.845  -7.886
   60   1HB   LYS   8          1HB       LYS   8  -5.483   3.292 -10.199
   61   2HB   LYS   8          2HB       LYS   8  -4.631   1.928  -9.474
   62   1HG   LYS   8          1HG       LYS   8  -7.115   1.175  -8.860
   63   2HG   LYS   8          2HG       LYS   8  -7.500   2.166 -10.268
   64   1HD   LYS   8          1HD       LYS   8  -5.188   0.472 -10.763
   65   2HD   LYS   8          2HD       LYS   8  -6.600  -0.481 -10.308
   66   1HE   LYS   8          1HE       LYS   8  -6.878   1.730 -12.342
   67   2HE   LYS   8          2HE       LYS   8  -6.292   0.126 -12.834
   68   1HZ   LYS   8          1HZ       LYS   8  -8.582   0.203 -11.032
   69   2HZ   LYS   8          2HZ       LYS   8  -8.870   0.687 -12.635
   70   3HZ   LYS   8          3HZ       LYS   8  -8.246  -0.861 -12.310
   71    H    THR   9           H        THR   9  -7.938   2.129  -7.287
   72    HA   THR   9           HA       THR   9  -9.591   4.445  -8.096
   73    HB   THR   9           HB       THR   9 -11.389   2.878  -7.805
   74    HG1  THR   9           HG1      THR   9  -9.692   0.947  -6.720
   75   1HG2  THR   9          1HG2      THR   9  -9.617   2.489  -9.662
   76   2HG2  THR   9          2HG2      THR   9  -9.125   1.103  -8.687
   77   3HG2  THR   9          3HG2      THR   9 -10.767   1.195  -9.323
   78    H    GLY  10           H        GLY  10  -8.437   2.800  -5.205
   79   1HA   GLY  10          1HA       GLY  10  -8.256   4.506  -3.264
   80   2HA   GLY  10          2HA       GLY  10  -9.991   4.710  -3.514
   81    H    CYS  11           H        CYS  11 -10.000   1.688  -4.228
   82    HA   CYS  11           HA       CYS  11 -10.827   0.746  -1.626
   83   1HB   CYS  11          1HB       CYS  11 -10.052  -0.885  -4.060
   84   2HB   CYS  11          2HB       CYS  11 -11.230  -1.306  -2.818
   85    H    LYS  12           H        LYS  12  -9.777  -1.190  -0.540
   86    HA   LYS  12           HA       LYS  12  -7.014  -0.705   0.041
   87   1HB   LYS  12          1HB       LYS  12  -7.234  -2.739   1.361
   88   2HB   LYS  12          2HB       LYS  12  -8.720  -1.811   1.502
   89   1HG   LYS  12          1HG       LYS  12  -9.771  -3.212  -0.234
   90   2HG   LYS  12          2HG       LYS  12  -8.278  -4.139  -0.387
   91   1HD   LYS  12          1HD       LYS  12  -8.779  -5.396   1.418
   92   2HD   LYS  12          2HD       LYS  12  -9.135  -3.966   2.389
   93   1HE   LYS  12          1HE       LYS  12 -11.217  -4.362   0.412
   94   2HE   LYS  12          2HE       LYS  12 -11.014  -5.820   1.405
   95   1HZ   LYS  12          1HZ       LYS  12 -11.028  -3.113   2.599
   96   2HZ   LYS  12          2HZ       LYS  12 -12.471  -3.974   2.351
   97   3HZ   LYS  12          3HZ       LYS  12 -11.267  -4.604   3.370
   98    H    LYS  13           H        LYS  13  -5.719  -3.089   0.000
   99    HA   LYS  13           HA       LYS  13  -5.790  -4.138  -2.785
  100   1HB   LYS  13          1HB       LYS  13  -4.288  -2.095  -2.594
  101   2HB   LYS  13          2HB       LYS  13  -3.281  -3.034  -1.493
  102   1HG   LYS  13          1HG       LYS  13  -2.373  -4.243  -3.180
  103   2HG   LYS  13          2HG       LYS  13  -3.938  -4.483  -3.957
  104   1HD   LYS  13          1HD       LYS  13  -3.744  -1.997  -4.656
  105   2HD   LYS  13          2HD       LYS  13  -2.035  -2.162  -4.247
  106   1HE   LYS  13          1HE       LYS  13  -3.144  -4.337  -5.940
  107   2HE   LYS  13          2HE       LYS  13  -3.016  -2.747  -6.715
  108   1HZ   LYS  13          1HZ       LYS  13  -0.727  -2.732  -5.486
  109   2HZ   LYS  13          2HZ       LYS  13  -0.904  -4.421  -5.552
  110   3HZ   LYS  13          3HZ       LYS  13  -0.888  -3.510  -6.986
  111    H    THR  14           H        THR  14  -5.619  -6.331  -2.636
  112    HA   THR  14           HA       THR  14  -4.423  -7.509  -0.164
  113    HB   THR  14           HB       THR  14  -6.426  -8.356  -2.255
  114    HG1  THR  14           HG1      THR  14  -7.538  -7.672  -0.609
  115   1HG2  THR  14          1HG2      THR  14  -4.638 -10.098  -0.625
  116   2HG2  THR  14          2HG2      THR  14  -6.336 -10.564  -0.737
  117   3HG2  THR  14          3HG2      THR  14  -5.368 -10.399  -2.202
  118    H    CYS  15           H        CYS  15  -2.818  -9.171  -0.369
  119    HA   CYS  15           HA       CYS  15  -1.632  -9.511  -3.101
  120   1HB   CYS  15          1HB       CYS  15   0.596  -9.394  -1.849
  121   2HB   CYS  15          2HB       CYS  15  -0.296  -7.877  -1.953
  122    H    TYR  16           H        TYR  16  -1.367 -11.657  -3.581
  123    HA   TYR  16           HA       TYR  16  -2.071 -13.722  -1.674
  124   1HB   TYR  16          1HB       TYR  16  -1.525 -13.368  -4.503
  125   2HB   TYR  16          2HB       TYR  16  -0.775 -14.847  -3.901
  126    HD1  TYR  16           HD1      TYR  16  -2.345 -16.213  -2.185
  127    HD2  TYR  16           HD2      TYR  16  -3.726 -13.517  -5.231
  128    HE1  TYR  16           HE1      TYR  16  -4.558 -17.333  -2.171
  129    HE2  TYR  16           HE2      TYR  16  -5.940 -14.638  -5.218
  130    HH   TYR  16           HH       TYR  16  -6.769 -17.053  -4.561
  131    H    LYS  17           H        LYS  17   1.018 -13.039  -3.384
  132    HA   LYS  17           HA       LYS  17   2.525 -14.945  -1.823
  133   1HB   LYS  17          1HB       LYS  17   2.982 -14.038  -4.149
  134   2HB   LYS  17          2HB       LYS  17   3.527 -12.548  -3.377
  135   1HG   LYS  17          1HG       LYS  17   5.536 -13.471  -2.985
  136   2HG   LYS  17          2HG       LYS  17   4.772 -14.751  -2.043
  137   1HD   LYS  17          1HD       LYS  17   4.241 -15.888  -4.267
  138   2HD   LYS  17          2HD       LYS  17   5.334 -14.722  -5.015
  139   1HE   LYS  17          1HE       LYS  17   7.185 -15.792  -4.233
  140   2HE   LYS  17          2HE       LYS  17   6.469 -16.023  -2.625
  141   1HZ   LYS  17          1HZ       LYS  17   4.903 -17.596  -4.081
  142   2HZ   LYS  17          2HZ       LYS  17   6.341 -17.741  -4.972
  143   3HZ   LYS  17          3HZ       LYS  17   6.315 -18.152  -3.325
  144    H    LEU  18           H        LEU  18   2.480 -14.529   0.412
  145    HA   LEU  18           HA       LEU  18   2.699 -11.932   1.618
  146   1HB   LEU  18          1HB       LEU  18   3.027 -14.809   2.427
  147   2HB   LEU  18          2HB       LEU  18   3.468 -13.538   3.569
  148    HG   LEU  18           HG       LEU  18   0.782 -13.714   2.176
  149   1HD1  LEU  18          1HD1      LEU  18   1.207 -15.593   3.787
  150   2HD1  LEU  18          2HD1      LEU  18   1.488 -14.390   5.046
  151   3HD1  LEU  18          3HD1      LEU  18  -0.101 -14.522   4.291
  152   1HD2  LEU  18          1HD2      LEU  18   2.148 -11.702   3.759
  153   2HD2  LEU  18          2HD2      LEU  18   0.607 -11.591   2.910
  154   3HD2  LEU  18          3HD2      LEU  18   0.662 -12.222   4.554
  155    H    GLY  19           H        GLY  19   4.574 -10.915   2.513
  156   1HA   GLY  19          1HA       GLY  19   6.965 -10.977   3.100
  157   2HA   GLY  19          2HA       GLY  19   7.202 -12.141   1.796
  158    H    GLU  20           H        GLU  20   8.925 -10.262   1.473
  159    HA   GLU  20           HA       GLU  20   8.235  -7.732   0.422
  160   1HB   GLU  20          1HB       GLU  20  10.488  -9.676  -0.138
  161   2HB   GLU  20          2HB       GLU  20  10.475  -8.028  -0.768
  162   1HG   GLU  20          1HG       GLU  20   9.965  -8.404   2.153
  163   2HG   GLU  20          2HG       GLU  20  11.618  -8.607   1.573
  164    H    ASN  21           H        ASN  21   6.275  -8.188  -0.894
  165    HA   ASN  21           HA       ASN  21   6.532  -9.811  -3.317
  166   1HB   ASN  21          1HB       ASN  21   4.472  -9.241  -1.789
  167   2HB   ASN  21          2HB       ASN  21   4.382  -7.776  -2.769
  168   1HD2  ASN  21          2HD2      ASN  21   2.765 -10.493  -2.637
  169   2HD2  ASN  21          1HD2      ASN  21   2.609 -10.904  -4.276
  170    H    ASP  22           H        ASP  22   8.273  -8.786  -4.474
  171    HA   ASP  22           HA       ASP  22   8.941  -6.228  -5.047
  172   1HB   ASP  22          1HB       ASP  22   8.641  -8.692  -6.717
  173   2HB   ASP  22          2HB       ASP  22   9.109  -7.194  -7.519
  174    H    PHE  23           H        PHE  23   6.122  -7.864  -6.526
  175    HA   PHE  23           HA       PHE  23   5.248  -5.847  -8.281
  176   1HB   PHE  23          1HB       PHE  23   4.364  -8.245  -7.630
  177   2HB   PHE  23          2HB       PHE  23   3.344  -7.354  -6.499
  178    HD1  PHE  23           HD1      PHE  23   4.516  -6.764 -10.022
  179    HD2  PHE  23           HD2      PHE  23   1.193  -7.044  -7.317
  180    HE1  PHE  23           HE1      PHE  23   2.964  -6.194 -11.869
  181    HE2  PHE  23           HE2      PHE  23  -0.360  -6.474  -9.164
  182    HZ   PHE  23           HZ       PHE  23   0.525  -6.050 -11.442
  183    H    CYS  24           H        CYS  24   3.929  -6.336  -4.992
  184    HA   CYS  24           HA       CYS  24   2.852  -3.644  -4.842
  185   1HB   CYS  24          1HB       CYS  24   1.989  -5.714  -3.695
  186   2HB   CYS  24          2HB       CYS  24   3.418  -5.683  -2.663
  187    H    ASN  25           H        ASN  25   5.828  -5.241  -3.784
  188    HA   ASN  25           HA       ASN  25   6.849  -3.309  -1.981
  189   1HB   ASN  25          1HB       ASN  25   7.712  -5.608  -3.429
  190   2HB   ASN  25          2HB       ASN  25   8.909  -4.347  -3.713
  191   1HD2  ASN  25          2HD2      ASN  25  10.577  -4.632  -2.215
  192   2HD2  ASN  25          1HD2      ASN  25  10.354  -4.969  -0.566
  193    H    ARG  26           H        ARG  26   7.033  -3.464  -5.542
  194    HA   ARG  26           HA       ARG  26   8.604  -1.070  -5.879
  195   1HB   ARG  26          1HB       ARG  26   7.314  -3.110  -7.441
  196   2HB   ARG  26          2HB       ARG  26   6.884  -1.535  -8.107
  197   1HG   ARG  26          1HG       ARG  26   9.741  -2.162  -7.390
  198   2HG   ARG  26          2HG       ARG  26   9.073  -2.674  -8.940
  199   1HD   ARG  26          1HD       ARG  26   8.318   0.057  -8.509
  200   2HD   ARG  26          2HD       ARG  26  10.063  -0.087  -8.234
  201    HE   ARG  26           HE       ARG  26   8.789  -0.229 -10.783
  202   1HH1  ARG  26          1HH1      ARG  26  11.115  -1.960  -8.889
  203   2HH1  ARG  26          2HH1      ARG  26  11.731  -2.844 -10.240
  204   1HH2  ARG  26          1HH2      ARG  26   9.613  -1.360 -12.541
  205   2HH2  ARG  26          2HH2      ARG  26  10.898  -2.498 -12.299
  206    H    GLU  27           H        GLU  27   5.082  -1.696  -6.184
  207    HA   GLU  27           HA       GLU  27   4.207   0.913  -6.761
  208   1HB   GLU  27          1HB       GLU  27   3.115  -1.459  -5.281
  209   2HB   GLU  27          2HB       GLU  27   2.197   0.048  -5.258
  210   1HG   GLU  27          1HG       GLU  27   2.794  -0.088  -7.896
  211   2HG   GLU  27          2HG       GLU  27   2.723  -1.808  -7.514
  212    H    CYS  28           H        CYS  28   5.099  -0.527  -3.637
  213    HA   CYS  28           HA       CYS  28   4.362   1.854  -2.106
  214   1HB   CYS  28          1HB       CYS  28   4.349  -0.522  -1.286
  215   2HB   CYS  28          2HB       CYS  28   6.109  -0.524  -1.393
  216    H    LYS  29           H        LYS  29   7.270   0.548  -3.613
  217    HA   LYS  29           HA       LYS  29   9.044   2.545  -2.380
  218   1HB   LYS  29          1HB       LYS  29   9.296   0.006  -3.468
  219   2HB   LYS  29          2HB       LYS  29   9.978   1.036  -4.727
  220   1HG   LYS  29          1HG       LYS  29  11.868   0.809  -3.443
  221   2HG   LYS  29          2HG       LYS  29  11.144   2.166  -2.579
  222   1HD   LYS  29          1HD       LYS  29  11.146   0.890  -0.724
  223   2HD   LYS  29          2HD       LYS  29   9.927  -0.125  -1.496
  224   1HE   LYS  29          1HE       LYS  29  11.468  -1.749  -2.103
  225   2HE   LYS  29          2HE       LYS  29  12.799  -0.581  -2.234
  226   1HZ   LYS  29          1HZ       LYS  29  12.670  -0.267   0.185
  227   2HZ   LYS  29          2HZ       LYS  29  11.488  -1.484   0.277
  228   3HZ   LYS  29          3HZ       LYS  29  13.066  -1.863  -0.226
  229    H    TRP  30           H        TRP  30   7.251   4.113  -3.462
  230    HA   TRP  30           HA       TRP  30   8.622   5.472  -5.613
  231   1HB   TRP  30          1HB       TRP  30   7.396   4.821  -7.439
  232   2HB   TRP  30          2HB       TRP  30   7.253   3.357  -6.481
  233    HD1  TRP  30           HD1      TRP  30   5.144   4.491  -8.683
  234    HE1  TRP  30           HE1      TRP  30   2.679   4.717  -7.976
  235    HE3  TRP  30           HE3      TRP  30   5.669   4.628  -3.609
  236    HZ2  TRP  30           HZ2      TRP  30   1.134   4.940  -5.592
  237    HZ3  TRP  30           HZ3      TRP  30   3.688   4.847  -2.141
  238    HH2  TRP  30           HH2      TRP  30   1.417   5.001  -3.127
  239    H    LYS  31           H        LYS  31   6.722   7.119  -6.643
  240    HA   LYS  31           HA       LYS  31   5.870   9.251  -5.960
  241   1HB   LYS  31          1HB       LYS  31   4.015   7.655  -6.414
  242   2HB   LYS  31          2HB       LYS  31   4.007   7.214  -4.704
  243   1HG   LYS  31          1HG       LYS  31   2.926   9.106  -4.102
  244   2HG   LYS  31          2HG       LYS  31   3.914  10.109  -5.165
  245   1HD   LYS  31          1HD       LYS  31   2.283   8.474  -6.827
  246   2HD   LYS  31          2HD       LYS  31   1.236   9.171  -5.589
  247   1HE   LYS  31          1HE       LYS  31   1.368  10.714  -7.497
  248   2HE   LYS  31          2HE       LYS  31   2.227  11.431  -6.118
  249   1HZ   LYS  31          1HZ       LYS  31   3.738   9.624  -7.839
  250   2HZ   LYS  31          2HZ       LYS  31   3.366  11.148  -8.485
  251   3HZ   LYS  31          3HZ       LYS  31   4.245  11.031  -7.036
  252    H    HIS  32           H        HIS  32   7.652   9.779  -4.390
  253    HA   HIS  32           HA       HIS  32   8.289  10.574  -2.244
  254   1HB   HIS  32          1HB       HIS  32   5.503   9.830  -1.345
  255   2HB   HIS  32          2HB       HIS  32   6.503  11.175  -0.803
  256    HD1  HIS  32           HD1      HIS  32   7.239  11.935  -3.905
  257    HD2  HIS  32           HD2      HIS  32   3.448  11.634  -2.196
  258    HE1  HIS  32           HE1      HIS  32   5.693  13.353  -5.329
  259    H    ILE  33           H        ILE  33   9.507   9.347  -0.797
  260    HA   ILE  33           HA       ILE  33   8.447   6.624  -0.110
  261    HB   ILE  33           HB       ILE  33  11.352   7.390  -0.409
  262   1HG1  ILE  33          1HG1      ILE  33   9.398   6.374  -2.494
  263   2HG1  ILE  33          2HG1      ILE  33  10.283   7.900  -2.532
  264   1HG2  ILE  33          1HG2      ILE  33   9.840   5.000   0.265
  265   2HG2  ILE  33          2HG2      ILE  33  10.849   4.735  -1.157
  266   3HG2  ILE  33          3HG2      ILE  33  11.579   5.277   0.353
  267   1HD1  ILE  33          1HD1      ILE  33  12.386   6.313  -2.305
  268   2HD1  ILE  33          2HD1      ILE  33  11.283   5.115  -2.984
  269   3HD1  ILE  33          3HD1      ILE  33  11.642   6.592  -3.879
  270    H    GLY  34           H        GLY  34  11.275   8.487   1.047
  271   1HA   GLY  34          1HA       GLY  34  11.793   9.256   3.208
  272   2HA   GLY  34          2HA       GLY  34  10.087   9.076   3.621
  273    H    GLY  35           H        GLY  35  11.758   6.333   2.281
  274   1HA   GLY  35          1HA       GLY  35  12.719   4.443   3.378
  275   2HA   GLY  35          2HA       GLY  35  12.398   5.214   4.931
  276    H    SER  36           H        SER  36   9.862   5.004   2.549
  277    HA   SER  36           HA       SER  36   8.090   3.629   4.361
  278   1HB   SER  36          1HB       SER  36   6.675   4.584   2.887
  279   2HB   SER  36          2HB       SER  36   8.049   5.042   1.884
  280    HG   SER  36           HG       SER  36   6.209   3.423   1.191
  281    H    TYR  37           H        TYR  37   8.791   1.537   4.912
  282    HA   TYR  37           HA       TYR  37   9.757  -0.335   2.859
  283   1HB   TYR  37          1HB       TYR  37  10.006  -0.006   5.614
  284   2HB   TYR  37          2HB       TYR  37   8.951  -1.412   5.468
  285    HD1  TYR  37           HD1      TYR  37  11.746  -0.177   3.304
  286    HD2  TYR  37           HD2      TYR  37  10.261  -3.331   5.811
  287    HE1  TYR  37           HE1      TYR  37  13.705  -1.574   2.703
  288    HE2  TYR  37           HE2      TYR  37  12.219  -4.729   5.209
  289    HH   TYR  37           HH       TYR  37  14.791  -4.002   4.322
  290    H    GLY  38           H        GLY  38   8.275  -1.296   1.519
  291   1HA   GLY  38          1HA       GLY  38   5.549  -1.829   2.620
  292   2HA   GLY  38          2HA       GLY  38   5.889  -1.553   0.913
  293    H    TYR  39           H        TYR  39   4.574  -3.857   2.177
  294    HA   TYR  39           HA       TYR  39   5.795  -5.969   0.666
  295   1HB   TYR  39          1HB       TYR  39   6.567  -7.309   2.670
  296   2HB   TYR  39          2HB       TYR  39   7.526  -5.865   2.355
  297    HD1  TYR  39           HD1      TYR  39   4.513  -6.975   4.296
  298    HD2  TYR  39           HD2      TYR  39   7.916  -4.361   4.093
  299    HE1  TYR  39           HE1      TYR  39   4.006  -6.140   6.575
  300    HE2  TYR  39           HE2      TYR  39   7.413  -3.530   6.374
  301    HH   TYR  39           HH       TYR  39   4.800  -3.567   7.807
  302    H    CYS  40           H        CYS  40   4.583  -8.012   0.948
  303    HA   CYS  40           HA       CYS  40   1.777  -7.571   1.517
  304   1HB   CYS  40          1HB       CYS  40   2.769  -9.094  -0.208
  305   2HB   CYS  40          2HB       CYS  40   3.326 -10.144   1.094
  306    H    TYR  41           H        TYR  41   0.729  -7.834   3.430
  307    HA   TYR  41           HA       TYR  41   1.921  -9.596   5.532
  308   1HB   TYR  41          1HB       TYR  41   2.126  -6.850   5.505
  309   2HB   TYR  41          2HB       TYR  41   0.663  -7.093   6.458
  310    HD1  TYR  41           HD1      TYR  41   4.049  -8.684   6.109
  311    HD2  TYR  41           HD2      TYR  41   0.967  -7.294   8.758
  312    HE1  TYR  41           HE1      TYR  41   5.433  -9.336   8.061
  313    HE2  TYR  41           HE2      TYR  41   2.353  -7.943  10.710
  314    HH   TYR  41           HH       TYR  41   5.598  -8.596  10.528
  315    H    GLY  42           H        GLY  42   0.333 -10.928   6.372
  316   1HA   GLY  42          1HA       GLY  42  -1.811 -11.858   6.645
  317   2HA   GLY  42          2HA       GLY  42  -2.274 -10.217   7.102
  318    H    PHE  43           H        PHE  43  -1.112 -11.385   3.953
  319    HA   PHE  43           HA       PHE  43  -2.098 -11.230   1.816
  320   1HB   PHE  43          1HB       PHE  43  -4.549 -11.614   3.565
  321   2HB   PHE  43          2HB       PHE  43  -4.491 -11.882   1.822
  322    HD1  PHE  43           HD1      PHE  43  -3.100 -13.014   5.080
  323    HD2  PHE  43           HD2      PHE  43  -3.546 -13.871   0.894
  324    HE1  PHE  43           HE1      PHE  43  -2.206 -15.297   5.453
  325    HE2  PHE  43           HE2      PHE  43  -2.650 -16.154   1.267
  326    HZ   PHE  43           HZ       PHE  43  -1.980 -16.868   3.546
  327    H    GLY  44           H        GLY  44  -1.396  -8.783   2.588
  328   1HA   GLY  44          1HA       GLY  44  -3.336  -7.048   1.341
  329   2HA   GLY  44          2HA       GLY  44  -3.281  -6.780   3.085
  330    H    CYS  45           H        CYS  45  -2.297  -5.135   0.686
  331    HA   CYS  45           HA       CYS  45   0.609  -5.084   0.945
  332   1HB   CYS  45          1HB       CYS  45  -1.560  -3.600  -0.477
  333   2HB   CYS  45          2HB       CYS  45   0.002  -2.797  -0.314
  334    H    TYR  46           H        TYR  46   1.521  -4.319   2.810
  335    HA   TYR  46           HA       TYR  46   0.331  -1.858   4.056
  336   1HB   TYR  46          1HB       TYR  46   0.073  -4.067   5.287
  337   2HB   TYR  46          2HB       TYR  46   1.831  -4.110   5.431
  338    HD1  TYR  46           HD1      TYR  46  -1.172  -2.036   6.222
  339    HD2  TYR  46           HD2      TYR  46   2.945  -2.882   7.116
  340    HE1  TYR  46           HE1      TYR  46  -1.296  -0.546   8.199
  341    HE2  TYR  46           HE2      TYR  46   2.821  -1.390   9.094
  342    HH   TYR  46           HH       TYR  46  -0.079   0.530   9.769
  343    H    CYS  47           H        CYS  47   1.855  -0.234   4.626
  344    HA   CYS  47           HA       CYS  47   4.724  -0.849   3.984
  345   1HB   CYS  47          1HB       CYS  47   2.917   1.401   3.100
  346   2HB   CYS  47          2HB       CYS  47   4.671   1.566   3.058
  347    H    GLU  48           H        GLU  48   6.259   0.596   5.051
  348    HA   GLU  48           HA       GLU  48   5.166   2.059   7.428
  349   1HB   GLU  48          1HB       GLU  48   7.488   0.105   7.284
  350   2HB   GLU  48          2HB       GLU  48   7.045   1.035   8.715
  351   1HG   GLU  48          1HG       GLU  48   4.820  -0.030   8.725
  352   2HG   GLU  48          2HG       GLU  48   5.258  -0.964   7.294
  353    H    GLY  49           H        GLY  49   5.698   4.156   6.816
  354   1HA   GLY  49          1HA       GLY  49   7.765   5.651   7.094
  355   2HA   GLY  49          2HA       GLY  49   8.490   4.635   5.852
  356    H    LEU  50           H        LEU  50   5.102   5.531   5.746
  357    HA   LEU  50           HA       LEU  50   5.669   7.071   3.253
  358   1HB   LEU  50          1HB       LEU  50   2.910   6.803   3.479
  359   2HB   LEU  50          2HB       LEU  50   3.961   5.774   2.517
  360    HG   LEU  50           HG       LEU  50   3.352   5.222   5.433
  361   1HD1  LEU  50          1HD1      LEU  50   1.857   4.524   2.925
  362   2HD1  LEU  50          2HD1      LEU  50   1.890   3.373   4.262
  363   3HD1  LEU  50          3HD1      LEU  50   1.226   4.988   4.506
  364   1HD2  LEU  50          1HD2      LEU  50   4.856   3.911   3.226
  365   2HD2  LEU  50          2HD2      LEU  50   5.145   3.857   4.963
  366   3HD2  LEU  50          3HD2      LEU  50   3.890   2.848   4.248
  367    HA   PRO  51           HA       PRO  51   5.018  10.570   6.078
  368   1HB   PRO  51          1HB       PRO  51   5.511  12.264   3.799
  369   2HB   PRO  51          2HB       PRO  51   6.567  11.963   5.183
  370   1HG   PRO  51          1HG       PRO  51   6.887  11.023   2.491
  371   2HG   PRO  51          2HG       PRO  51   7.938  10.724   3.877
  372   1HD   PRO  51          1HD       PRO  51   6.192   8.850   2.560
  373   2HD   PRO  51          2HD       PRO  51   7.220   8.565   3.986
  374    H    ASP  52           H        ASP  52   3.613  12.676   5.627
  375    HA   ASP  52           HA       ASP  52   0.958  11.864   4.938
  376   1HB   ASP  52          1HB       ASP  52   2.410  14.456   5.423
  377   2HB   ASP  52          2HB       ASP  52   0.715  14.474   4.936
  378    H    SER  53           H        SER  53   3.467  13.589   3.091
  379    HA   SER  53           HA       SER  53   2.111  14.542   0.880
  380   1HB   SER  53          1HB       SER  53   4.425  13.048   0.017
  381   2HB   SER  53          2HB       SER  53   4.255  14.788   0.219
  382    HG   SER  53           HG       SER  53   5.797  13.385   1.607
  383    H    THR  54           H        THR  54   2.633  11.169   1.739
  384    HA   THR  54           HA       THR  54   1.630  10.216  -0.882
  385    HB   THR  54           HB       THR  54   2.086   8.375   1.406
  386    HG1  THR  54           HG1      THR  54   3.867   9.339   1.927
  387   1HG2  THR  54          1HG2      THR  54   1.737   7.783  -1.061
  388   2HG2  THR  54          2HG2      THR  54   3.354   8.431  -1.337
  389   3HG2  THR  54          3HG2      THR  54   3.130   7.044  -0.271
  390    H    GLN  55           H        GLN  55  -0.365   9.136  -1.122
  391    HA   GLN  55           HA       GLN  55  -2.376   9.674   1.003
  392   1HB   GLN  55          1HB       GLN  55  -2.859  10.410  -1.263
  393   2HB   GLN  55          2HB       GLN  55  -2.505   8.805  -1.903
  394   1HG   GLN  55          1HG       GLN  55  -4.839   8.769  -1.783
  395   2HG   GLN  55          2HG       GLN  55  -4.386   8.027  -0.248
  396   1HE2  GLN  55          2HE2      GLN  55  -4.483   9.428   1.710
  397   2HE2  GLN  55          1HE2      GLN  55  -5.477  10.804   1.720
  398    H    THR  56           H        THR  56  -2.987   8.019   2.347
  399    HA   THR  56           HA       THR  56  -2.638   5.204   1.362
  400    HB   THR  56           HB       THR  56  -2.327   5.184   4.138
  401    HG1  THR  56           HG1      THR  56  -0.477   7.063   3.382
  402   1HG2  THR  56          1HG2      THR  56  -0.903   4.458   1.818
  403   2HG2  THR  56          2HG2      THR  56   0.217   5.414   2.789
  404   3HG2  THR  56          3HG2      THR  56  -0.548   3.983   3.478
  405    H    TRP  57           H        TRP  57  -3.972   3.652   2.724
  406    HA   TRP  57           HA       TRP  57  -6.742   4.521   2.862
  407   1HB   TRP  57          1HB       TRP  57  -5.464   2.215   2.392
  408   2HB   TRP  57          2HB       TRP  57  -5.686   2.020   4.127
  409    HD1  TRP  57           HD1      TRP  57  -7.991   3.326   1.294
  410    HE1  TRP  57           HE1      TRP  57 -10.279   2.161   1.530
  411    HE3  TRP  57           HE3      TRP  57  -7.057   0.352   5.339
  412    HZ2  TRP  57           HZ2      TRP  57 -11.546   0.227   3.212
  413    HZ3  TRP  57           HZ3      TRP  57  -8.820  -1.140   6.238
  414    HH2  TRP  57           HH2      TRP  57 -11.062  -1.207   5.179
  415    HA   PRO  58           HA       PRO  58  -8.541   4.007   3.872
  416   1HB   PRO  58          1HB       PRO  58 -10.136   5.893   5.243
  417   2HB   PRO  58          2HB       PRO  58 -10.174   4.140   5.446
  418   1HG   PRO  58          1HG       PRO  58  -9.178   6.149   7.287
  419   2HG   PRO  58          2HG       PRO  58  -9.377   4.414   7.550
  420   1HD   PRO  58          1HD       PRO  58  -6.920   5.869   7.139
  421   2HD   PRO  58          2HD       PRO  58  -7.123   4.116   7.390
  422    H    LEU  59           H        LEU  59 -10.046   5.820   2.796
  423    HA   LEU  59           HA       LEU  59  -8.236   8.020   1.886
  424   1HB   LEU  59          1HB       LEU  59 -10.080   6.143   0.676
  425   2HB   LEU  59          2HB       LEU  59 -10.548   7.796   0.276
  426    HG   LEU  59           HG       LEU  59  -8.098   8.198  -0.325
  427   1HD1  LEU  59          1HD1      LEU  59  -7.700   5.768   0.865
  428   2HD1  LEU  59          2HD1      LEU  59  -7.777   5.302  -0.834
  429   3HD1  LEU  59          3HD1      LEU  59  -6.588   6.488  -0.298
  430   1HD2  LEU  59          1HD2      LEU  59 -10.246   7.132  -1.783
  431   2HD2  LEU  59          2HD2      LEU  59  -8.802   7.893  -2.452
  432   3HD2  LEU  59          3HD2      LEU  59  -8.859   6.144  -2.239
  433    HA   PRO  60           HA       PRO  60 -10.764  11.323   3.329
  434   1HB   PRO  60          1HB       PRO  60 -11.724  12.266   0.777
  435   2HB   PRO  60          2HB       PRO  60 -10.433  12.940   1.777
  436   1HG   PRO  60          1HG       PRO  60 -10.173  11.497  -0.690
  437   2HG   PRO  60          2HG       PRO  60  -8.887  12.168   0.316
  438   1HD   PRO  60          1HD       PRO  60  -9.546   9.395  -0.066
  439   2HD   PRO  60          2HD       PRO  60  -8.294  10.077   1.002
  440    H    ASN  61           H        ASN  61 -13.148  12.409   2.413
  441    HA   ASN  61           HA       ASN  61 -15.132  10.579   3.302
  442   1HB   ASN  61          1HB       ASN  61 -16.669  12.307   2.291
  443   2HB   ASN  61          2HB       ASN  61 -15.415  12.991   3.325
  444   1HD2  ASN  61          2HD2      ASN  61 -16.915  13.652   0.499
  445   2HD2  ASN  61          1HD2      ASN  61 -15.641  14.360  -0.372
  446    H    LYS  62           H        LYS  62 -13.545  10.780   0.258
  447    HA   LYS  62           HA       LYS  62 -15.752   9.278  -1.100
  448   1HB   LYS  62          1HB       LYS  62 -14.077  11.428  -1.820
  449   2HB   LYS  62          2HB       LYS  62 -13.499  10.051  -2.756
  450   1HG   LYS  62          1HG       LYS  62 -16.448  10.603  -2.578
  451   2HG   LYS  62          2HG       LYS  62 -15.452  11.512  -3.716
  452   1HD   LYS  62          1HD       LYS  62 -14.907   8.629  -3.757
  453   2HD   LYS  62          2HD       LYS  62 -16.567   9.028  -4.203
  454   1HE   LYS  62          1HE       LYS  62 -15.645   9.362  -6.282
  455   2HE   LYS  62          2HE       LYS  62 -15.175  10.934  -5.604
  456   1HZ   LYS  62          1HZ       LYS  62 -13.514   8.567  -5.063
  457   2HZ   LYS  62          2HZ       LYS  62 -13.359   9.359  -6.558
  458   3HZ   LYS  62          3HZ       LYS  62 -13.067  10.206  -5.118
  459    H    THR  63           H        THR  63 -14.960   7.359   0.277
  460    HA   THR  63           HA       THR  63 -12.422   6.168  -0.741
  461    HB   THR  63           HB       THR  63 -12.846   6.393   1.696
  462    HG1  THR  63           HG1      THR  63 -11.684   4.664   1.706
  463   1HG2  THR  63          1HG2      THR  63 -15.245   4.705   0.986
  464   2HG2  THR  63          2HG2      THR  63 -14.598   4.764   2.626
  465   3HG2  THR  63          3HG2      THR  63 -15.209   6.233   1.866
  466    H    CYS  64           H        CYS  64 -12.974   3.511  -0.343
  467    HA   CYS  64           HA       CYS  64 -14.671   2.880  -2.676
  468   1HB   CYS  64          1HB       CYS  64 -12.328   1.973  -2.054
  469   2HB   CYS  64          2HB       CYS  64 -13.171   0.977  -0.870
  Start of MODEL    4
    1   1H    LYS   1          1H        LYS   1   6.708   4.992  10.034
    2   2H    LYS   1          2H        LYS   1   6.492   5.876  11.468
    3   3H    LYS   1          3H        LYS   1   6.414   4.180  11.494
    4    HA   LYS   1           HA       LYS   1   4.180   5.018  11.604
    5   1HB   LYS   1          1HB       LYS   1   5.032   7.216  10.595
    6   2HB   LYS   1          2HB       LYS   1   4.845   6.447   9.017
    7   1HG   LYS   1          1HG       LYS   1   2.470   5.999  10.579
    8   2HG   LYS   1          2HG       LYS   1   2.840   7.723  10.559
    9   1HD   LYS   1          1HD       LYS   1   2.755   7.838   8.202
   10   2HD   LYS   1          2HD       LYS   1   2.909   6.089   8.025
   11   1HE   LYS   1          1HE       LYS   1   0.580   6.721   7.603
   12   2HE   LYS   1          2HE       LYS   1   0.654   5.854   9.149
   13   1HZ   LYS   1          1HZ       LYS   1   1.241   8.583   9.566
   14   2HZ   LYS   1          2HZ       LYS   1  -0.221   8.463   8.718
   15   3HZ   LYS   1          3HZ       LYS   1  -0.037   7.665  10.205
   16    H    ASP   2           H        ASP   2   2.723   3.522  10.808
   17    HA   ASP   2           HA       ASP   2   3.541   1.986   8.363
   18   1HB   ASP   2          1HB       ASP   2   1.670   1.051  10.543
   19   2HB   ASP   2          2HB       ASP   2   2.645   0.077   9.442
   20    H    GLY   3           H        GLY   3   1.926   1.588   6.780
   21   1HA   GLY   3          1HA       GLY   3  -0.826   2.514   7.289
   22   2HA   GLY   3          2HA       GLY   3   0.061   3.412   6.059
   23    H    TYR   4           H        TYR   4  -2.208   2.111   5.314
   24    HA   TYR   4           HA       TYR   4  -1.244  -0.325   3.854
   25   1HB   TYR   4          1HB       TYR   4  -3.626   0.363   5.408
   26   2HB   TYR   4          2HB       TYR   4  -4.033  -0.271   3.814
   27    HD1  TYR   4           HD1      TYR   4  -2.775  -2.435   3.061
   28    HD2  TYR   4           HD2      TYR   4  -3.064  -1.116   7.140
   29    HE1  TYR   4           HE1      TYR   4  -2.260  -4.733   3.840
   30    HE2  TYR   4           HE2      TYR   4  -2.548  -3.415   7.919
   31    HH   TYR   4           HH       TYR   4  -2.657  -6.108   5.890
   32    H    LEU   5           H        LEU   5  -0.524   0.720   1.951
   33    HA   LEU   5           HA       LEU   5  -1.591   2.891   0.579
   34   1HB   LEU   5          1HB       LEU   5   0.144   0.664   0.110
   35   2HB   LEU   5          2HB       LEU   5  -0.886   0.864  -1.309
   36    HG   LEU   5           HG       LEU   5   0.081   3.420  -0.272
   37   1HD1  LEU   5          1HD1      LEU   5   2.100   1.388  -1.275
   38   2HD1  LEU   5          2HD1      LEU   5   2.423   3.099  -0.992
   39   3HD1  LEU   5          3HD1      LEU   5   2.026   2.041   0.362
   40   1HD2  LEU   5          1HD2      LEU   5  -0.204   1.949  -2.854
   41   2HD2  LEU   5          2HD2      LEU   5  -0.728   3.576  -2.427
   42   3HD2  LEU   5          3HD2      LEU   5   0.967   3.266  -2.804
   43    H    VAL   6           H        VAL   6  -2.915   2.857  -1.470
   44    HA   VAL   6           HA       VAL   6  -5.197   0.917  -1.249
   45    HB   VAL   6           HB       VAL   6  -6.610   2.747  -1.924
   46   1HG1  VAL   6          1HG1      VAL   6  -5.461   2.697   0.455
   47   2HG1  VAL   6          2HG1      VAL   6  -4.691   4.176  -0.119
   48   3HG1  VAL   6          3HG1      VAL   6  -6.449   4.075  -0.026
   49   1HG2  VAL   6          1HG2      VAL   6  -3.999   3.908  -2.776
   50   2HG2  VAL   6          2HG2      VAL   6  -5.570   3.973  -3.573
   51   3HG2  VAL   6          3HG2      VAL   6  -5.230   5.035  -2.208
   52    H    GLU   7           H        GLU   7  -6.427   1.516  -3.651
   53    HA   GLU   7           HA       GLU   7  -4.372   0.642  -5.655
   54   1HB   GLU   7          1HB       GLU   7  -6.276  -0.899  -4.940
   55   2HB   GLU   7          2HB       GLU   7  -7.374   0.240  -5.720
   56   1HG   GLU   7          1HG       GLU   7  -6.603  -0.258  -7.851
   57   2HG   GLU   7          2HG       GLU   7  -5.011  -0.749  -7.271
   58    H    LYS   8           H        LYS   8  -5.076   1.277  -7.974
   59    HA   LYS   8           HA       LYS   8  -5.007   4.005  -8.432
   60   1HB   LYS   8          1HB       LYS   8  -5.977   1.587  -9.865
   61   2HB   LYS   8          2HB       LYS   8  -6.479   3.137 -10.539
   62   1HG   LYS   8          1HG       LYS   8  -4.277   3.822 -10.949
   63   2HG   LYS   8          2HG       LYS   8  -3.604   2.686  -9.780
   64   1HD   LYS   8          1HD       LYS   8  -3.095   1.644 -11.812
   65   2HD   LYS   8          2HD       LYS   8  -4.613   0.863 -11.372
   66   1HE   LYS   8          1HE       LYS   8  -5.628   1.680 -13.224
   67   2HE   LYS   8          2HE       LYS   8  -5.115   3.332 -12.825
   68   1HZ   LYS   8          1HZ       LYS   8  -2.824   2.580 -13.563
   69   2HZ   LYS   8          2HZ       LYS   8  -3.591   1.243 -14.269
   70   3HZ   LYS   8          3HZ       LYS   8  -3.974   2.813 -14.791
   71    H    THR   9           H        THR   9  -8.050   2.125  -8.700
   72    HA   THR   9           HA       THR   9  -9.799   4.364  -8.753
   73    HB   THR   9           HB       THR   9 -11.306   2.361  -7.710
   74    HG1  THR   9           HG1      THR   9  -9.503   1.060  -7.307
   75   1HG2  THR   9          1HG2      THR   9 -10.393   3.166 -10.376
   76   2HG2  THR   9          2HG2      THR   9 -10.923   1.485 -10.302
   77   3HG2  THR   9          3HG2      THR   9 -12.020   2.778  -9.815
   78    H    GLY  10           H        GLY  10  -8.237   2.743  -6.068
   79   1HA   GLY  10          1HA       GLY  10  -8.067   4.281  -4.031
   80   2HA   GLY  10          2HA       GLY  10  -9.820   4.429  -4.173
   81    H    CYS  11           H        CYS  11 -10.354   1.696  -4.856
   82    HA   CYS  11           HA       CYS  11 -10.751   0.489  -2.359
   83   1HB   CYS  11          1HB       CYS  11 -10.504  -0.425  -5.203
   84   2HB   CYS  11          2HB       CYS  11 -10.626  -1.650  -3.942
   85    H    LYS  12           H        LYS  12  -9.416  -0.636  -0.956
   86    HA   LYS  12           HA       LYS  12  -6.625  -0.502  -0.999
   87   1HB   LYS  12          1HB       LYS  12  -6.876  -2.581   0.523
   88   2HB   LYS  12          2HB       LYS  12  -7.741  -1.122   0.999
   89   1HG   LYS  12          1HG       LYS  12  -9.808  -1.994   0.429
   90   2HG   LYS  12          2HG       LYS  12  -9.133  -3.053  -0.809
   91   1HD   LYS  12          1HD       LYS  12  -8.081  -3.755   1.795
   92   2HD   LYS  12          2HD       LYS  12  -9.844  -3.768   1.819
   93   1HE   LYS  12          1HE       LYS  12  -9.269  -4.989  -0.605
   94   2HE   LYS  12          2HE       LYS  12  -8.000  -5.611   0.468
   95   1HZ   LYS  12          1HZ       LYS  12 -10.671  -5.403   1.609
   96   2HZ   LYS  12          2HZ       LYS  12 -10.463  -6.606   0.429
   97   3HZ   LYS  12          3HZ       LYS  12  -9.492  -6.607   1.819
   98    H    LYS  13           H        LYS  13  -5.278  -2.716  -0.973
   99    HA   LYS  13           HA       LYS  13  -5.977  -4.328  -3.399
  100   1HB   LYS  13          1HB       LYS  13  -4.238  -2.309  -3.531
  101   2HB   LYS  13          2HB       LYS  13  -3.145  -3.515  -2.848
  102   1HG   LYS  13          1HG       LYS  13  -3.569  -5.034  -4.686
  103   2HG   LYS  13          2HG       LYS  13  -4.833  -3.981  -5.322
  104   1HD   LYS  13          1HD       LYS  13  -2.849  -2.198  -5.307
  105   2HD   LYS  13          2HD       LYS  13  -1.864  -3.658  -5.428
  106   1HE   LYS  13          1HE       LYS  13  -2.741  -4.239  -7.518
  107   2HE   LYS  13          2HE       LYS  13  -4.239  -3.326  -7.252
  108   1HZ   LYS  13          1HZ       LYS  13  -2.376  -1.416  -6.983
  109   2HZ   LYS  13          2HZ       LYS  13  -1.653  -2.392  -8.168
  110   3HZ   LYS  13          3HZ       LYS  13  -3.200  -1.740  -8.433
  111    H    THR  14           H        THR  14  -5.792  -6.492  -2.959
  112    HA   THR  14           HA       THR  14  -4.294  -7.295  -0.492
  113    HB   THR  14           HB       THR  14  -6.619  -8.456  -2.050
  114    HG1  THR  14           HG1      THR  14  -7.377  -7.009  -0.659
  115   1HG2  THR  14          1HG2      THR  14  -4.668  -9.924  -0.666
  116   2HG2  THR  14          2HG2      THR  14  -6.026  -9.797   0.450
  117   3HG2  THR  14          3HG2      THR  14  -6.266 -10.488  -1.153
  118    H    CYS  15           H        CYS  15  -2.790  -9.024  -0.633
  119    HA   CYS  15           HA       CYS  15  -2.128  -9.926  -3.422
  120   1HB   CYS  15          1HB       CYS  15   0.191  -9.809  -2.796
  121   2HB   CYS  15          2HB       CYS  15  -0.548  -8.307  -2.249
  122    H    TYR  16           H        TYR  16  -1.494 -12.147  -3.630
  123    HA   TYR  16           HA       TYR  16  -2.747 -13.952  -1.725
  124   1HB   TYR  16          1HB       TYR  16  -0.980 -14.364  -4.155
  125   2HB   TYR  16          2HB       TYR  16  -1.898 -15.640  -3.356
  126    HD1  TYR  16           HD1      TYR  16  -4.429 -14.374  -2.687
  127    HD2  TYR  16           HD2      TYR  16  -2.021 -13.939  -6.219
  128    HE1  TYR  16           HE1      TYR  16  -6.446 -13.741  -3.986
  129    HE2  TYR  16           HE2      TYR  16  -4.037 -13.305  -7.515
  130    HH   TYR  16           HH       TYR  16  -6.215 -12.916  -7.450
  131    H    LYS  17           H        LYS  17   0.554 -14.326  -3.022
  132    HA   LYS  17           HA       LYS  17   1.492 -15.667  -0.645
  133   1HB   LYS  17          1HB       LYS  17   2.600 -14.615  -3.216
  134   2HB   LYS  17          2HB       LYS  17   3.744 -15.013  -1.934
  135   1HG   LYS  17          1HG       LYS  17   3.140 -17.275  -1.913
  136   2HG   LYS  17          2HG       LYS  17   1.576 -16.964  -2.667
  137   1HD   LYS  17          1HD       LYS  17   2.439 -17.232  -4.727
  138   2HD   LYS  17          2HD       LYS  17   3.728 -16.075  -4.392
  139   1HE   LYS  17          1HE       LYS  17   4.032 -18.711  -3.060
  140   2HE   LYS  17          2HE       LYS  17   4.202 -18.717  -4.828
  141   1HZ   LYS  17          1HZ       LYS  17   5.521 -16.711  -3.086
  142   2HZ   LYS  17          2HZ       LYS  17   6.281 -18.156  -3.555
  143   3HZ   LYS  17          3HZ       LYS  17   5.822 -17.021  -4.729
  144    H    LEU  18           H        LEU  18   1.360 -14.363   1.215
  145    HA   LEU  18           HA       LEU  18   2.015 -11.572   1.322
  146   1HB   LEU  18          1HB       LEU  18   2.066 -13.720   3.467
  147   2HB   LEU  18          2HB       LEU  18   1.943 -11.983   3.750
  148    HG   LEU  18           HG       LEU  18  -0.050 -13.378   1.975
  149   1HD1  LEU  18          1HD1      LEU  18   0.137 -13.406   4.971
  150   2HD1  LEU  18          2HD1      LEU  18  -1.452 -13.312   4.212
  151   3HD1  LEU  18          3HD1      LEU  18  -0.393 -14.681   3.875
  152   1HD2  LEU  18          1HD2      LEU  18   0.103 -10.876   2.079
  153   2HD2  LEU  18          2HD2      LEU  18  -1.453 -11.496   2.631
  154   3HD2  LEU  18          3HD2      LEU  18  -0.250 -10.964   3.804
  155    H    GLY  19           H        GLY  19   3.861 -11.044   3.158
  156   1HA   GLY  19          1HA       GLY  19   6.161 -11.412   3.841
  157   2HA   GLY  19          2HA       GLY  19   6.332 -12.571   2.528
  158    H    GLU  20           H        GLU  20   8.298 -11.310   2.027
  159    HA   GLU  20           HA       GLU  20   8.269  -8.570   1.212
  160   1HB   GLU  20          1HB       GLU  20  10.417  -9.147   0.207
  161   2HB   GLU  20          2HB       GLU  20  10.255 -10.019   1.733
  162   1HG   GLU  20          1HG       GLU  20   9.084 -11.752  -0.071
  163   2HG   GLU  20          2HG       GLU  20  10.412 -11.064  -1.006
  164    H    ASN  21           H        ASN  21   6.062  -8.823   0.019
  165    HA   ASN  21           HA       ASN  21   6.044 -10.130  -2.578
  166   1HB   ASN  21          1HB       ASN  21   4.137  -9.429  -0.917
  167   2HB   ASN  21          2HB       ASN  21   4.243  -7.870  -1.733
  168   1HD2  ASN  21          2HD2      ASN  21   2.528 -10.696  -1.840
  169   2HD2  ASN  21          1HD2      ASN  21   2.133 -10.733  -3.491
  170    H    ASP  22           H        ASP  22   7.833  -9.276  -3.757
  171    HA   ASP  22           HA       ASP  22   8.837  -6.758  -4.067
  172   1HB   ASP  22          1HB       ASP  22   8.088  -8.773  -6.205
  173   2HB   ASP  22          2HB       ASP  22   9.212  -7.438  -6.455
  174    H    PHE  23           H        PHE  23   5.810  -7.906  -5.620
  175    HA   PHE  23           HA       PHE  23   5.210  -5.616  -7.155
  176   1HB   PHE  23          1HB       PHE  23   3.985  -8.007  -6.377
  177   2HB   PHE  23          2HB       PHE  23   2.894  -6.753  -5.784
  178    HD1  PHE  23           HD1      PHE  23   3.461  -4.615  -7.822
  179    HD2  PHE  23           HD2      PHE  23   2.778  -8.833  -8.269
  180    HE1  PHE  23           HE1      PHE  23   2.635  -4.236 -10.130
  181    HE2  PHE  23           HE2      PHE  23   1.953  -8.454 -10.577
  182    HZ   PHE  23           HZ       PHE  23   1.881  -6.156 -11.507
  183    H    CYS  24           H        CYS  24   4.169  -6.290  -3.777
  184    HA   CYS  24           HA       CYS  24   3.075  -3.654  -3.341
  185   1HB   CYS  24          1HB       CYS  24   4.022  -5.930  -1.582
  186   2HB   CYS  24          2HB       CYS  24   3.334  -4.455  -0.906
  187    H    ASN  25           H        ASN  25   6.187  -5.171  -2.407
  188    HA   ASN  25           HA       ASN  25   7.374  -2.971  -1.084
  189   1HB   ASN  25          1HB       ASN  25   8.296  -5.243  -1.152
  190   2HB   ASN  25          2HB       ASN  25   8.554  -5.112  -2.891
  191   1HD2  ASN  25          2HD2      ASN  25  10.711  -5.615  -1.032
  192   2HD2  ASN  25          1HD2      ASN  25  11.750  -4.274  -1.063
  193    H    ARG  26           H        ARG  26   7.456  -3.838  -4.543
  194    HA   ARG  26           HA       ARG  26   9.024  -1.629  -5.445
  195   1HB   ARG  26          1HB       ARG  26   8.194  -3.873  -6.538
  196   2HB   ARG  26          2HB       ARG  26   6.812  -2.899  -7.044
  197   1HG   ARG  26          1HG       ARG  26   8.592  -1.211  -7.897
  198   2HG   ARG  26          2HG       ARG  26   9.717  -2.566  -7.773
  199   1HD   ARG  26          1HD       ARG  26   8.959  -3.354  -9.754
  200   2HD   ARG  26          2HD       ARG  26   7.335  -3.512  -9.061
  201    HE   ARG  26           HE       ARG  26   7.675  -0.771  -9.558
  202   1HH1  ARG  26          1HH1      ARG  26   7.746  -3.732 -11.337
  203   2HH1  ARG  26          2HH1      ARG  26   7.218  -3.003 -12.816
  204   1HH2  ARG  26          1HH2      ARG  26   6.987   0.187 -11.484
  205   2HH2  ARG  26          2HH2      ARG  26   6.794  -0.790 -12.902
  206    H    GLU  27           H        GLU  27   5.465  -2.050  -5.264
  207    HA   GLU  27           HA       GLU  27   4.801   0.536  -6.313
  208   1HB   GLU  27          1HB       GLU  27   3.331  -1.519  -6.007
  209   2HB   GLU  27          2HB       GLU  27   3.260  -1.118  -4.290
  210   1HG   GLU  27          1HG       GLU  27   2.626   1.290  -5.319
  211   2HG   GLU  27          2HG       GLU  27   2.006   0.260  -6.610
  212    H    CYS  28           H        CYS  28   5.585  -0.611  -3.057
  213    HA   CYS  28           HA       CYS  28   4.859   1.917  -1.772
  214   1HB   CYS  28          1HB       CYS  28   5.518  -0.781  -1.076
  215   2HB   CYS  28          2HB       CYS  28   6.618   0.289  -0.205
  216    H    LYS  29           H        LYS  29   7.489   0.826  -3.628
  217    HA   LYS  29           HA       LYS  29   9.319   2.867  -2.407
  218   1HB   LYS  29          1HB       LYS  29  10.048   0.485  -2.368
  219   2HB   LYS  29          2HB       LYS  29   9.908   0.431  -4.124
  220   1HG   LYS  29          1HG       LYS  29  12.201   0.868  -3.753
  221   2HG   LYS  29          2HG       LYS  29  11.524   2.456  -4.116
  222   1HD   LYS  29          1HD       LYS  29  11.270   1.900  -1.292
  223   2HD   LYS  29          2HD       LYS  29  12.948   1.701  -1.798
  224   1HE   LYS  29          1HE       LYS  29  12.728   3.960  -2.983
  225   2HE   LYS  29          2HE       LYS  29  11.204   4.161  -2.096
  226   1HZ   LYS  29          1HZ       LYS  29  13.418   3.183  -0.510
  227   2HZ   LYS  29          2HZ       LYS  29  13.619   4.768  -1.083
  228   3HZ   LYS  29          3HZ       LYS  29  12.265   4.375  -0.142
  229    H    TRP  30           H        TRP  30   7.291   2.276  -5.042
  230    HA   TRP  30           HA       TRP  30   8.815   3.303  -7.230
  231   1HB   TRP  30          1HB       TRP  30   6.707   3.381  -8.334
  232   2HB   TRP  30          2HB       TRP  30   6.623   2.029  -7.215
  233    HD1  TRP  30           HD1      TRP  30   4.013   3.286  -8.224
  234    HE1  TRP  30           HE1      TRP  30   2.371   4.439  -6.619
  235    HE3  TRP  30           HE3      TRP  30   7.167   4.440  -4.332
  236    HZ2  TRP  30           HZ2      TRP  30   2.370   5.675  -4.059
  237    HZ3  TRP  30           HZ3      TRP  30   6.297   5.598  -2.337
  238    HH2  TRP  30           HH2      TRP  30   3.904   6.220  -2.192
  239    H    LYS  31           H        LYS  31   6.994   5.452  -8.090
  240    HA   LYS  31           HA       LYS  31   7.962   7.607  -6.235
  241   1HB   LYS  31          1HB       LYS  31   7.991   7.211  -9.196
  242   2HB   LYS  31          2HB       LYS  31   7.810   8.858  -8.595
  243   1HG   LYS  31          1HG       LYS  31   9.990   8.960  -8.051
  244   2HG   LYS  31          2HG       LYS  31   9.858   7.483  -7.094
  245   1HD   LYS  31          1HD       LYS  31  11.038   6.394  -8.669
  246   2HD   LYS  31          2HD       LYS  31   9.736   6.700  -9.819
  247   1HE   LYS  31          1HE       LYS  31  10.813   9.041 -10.123
  248   2HE   LYS  31          2HE       LYS  31  12.240   8.325  -9.349
  249   1HZ   LYS  31          1HZ       LYS  31  10.806   7.014 -11.588
  250   2HZ   LYS  31          2HZ       LYS  31  12.115   8.069 -11.840
  251   3HZ   LYS  31          3HZ       LYS  31  12.336   6.629 -10.964
  252    H    HIS  32           H        HIS  32   6.407   8.910  -5.417
  253    HA   HIS  32           HA       HIS  32   4.189  10.018  -6.762
  254   1HB   HIS  32          1HB       HIS  32   3.335   7.780  -7.039
  255   2HB   HIS  32          2HB       HIS  32   3.667   7.383  -5.353
  256    HD1  HIS  32           HD1      HIS  32   1.981  10.515  -6.681
  257    HD2  HIS  32           HD2      HIS  32   1.067   7.180  -4.352
  258    HE1  HIS  32           HE1      HIS  32  -0.341  10.907  -5.751
  259    H    ILE  33           H        ILE  33   4.783   8.393  -3.621
  260    HA   ILE  33           HA       ILE  33   4.023  10.952  -2.250
  261    HB   ILE  33           HB       ILE  33   3.691   8.019  -1.620
  262   1HG1  ILE  33          1HG1      ILE  33   1.910   9.280  -2.838
  263   2HG1  ILE  33          2HG1      ILE  33   1.367   8.684  -1.270
  264   1HG2  ILE  33          1HG2      ILE  33   3.577  10.343   0.325
  265   2HG2  ILE  33          2HG2      ILE  33   2.921   8.741   0.661
  266   3HG2  ILE  33          3HG2      ILE  33   4.654   8.949   0.406
  267   1HD1  ILE  33          1HD1      ILE  33   2.244  11.050  -0.445
  268   2HD1  ILE  33          2HD1      ILE  33   1.960  11.489  -2.130
  269   3HD1  ILE  33          3HD1      ILE  33   0.634  10.878  -1.141
  270    H    GLY  34           H        GLY  34   5.806   8.020  -1.240
  271   1HA   GLY  34          1HA       GLY  34   8.399   8.528  -1.213
  272   2HA   GLY  34          2HA       GLY  34   7.896   9.790  -0.090
  273    H    GLY  35           H        GLY  35   8.134   6.309  -0.551
  274   1HA   GLY  35          1HA       GLY  35   7.594   5.960   2.372
  275   2HA   GLY  35          2HA       GLY  35   7.309   4.702   1.167
  276    H    SER  36           H        SER  36   8.985   4.366   3.479
  277    HA   SER  36           HA       SER  36  11.765   4.488   2.446
  278   1HB   SER  36          1HB       SER  36  12.185   3.653   4.816
  279   2HB   SER  36          2HB       SER  36  11.392   5.221   4.701
  280    HG   SER  36           HG       SER  36  10.390   2.737   5.494
  281    H    TYR  37           H        TYR  37   9.652   1.999   3.944
  282    HA   TYR  37           HA       TYR  37  10.798  -0.022   2.069
  283   1HB   TYR  37          1HB       TYR  37  11.964   0.241   4.396
  284   2HB   TYR  37          2HB       TYR  37  10.525  -0.563   5.022
  285    HD1  TYR  37           HD1      TYR  37  12.974  -0.928   2.193
  286    HD2  TYR  37           HD2      TYR  37  10.565  -2.886   5.163
  287    HE1  TYR  37           HE1      TYR  37  13.895  -3.125   1.493
  288    HE2  TYR  37           HE2      TYR  37  11.484  -5.079   4.463
  289    HH   TYR  37           HH       TYR  37  12.529  -6.011   2.248
  290    H    GLY  38           H        GLY  38   9.140  -1.299   1.287
  291   1HA   GLY  38          1HA       GLY  38   6.660  -1.478   2.946
  292   2HA   GLY  38          2HA       GLY  38   6.573  -1.148   1.218
  293    H    TYR  39           H        TYR  39   5.225  -3.278   2.153
  294    HA   TYR  39           HA       TYR  39   6.202  -5.479   0.595
  295   1HB   TYR  39          1HB       TYR  39   6.860  -6.983   2.407
  296   2HB   TYR  39          2HB       TYR  39   7.803  -5.499   2.545
  297    HD1  TYR  39           HD1      TYR  39   6.901  -3.658   4.102
  298    HD2  TYR  39           HD2      TYR  39   5.539  -7.729   4.211
  299    HE1  TYR  39           HE1      TYR  39   6.017  -3.297   6.390
  300    HE2  TYR  39           HE2      TYR  39   4.655  -7.369   6.500
  301    HH   TYR  39           HH       TYR  39   4.563  -4.177   7.953
  302    H    CYS  40           H        CYS  40   4.806  -7.590   1.559
  303    HA   CYS  40           HA       CYS  40   2.063  -6.450   1.916
  304   1HB   CYS  40          1HB       CYS  40   3.042  -8.103   0.000
  305   2HB   CYS  40          2HB       CYS  40   2.455  -9.293   1.165
  306    H    TYR  41           H        TYR  41   1.067  -6.771   3.827
  307    HA   TYR  41           HA       TYR  41   1.978  -9.045   5.561
  308   1HB   TYR  41          1HB       TYR  41   2.734  -6.707   6.224
  309   2HB   TYR  41          2HB       TYR  41   1.032  -6.305   6.457
  310    HD1  TYR  41           HD1      TYR  41   2.986  -9.411   7.223
  311    HD2  TYR  41           HD2      TYR  41   0.621  -6.172   8.765
  312    HE1  TYR  41           HE1      TYR  41   3.052 -10.436   9.479
  313    HE2  TYR  41           HE2      TYR  41   0.687  -7.200  11.022
  314    HH   TYR  41           HH       TYR  41   1.141 -10.026  11.739
  315    H    GLY  42           H        GLY  42   0.294 -10.313   6.318
  316   1HA   GLY  42          1HA       GLY  42  -1.913 -11.000   6.773
  317   2HA   GLY  42          2HA       GLY  42  -2.398  -9.305   6.671
  318    H    PHE  43           H        PHE  43  -2.442  -8.396   4.377
  319    HA   PHE  43           HA       PHE  43  -2.620 -10.159   2.100
  320   1HB   PHE  43          1HB       PHE  43  -4.965  -9.762   3.864
  321   2HB   PHE  43          2HB       PHE  43  -5.287  -9.600   2.140
  322    HD1  PHE  43           HD1      PHE  43  -3.835 -11.472   0.716
  323    HD2  PHE  43           HD2      PHE  43  -5.349 -11.892   4.711
  324    HE1  PHE  43           HE1      PHE  43  -3.782 -13.940   0.475
  325    HE2  PHE  43           HE2      PHE  43  -5.297 -14.360   4.471
  326    HZ   PHE  43           HZ       PHE  43  -4.513 -15.384   2.353
  327    H    GLY  44           H        GLY  44  -1.303  -7.929   1.918
  328   1HA   GLY  44          1HA       GLY  44  -2.391  -6.349  -0.074
  329   2HA   GLY  44          2HA       GLY  44  -2.934  -5.567   1.410
  330    H    CYS  45           H        CYS  45  -1.147  -4.344  -0.450
  331    HA   CYS  45           HA       CYS  45   1.609  -4.599   0.372
  332   1HB   CYS  45          1HB       CYS  45   0.160  -2.245  -0.883
  333   2HB   CYS  45          2HB       CYS  45   1.879  -2.616  -1.006
  334    H    TYR  46           H        TYR  46   2.381  -3.975   2.337
  335    HA   TYR  46           HA       TYR  46   0.994  -1.739   3.783
  336   1HB   TYR  46          1HB       TYR  46   1.010  -4.161   4.660
  337   2HB   TYR  46          2HB       TYR  46   2.734  -3.924   4.949
  338    HD1  TYR  46           HD1      TYR  46  -0.565  -2.260   5.597
  339    HD2  TYR  46           HD2      TYR  46   3.428  -3.018   6.983
  340    HE1  TYR  46           HE1      TYR  46  -1.078  -1.082   7.718
  341    HE2  TYR  46           HE2      TYR  46   2.917  -1.839   9.104
  342    HH   TYR  46           HH       TYR  46  -0.351  -0.675   9.817
  343    H    CYS  47           H        CYS  47   2.257   0.050   4.270
  344    HA   CYS  47           HA       CYS  47   5.184  -0.159   3.646
  345   1HB   CYS  47          1HB       CYS  47   3.090   1.633   2.903
  346   2HB   CYS  47          2HB       CYS  47   4.237   2.535   3.893
  347    H    GLU  48           H        GLU  48   6.684   0.585   5.172
  348    HA   GLU  48           HA       GLU  48   5.587   1.452   7.829
  349   1HB   GLU  48          1HB       GLU  48   7.635  -0.608   7.029
  350   2HB   GLU  48          2HB       GLU  48   7.703   0.131   8.629
  351   1HG   GLU  48          1HG       GLU  48   4.988  -0.590   8.109
  352   2HG   GLU  48          2HG       GLU  48   6.001  -1.985   7.741
  353    H    GLY  49           H        GLY  49   6.107   3.652   7.642
  354   1HA   GLY  49          1HA       GLY  49   8.128   5.053   8.374
  355   2HA   GLY  49          2HA       GLY  49   8.953   4.311   7.001
  356    H    LEU  50           H        LEU  50   5.603   5.451   7.166
  357    HA   LEU  50           HA       LEU  50   6.120   7.118   4.758
  358   1HB   LEU  50          1HB       LEU  50   3.486   6.486   6.110
  359   2HB   LEU  50          2HB       LEU  50   3.752   6.946   4.432
  360    HG   LEU  50           HG       LEU  50   5.114   4.469   5.403
  361   1HD1  LEU  50          1HD1      LEU  50   2.663   4.525   6.235
  362   2HD1  LEU  50          2HD1      LEU  50   2.229   4.392   4.531
  363   3HD1  LEU  50          3HD1      LEU  50   3.179   3.122   5.300
  364   1HD2  LEU  50          1HD2      LEU  50   4.592   5.790   2.945
  365   2HD2  LEU  50          2HD2      LEU  50   5.407   4.243   3.181
  366   3HD2  LEU  50          3HD2      LEU  50   3.662   4.291   2.923
  367    HA   PRO  51           HA       PRO  51   6.098  10.818   7.221
  368   1HB   PRO  51          1HB       PRO  51   5.092  12.395   5.066
  369   2HB   PRO  51          2HB       PRO  51   6.779  12.198   5.552
  370   1HG   PRO  51          1HG       PRO  51   5.436  11.120   3.219
  371   2HG   PRO  51          2HG       PRO  51   7.154  11.074   3.622
  372   1HD   PRO  51          1HD       PRO  51   5.309   8.888   3.686
  373   2HD   PRO  51          2HD       PRO  51   7.002   8.882   4.238
  374    H    ASP  52           H        ASP  52   4.432  12.618   7.753
  375    HA   ASP  52           HA       ASP  52   1.870  11.424   8.354
  376   1HB   ASP  52          1HB       ASP  52   2.733  14.332   8.397
  377   2HB   ASP  52          2HB       ASP  52   1.448  13.597   9.354
  378    H    SER  53           H        SER  53   3.082  13.339   5.685
  379    HA   SER  53           HA       SER  53   0.399  14.111   4.741
  380   1HB   SER  53          1HB       SER  53   2.494  14.400   2.791
  381   2HB   SER  53          2HB       SER  53   1.670  15.662   3.700
  382    HG   SER  53           HG       SER  53   3.331  15.783   4.986
  383    H    THR  54           H        THR  54   1.827  11.209   4.858
  384    HA   THR  54           HA       THR  54   1.644  10.298   2.095
  385    HB   THR  54           HB       THR  54   1.634   8.640   4.622
  386    HG1  THR  54           HG1      THR  54   3.747  10.060   3.385
  387   1HG2  THR  54          1HG2      THR  54   1.680   7.963   1.942
  388   2HG2  THR  54          2HG2      THR  54   3.387   7.931   2.382
  389   3HG2  THR  54          3HG2      THR  54   2.230   6.934   3.265
  390    H    GLN  55           H        GLN  55  -0.018   9.044   1.176
  391    HA   GLN  55           HA       GLN  55  -2.663   9.212   2.528
  392   1HB   GLN  55          1HB       GLN  55  -2.038   9.920   0.095
  393   2HB   GLN  55          2HB       GLN  55  -2.063   8.192  -0.252
  394   1HG   GLN  55          1HG       GLN  55  -4.253   9.367  -0.691
  395   2HG   GLN  55          2HG       GLN  55  -4.371   8.016   0.440
  396   1HE2  GLN  55          2HE2      GLN  55  -5.597   8.529   2.247
  397   2HE2  GLN  55          1HE2      GLN  55  -5.713  10.071   2.948
  398    H    THR  56           H        THR  56  -3.808   7.316   3.108
  399    HA   THR  56           HA       THR  56  -2.699   4.674   2.331
  400    HB   THR  56           HB       THR  56  -1.418   5.412   4.307
  401    HG1  THR  56           HG1      THR  56  -3.209   3.304   4.397
  402   1HG2  THR  56          1HG2      THR  56  -3.562   6.807   5.042
  403   2HG2  THR  56          2HG2      THR  56  -3.887   5.354   5.986
  404   3HG2  THR  56          3HG2      THR  56  -2.386   6.247   6.231
  405    H    TRP  57           H        TRP  57  -4.178   2.921   2.853
  406    HA   TRP  57           HA       TRP  57  -6.971   3.599   2.611
  407   1HB   TRP  57          1HB       TRP  57  -5.559   1.509   1.889
  408   2HB   TRP  57          2HB       TRP  57  -5.885   0.944   3.526
  409    HD1  TRP  57           HD1      TRP  57  -7.564   1.567   0.189
  410    HE1  TRP  57           HE1      TRP  57  -9.972   0.650   0.269
  411    HE3  TRP  57           HE3      TRP  57  -7.933   0.497   5.165
  412    HZ2  TRP  57           HZ2      TRP  57 -11.812  -0.400   2.191
  413    HZ3  TRP  57           HZ3      TRP  57 -10.021  -0.458   6.094
  414    HH2  TRP  57           HH2      TRP  57 -11.961  -0.906   4.616
  415    HA   PRO  58           HA       PRO  58  -8.814   3.262   2.992
  416   1HB   PRO  58          1HB       PRO  58 -10.798   4.677   4.398
  417   2HB   PRO  58          2HB       PRO  58 -10.787   2.938   4.089
  418   1HG   PRO  58          1HG       PRO  58 -10.392   4.328   6.609
  419   2HG   PRO  58          2HG       PRO  58 -10.580   2.597   6.320
  420   1HD   PRO  58          1HD       PRO  58  -8.151   4.045   6.946
  421   2HD   PRO  58          2HD       PRO  58  -8.350   2.292   6.698
  422    H    LEU  59           H        LEU  59  -9.684   5.319   1.913
  423    HA   LEU  59           HA       LEU  59  -7.831   7.570   2.432
  424   1HB   LEU  59          1HB       LEU  59  -9.321   6.402   0.223
  425   2HB   LEU  59          2HB       LEU  59  -9.559   8.149   0.294
  426    HG   LEU  59           HG       LEU  59  -7.133   8.505   0.339
  427   1HD1  LEU  59          1HD1      LEU  59  -7.157   5.717   1.061
  428   2HD1  LEU  59          2HD1      LEU  59  -6.140   5.949  -0.361
  429   3HD1  LEU  59          3HD1      LEU  59  -5.815   6.859   1.114
  430   1HD2  LEU  59          1HD2      LEU  59  -8.610   7.678  -1.837
  431   2HD2  LEU  59          2HD2      LEU  59  -6.968   8.318  -1.921
  432   3HD2  LEU  59          3HD2      LEU  59  -7.234   6.576  -1.882
  433    HA   PRO  60           HA       PRO  60 -10.560  10.505   4.223
  434   1HB   PRO  60          1HB       PRO  60 -10.884  12.197   1.884
  435   2HB   PRO  60          2HB       PRO  60  -9.941  12.502   3.347
  436   1HG   PRO  60          1HG       PRO  60  -8.947  11.858   0.754
  437   2HG   PRO  60          2HG       PRO  60  -8.015  12.059   2.240
  438   1HD   PRO  60          1HD       PRO  60  -8.536   9.620   0.799
  439   2HD   PRO  60          2HD       PRO  60  -7.617   9.815   2.311
  440    H    ASN  61           H        ASN  61 -12.703  11.951   3.302
  441    HA   ASN  61           HA       ASN  61 -14.819  10.095   3.111
  442   1HB   ASN  61          1HB       ASN  61 -14.745  12.636   3.640
  443   2HB   ASN  61          2HB       ASN  61 -14.884  12.859   1.896
  444   1HD2  ASN  61          2HD2      ASN  61 -16.910  13.420   4.094
  445   2HD2  ASN  61          1HD2      ASN  61 -18.295  12.553   3.636
  446    H    LYS  62           H        LYS  62 -12.626  11.182   0.664
  447    HA   LYS  62           HA       LYS  62 -14.429  10.299  -1.534
  448   1HB   LYS  62          1HB       LYS  62 -11.698  11.620  -1.428
  449   2HB   LYS  62          2HB       LYS  62 -12.553  11.242  -2.925
  450   1HG   LYS  62          1HG       LYS  62 -14.374  12.596  -1.187
  451   2HG   LYS  62          2HG       LYS  62 -12.879  13.530  -1.249
  452   1HD   LYS  62          1HD       LYS  62 -14.499  12.579  -3.630
  453   2HD   LYS  62          2HD       LYS  62 -14.355  14.242  -3.061
  454   1HE   LYS  62          1HE       LYS  62 -12.181  12.507  -4.271
  455   2HE   LYS  62          2HE       LYS  62 -12.783  14.070  -4.859
  456   1HZ   LYS  62          1HZ       LYS  62 -12.105  14.990  -2.643
  457   2HZ   LYS  62          2HZ       LYS  62 -11.283  13.531  -2.357
  458   3HZ   LYS  62          3HZ       LYS  62 -10.816  14.526  -3.648
  459    H    THR  63           H        THR  63 -13.812   8.136   0.009
  460    HA   THR  63           HA       THR  63 -11.360   6.792  -0.819
  461    HB   THR  63           HB       THR  63 -12.446   6.375   1.331
  462    HG1  THR  63           HG1      THR  63 -12.482   4.137   1.205
  463   1HG2  THR  63          1HG2      THR  63 -14.800   6.555  -0.139
  464   2HG2  THR  63          2HG2      THR  63 -14.711   4.849   0.301
  465   3HG2  THR  63          3HG2      THR  63 -14.675   6.087   1.558
  466    H    CYS  64           H        CYS  64 -12.137   4.259  -1.491
  467    HA   CYS  64           HA       CYS  64 -12.608   4.347  -4.280
  468   1HB   CYS  64          1HB       CYS  64 -11.675   2.486  -2.813
  469   2HB   CYS  64          2HB       CYS  64 -13.340   2.096  -2.388
  Start of MODEL    5
    1   1H    LYS   1          1H        LYS   1   5.924   7.181   7.438
    2   2H    LYS   1          2H        LYS   1   5.760   8.428   8.582
    3   3H    LYS   1          3H        LYS   1   6.383   6.922   9.053
    4    HA   LYS   1           HA       LYS   1   4.213   6.765   9.806
    5   1HB   LYS   1          1HB       LYS   1   3.940   9.003   8.354
    6   2HB   LYS   1          2HB       LYS   1   3.090   7.892   7.279
    7   1HG   LYS   1          1HG       LYS   1   1.928   7.116   9.529
    8   2HG   LYS   1          2HG       LYS   1   2.396   8.730  10.069
    9   1HD   LYS   1          1HD       LYS   1   0.121   8.709   9.068
   10   2HD   LYS   1          2HD       LYS   1   1.234   9.734   8.159
   11   1HE   LYS   1          1HE       LYS   1   1.052   8.438   6.299
   12   2HE   LYS   1          2HE       LYS   1   1.250   6.943   7.235
   13   1HZ   LYS   1          1HZ       LYS   1  -1.221   8.583   7.299
   14   2HZ   LYS   1          2HZ       LYS   1  -1.014   7.270   6.242
   15   3HZ   LYS   1          3HZ       LYS   1  -1.000   7.017   7.918
   16    H    ASP   2           H        ASP   2   2.672   5.077   9.322
   17    HA   ASP   2           HA       ASP   2   3.448   3.381   6.975
   18   1HB   ASP   2          1HB       ASP   2   1.948   2.517   9.453
   19   2HB   ASP   2          2HB       ASP   2   2.909   1.523   8.358
   20    H    GLY   3           H        GLY   3   1.924   3.331   5.361
   21   1HA   GLY   3          1HA       GLY   3  -0.940   3.645   6.156
   22   2HA   GLY   3          2HA       GLY   3  -0.288   4.520   4.771
   23    H    TYR   4           H        TYR   4  -2.238   3.162   3.904
   24    HA   TYR   4           HA       TYR   4  -1.230   0.501   2.946
   25   1HB   TYR   4          1HB       TYR   4  -3.818   1.541   3.979
   26   2HB   TYR   4          2HB       TYR   4  -3.930   0.434   2.611
   27    HD1  TYR   4           HD1      TYR   4  -2.615  -1.791   2.773
   28    HD2  TYR   4           HD2      TYR   4  -3.492   0.715   6.149
   29    HE1  TYR   4           HE1      TYR   4  -2.236  -3.711   4.296
   30    HE2  TYR   4           HE2      TYR   4  -3.111  -1.204   7.673
   31    HH   TYR   4           HH       TYR   4  -2.402  -4.446   6.401
   32    H    LEU   5           H        LEU   5  -1.802  -0.008   0.694
   33    HA   LEU   5           HA       LEU   5  -1.870   2.392  -1.029
   34   1HB   LEU   5          1HB       LEU   5  -1.130  -0.449  -1.193
   35   2HB   LEU   5          2HB       LEU   5  -1.959   0.140  -2.634
   36    HG   LEU   5           HG       LEU   5   0.122   1.946  -1.547
   37   1HD1  LEU   5          1HD1      LEU   5   0.667  -0.870  -2.291
   38   2HD1  LEU   5          2HD1      LEU   5   1.695   0.329  -3.075
   39   3HD1  LEU   5          3HD1      LEU   5   1.627   0.241  -1.315
   40   1HD2  LEU   5          1HD2      LEU   5  -1.254   2.198  -3.690
   41   2HD2  LEU   5          2HD2      LEU   5   0.492   2.368  -3.875
   42   3HD2  LEU   5          3HD2      LEU   5  -0.302   0.864  -4.344
   43    H    VAL   6           H        VAL   6  -3.655   2.971  -2.268
   44    HA   VAL   6           HA       VAL   6  -6.173   1.443  -1.757
   45    HB   VAL   6           HB       VAL   6  -7.248   3.590  -2.317
   46   1HG1  VAL   6          1HG1      VAL   6  -6.277   3.102  -0.009
   47   2HG1  VAL   6          2HG1      VAL   6  -4.916   4.124  -0.470
   48   3HG1  VAL   6          3HG1      VAL   6  -6.541   4.804  -0.387
   49   1HG2  VAL   6          1HG2      VAL   6  -4.931   4.047  -3.772
   50   2HG2  VAL   6          2HG2      VAL   6  -6.175   5.250  -3.432
   51   3HG2  VAL   6          3HG2      VAL   6  -4.754   5.132  -2.393
   52    H    GLU   7           H        GLU   7  -7.739   2.116  -3.850
   53    HA   GLU   7           HA       GLU   7  -6.210   1.594  -6.357
   54   1HB   GLU   7          1HB       GLU   7  -7.432  -0.387  -4.825
   55   2HB   GLU   7          2HB       GLU   7  -8.605  -0.057  -6.101
   56   1HG   GLU   7          1HG       GLU   7  -6.677  -0.241  -7.755
   57   2HG   GLU   7          2HG       GLU   7  -5.707  -0.868  -6.422
   58    H    LYS   8           H        LYS   8  -7.981   1.432  -8.218
   59    HA   LYS   8           HA       LYS   8  -9.120   3.872  -8.765
   60   1HB   LYS   8          1HB       LYS   8  -8.973   1.826 -10.214
   61   2HB   LYS   8          2HB       LYS   8 -10.365   1.169  -9.352
   62   1HG   LYS   8          1HG       LYS   8 -11.227   2.204 -11.334
   63   2HG   LYS   8          2HG       LYS   8 -11.616   3.287  -9.996
   64   1HD   LYS   8          1HD       LYS   8 -10.735   4.706 -11.682
   65   2HD   LYS   8          2HD       LYS   8  -9.409   4.483 -10.542
   66   1HE   LYS   8          1HE       LYS   8  -9.364   2.350 -12.497
   67   2HE   LYS   8          2HE       LYS   8  -9.372   3.921 -13.320
   68   1HZ   LYS   8          1HZ       LYS   8  -7.726   4.290 -11.166
   69   2HZ   LYS   8          2HZ       LYS   8  -7.323   2.735 -11.706
   70   3HZ   LYS   8          3HZ       LYS   8  -7.228   4.055 -12.770
   71    H    THR   9           H        THR   9 -11.096   1.164  -7.501
   72    HA   THR   9           HA       THR   9 -13.340   2.821  -6.809
   73    HB   THR   9           HB       THR   9 -13.697   0.619  -5.322
   74    HG1  THR   9           HG1      THR   9 -12.377  -0.981  -5.872
   75   1HG2  THR   9          1HG2      THR   9 -14.466   1.473  -7.824
   76   2HG2  THR   9          2HG2      THR   9 -13.700  -0.075  -8.179
   77   3HG2  THR   9          3HG2      THR   9 -15.043   0.003  -7.039
   78    H    GLY  10           H        GLY  10 -10.367   2.053  -5.149
   79   1HA   GLY  10          1HA       GLY  10  -9.735   3.651  -3.331
   80   2HA   GLY  10          2HA       GLY  10 -11.397   3.518  -2.751
   81    H    CYS  11           H        CYS  11 -10.983   0.493  -3.619
   82    HA   CYS  11           HA       CYS  11 -10.593  -0.526  -0.977
   83   1HB   CYS  11          1HB       CYS  11 -10.738  -1.560  -3.774
   84   2HB   CYS  11          2HB       CYS  11 -10.105  -2.654  -2.542
   85    H    LYS  12           H        LYS  12  -8.737  -2.158  -0.502
   86    HA   LYS  12           HA       LYS  12  -6.182  -0.744  -0.897
   87   1HB   LYS  12          1HB       LYS  12  -6.602  -3.356   0.545
   88   2HB   LYS  12          2HB       LYS  12  -5.487  -2.050   0.934
   89   1HG   LYS  12          1HG       LYS  12  -7.037  -1.394   2.451
   90   2HG   LYS  12          2HG       LYS  12  -7.956  -0.805   1.064
   91   1HD   LYS  12          1HD       LYS  12  -9.555  -2.207   1.933
   92   2HD   LYS  12          2HD       LYS  12  -8.674  -3.396   0.971
   93   1HE   LYS  12          1HE       LYS  12  -8.214  -2.819   3.922
   94   2HE   LYS  12          2HE       LYS  12  -8.989  -4.267   3.249
   95   1HZ   LYS  12          1HZ       LYS  12  -6.951  -4.600   1.900
   96   2HZ   LYS  12          2HZ       LYS  12  -6.209  -3.338   2.765
   97   3HZ   LYS  12          3HZ       LYS  12  -6.684  -4.754   3.570
   98    H    LYS  13           H        LYS  13  -4.256  -2.550  -1.041
   99    HA   LYS  13           HA       LYS  13  -4.770  -4.039  -3.590
  100   1HB   LYS  13          1HB       LYS  13  -2.590  -2.414  -2.435
  101   2HB   LYS  13          2HB       LYS  13  -2.045  -3.888  -3.236
  102   1HG   LYS  13          1HG       LYS  13  -3.419  -3.243  -5.235
  103   2HG   LYS  13          2HG       LYS  13  -3.780  -1.711  -4.438
  104   1HD   LYS  13          1HD       LYS  13  -1.913  -0.993  -5.538
  105   2HD   LYS  13          2HD       LYS  13  -1.069  -1.764  -4.195
  106   1HE   LYS  13          1HE       LYS  13  -1.160  -3.927  -5.630
  107   2HE   LYS  13          2HE       LYS  13  -1.530  -2.839  -6.982
  108   1HZ   LYS  13          1HZ       LYS  13   0.558  -1.786  -5.360
  109   2HZ   LYS  13          2HZ       LYS  13   0.965  -3.339  -5.912
  110   3HZ   LYS  13          3HZ       LYS  13   0.563  -2.119  -7.022
  111    H    THR  14           H        THR  14  -5.436  -6.064  -2.794
  112    HA   THR  14           HA       THR  14  -4.266  -7.385  -0.513
  113    HB   THR  14           HB       THR  14  -5.824  -8.427  -2.901
  114    HG1  THR  14           HG1      THR  14  -7.293  -7.220  -2.032
  115   1HG2  THR  14          1HG2      THR  14  -5.439  -9.559  -0.119
  116   2HG2  THR  14          2HG2      THR  14  -6.501 -10.231  -1.354
  117   3HG2  THR  14          3HG2      THR  14  -4.754 -10.220  -1.602
  118    H    CYS  15           H        CYS  15  -2.962  -9.352  -0.585
  119    HA   CYS  15           HA       CYS  15  -1.396  -9.797  -3.091
  120   1HB   CYS  15          1HB       CYS  15   0.635  -9.896  -1.509
  121   2HB   CYS  15          2HB       CYS  15  -0.033  -8.296  -1.825
  122    H    TYR  16           H        TYR  16  -0.648 -11.980  -3.276
  123    HA   TYR  16           HA       TYR  16  -2.096 -13.918  -1.593
  124   1HB   TYR  16          1HB       TYR  16  -0.164 -14.313  -3.899
  125   2HB   TYR  16          2HB       TYR  16  -1.335 -15.486  -3.294
  126    HD1  TYR  16           HD1      TYR  16  -3.807 -14.928  -3.416
  127    HD2  TYR  16           HD2      TYR  16  -0.802 -12.638  -5.461
  128    HE1  TYR  16           HE1      TYR  16  -5.552 -13.954  -4.885
  129    HE2  TYR  16           HE2      TYR  16  -2.546 -11.662  -6.931
  130    HH   TYR  16           HH       TYR  16  -5.049 -11.247  -6.784
  131    H    LYS  17           H        LYS  17   1.162 -12.668  -1.916
  132    HA   LYS  17           HA       LYS  17   2.209 -14.820  -0.126
  133   1HB   LYS  17          1HB       LYS  17   3.539 -12.674  -1.812
  134   2HB   LYS  17          2HB       LYS  17   4.404 -13.884  -0.865
  135   1HG   LYS  17          1HG       LYS  17   4.104 -15.454  -2.453
  136   2HG   LYS  17          2HG       LYS  17   2.373 -15.120  -2.536
  137   1HD   LYS  17          1HD       LYS  17   2.688 -14.104  -4.516
  138   2HD   LYS  17          2HD       LYS  17   3.700 -12.902  -3.714
  139   1HE   LYS  17          1HE       LYS  17   5.524 -14.847  -3.869
  140   2HE   LYS  17          2HE       LYS  17   4.516 -15.338  -5.246
  141   1HZ   LYS  17          1HZ       LYS  17   5.163 -12.495  -4.898
  142   2HZ   LYS  17          2HZ       LYS  17   6.350 -13.519  -5.547
  143   3HZ   LYS  17          3HZ       LYS  17   4.848 -13.363  -6.326
  144    H    LEU  18           H        LEU  18   1.557 -14.117   1.941
  145    HA   LEU  18           HA       LEU  18   1.666 -11.361   2.811
  146   1HB   LEU  18          1HB       LEU  18   1.628 -13.963   4.374
  147   2HB   LEU  18          2HB       LEU  18   1.162 -12.378   4.990
  148    HG   LEU  18           HG       LEU  18  -0.193 -13.896   2.742
  149   1HD1  LEU  18          1HD1      LEU  18  -0.892 -13.288   5.615
  150   2HD1  LEU  18          2HD1      LEU  18  -2.138 -13.666   4.427
  151   3HD1  LEU  18          3HD1      LEU  18  -0.885 -14.850   4.798
  152   1HD2  LEU  18          1HD2      LEU  18  -0.650 -11.135   3.905
  153   2HD2  LEU  18          2HD2      LEU  18  -0.291 -11.547   2.227
  154   3HD2  LEU  18          3HD2      LEU  18  -1.852 -11.979   2.929
  155    H    GLY  19           H        GLY  19   3.093 -10.586   4.559
  156   1HA   GLY  19          1HA       GLY  19   5.187 -10.207   5.529
  157   2HA   GLY  19          2HA       GLY  19   5.487 -11.933   5.365
  158    H    GLU  20           H        GLU  20   7.400  -9.908   4.984
  159    HA   GLU  20           HA       GLU  20   8.766  -8.852   3.275
  160   1HB   GLU  20          1HB       GLU  20   9.407 -11.227   4.249
  161   2HB   GLU  20          2HB       GLU  20   9.166 -11.735   2.576
  162   1HG   GLU  20          1HG       GLU  20  11.472 -11.146   2.732
  163   2HG   GLU  20          2HG       GLU  20  10.694  -9.787   1.919
  164    H    ASN  21           H        ASN  21   6.306  -8.591   2.061
  165    HA   ASN  21           HA       ASN  21   6.199 -10.055  -0.471
  166   1HB   ASN  21          1HB       ASN  21   4.279  -9.070   0.914
  167   2HB   ASN  21          2HB       ASN  21   4.777  -7.494   0.295
  168   1HD2  ASN  21          2HD2      ASN  21   2.737 -10.106  -0.369
  169   2HD2  ASN  21          1HD2      ASN  21   2.509  -9.834  -2.029
  170    H    ASP  22           H        ASP  22   8.454  -9.478  -1.135
  171    HA   ASP  22           HA       ASP  22   9.404  -6.855  -1.604
  172   1HB   ASP  22          1HB       ASP  22   9.860  -9.583  -2.790
  173   2HB   ASP  22          2HB       ASP  22  10.693  -8.184  -3.470
  174    H    PHE  23           H        PHE  23   7.456  -8.980  -3.712
  175    HA   PHE  23           HA       PHE  23   7.427  -7.574  -6.104
  176   1HB   PHE  23          1HB       PHE  23   6.187  -9.699  -5.323
  177   2HB   PHE  23          2HB       PHE  23   4.919  -8.605  -4.770
  178    HD1  PHE  23           HD1      PHE  23   7.140  -8.424  -7.776
  179    HD2  PHE  23           HD2      PHE  23   3.133  -8.829  -6.282
  180    HE1  PHE  23           HE1      PHE  23   6.260  -8.265 -10.089
  181    HE2  PHE  23           HE2      PHE  23   2.254  -8.670  -8.596
  182    HZ   PHE  23           HZ       PHE  23   3.819  -8.389 -10.499
  183    H    CYS  24           H        CYS  24   4.843  -7.085  -3.674
  184    HA   CYS  24           HA       CYS  24   3.908  -4.618  -4.734
  185   1HB   CYS  24          1HB       CYS  24   2.995  -6.318  -2.942
  186   2HB   CYS  24          2HB       CYS  24   3.850  -5.282  -1.799
  187    H    ASN  25           H        ASN  25   6.360  -5.316  -2.255
  188    HA   ASN  25           HA       ASN  25   6.894  -2.742  -1.275
  189   1HB   ASN  25          1HB       ASN  25   7.987  -4.602  -0.307
  190   2HB   ASN  25          2HB       ASN  25   8.556  -5.190  -1.869
  191   1HD2  ASN  25          2HD2      ASN  25   9.149  -2.759   0.656
  192   2HD2  ASN  25          1HD2      ASN  25  10.693  -2.320   0.105
  193    H    ARG  26           H        ARG  26   8.658  -4.326  -3.976
  194    HA   ARG  26           HA       ARG  26  10.156  -2.173  -4.907
  195   1HB   ARG  26          1HB       ARG  26   9.624  -4.707  -5.711
  196   2HB   ARG  26          2HB       ARG  26   8.728  -3.814  -6.940
  197   1HG   ARG  26          1HG       ARG  26  10.796  -2.448  -7.359
  198   2HG   ARG  26          2HG       ARG  26  11.665  -3.518  -6.260
  199   1HD   ARG  26          1HD       ARG  26  11.830  -5.150  -7.834
  200   2HD   ARG  26          2HD       ARG  26  10.126  -4.977  -8.297
  201    HE   ARG  26           HE       ARG  26  11.372  -2.648  -9.219
  202   1HH1  ARG  26          1HH1      ARG  26  11.727  -6.059  -9.626
  203   2HH1  ARG  26          2HH1      ARG  26  12.367  -5.931 -11.230
  204   1HH2  ARG  26          1HH2      ARG  26  12.205  -2.470 -11.310
  205   2HH2  ARG  26          2HH2      ARG  26  12.634  -3.902 -12.183
  206    H    GLU  27           H        GLU  27   6.789  -2.978  -5.848
  207    HA   GLU  27           HA       GLU  27   6.305  -0.804  -7.591
  208   1HB   GLU  27          1HB       GLU  27   4.792  -2.718  -5.942
  209   2HB   GLU  27          2HB       GLU  27   3.923  -1.215  -6.251
  210   1HG   GLU  27          1HG       GLU  27   3.345  -2.517  -8.111
  211   2HG   GLU  27          2HG       GLU  27   4.701  -1.566  -8.720
  212    H    CYS  28           H        CYS  28   5.693  -0.984  -4.062
  213    HA   CYS  28           HA       CYS  28   4.786   1.686  -3.703
  214   1HB   CYS  28          1HB       CYS  28   5.034  -0.514  -2.175
  215   2HB   CYS  28          2HB       CYS  28   6.463   0.357  -1.618
  216    H    LYS  29           H        LYS  29   7.952   0.459  -4.369
  217    HA   LYS  29           HA       LYS  29   9.150   3.127  -3.684
  218   1HB   LYS  29          1HB       LYS  29   9.797   0.995  -2.397
  219   2HB   LYS  29          2HB       LYS  29  10.582   0.471  -3.887
  220   1HG   LYS  29          1HG       LYS  29  11.942   2.539  -3.890
  221   2HG   LYS  29          2HG       LYS  29  11.174   3.038  -2.383
  222   1HD   LYS  29          1HD       LYS  29  12.757   0.474  -2.743
  223   2HD   LYS  29          2HD       LYS  29  13.387   1.949  -2.008
  224   1HE   LYS  29          1HE       LYS  29  10.819   1.125  -0.847
  225   2HE   LYS  29          2HE       LYS  29  12.105  -0.076  -0.620
  226   1HZ   LYS  29          1HZ       LYS  29  13.516   2.050  -0.141
  227   2HZ   LYS  29          2HZ       LYS  29  12.012   2.729   0.249
  228   3HZ   LYS  29          3HZ       LYS  29  12.567   1.359   1.087
  229    H    TRP  30           H        TRP  30   7.876   2.339  -6.271
  230    HA   TRP  30           HA       TRP  30  10.251   2.089  -8.045
  231   1HB   TRP  30          1HB       TRP  30   8.723   1.287  -9.655
  232   2HB   TRP  30          2HB       TRP  30   8.183   0.604  -8.128
  233    HD1  TRP  30           HD1      TRP  30   6.205   0.872 -10.490
  234    HE1  TRP  30           HE1      TRP  30   4.109   2.345 -10.298
  235    HE3  TRP  30           HE3      TRP  30   7.651   4.061  -6.731
  236    HZ2  TRP  30           HZ2      TRP  30   3.161   4.557  -8.780
  237    HZ3  TRP  30           HZ3      TRP  30   6.119   5.820  -5.943
  238    HH2  TRP  30           HH2      TRP  30   3.877   6.080  -6.962
  239    H    LYS  31           H        LYS  31  10.208   4.627  -6.967
  240    HA   LYS  31           HA       LYS  31  10.389   6.355  -9.147
  241   1HB   LYS  31          1HB       LYS  31   7.672   5.680  -8.556
  242   2HB   LYS  31          2HB       LYS  31   7.901   7.383  -8.179
  243   1HG   LYS  31          1HG       LYS  31   9.195   7.349 -10.513
  244   2HG   LYS  31          2HG       LYS  31   8.128   5.975 -10.805
  245   1HD   LYS  31          1HD       LYS  31   6.371   7.769  -9.729
  246   2HD   LYS  31          2HD       LYS  31   7.474   8.850 -10.581
  247   1HE   LYS  31          1HE       LYS  31   6.376   8.331 -12.497
  248   2HE   LYS  31          2HE       LYS  31   6.995   6.674 -12.339
  249   1HZ   LYS  31          1HZ       LYS  31   4.750   7.487 -10.640
  250   2HZ   LYS  31          2HZ       LYS  31   4.426   7.158 -12.275
  251   3HZ   LYS  31          3HZ       LYS  31   5.117   5.962 -11.286
  252    H    HIS  32           H        HIS  32  11.449   5.933  -6.433
  253    HA   HIS  32           HA       HIS  32  12.032   7.171  -4.485
  254   1HB   HIS  32          1HB       HIS  32  12.960   8.226  -6.760
  255   2HB   HIS  32          2HB       HIS  32  11.944   9.577  -6.264
  256    HD1  HIS  32           HD1      HIS  32  12.552   8.688  -3.111
  257    HD2  HIS  32           HD2      HIS  32  15.254   9.888  -6.052
  258    HE1  HIS  32           HE1      HIS  32  14.606   9.535  -1.895
  259    H    ILE  33           H        ILE  33   9.780   6.925  -3.552
  260    HA   ILE  33           HA       ILE  33   8.066   9.343  -3.805
  261    HB   ILE  33           HB       ILE  33   7.383   6.815  -3.939
  262   1HG1  ILE  33          1HG1      ILE  33   5.194   7.398  -2.759
  263   2HG1  ILE  33          2HG1      ILE  33   5.945   8.936  -2.334
  264   1HG2  ILE  33          1HG2      ILE  33   7.489   7.270  -0.945
  265   2HG2  ILE  33          2HG2      ILE  33   6.690   5.910  -1.730
  266   3HG2  ILE  33          3HG2      ILE  33   8.439   6.095  -1.856
  267   1HD1  ILE  33          1HD1      ILE  33   6.431   8.476  -5.106
  268   2HD1  ILE  33          2HD1      ILE  33   4.715   8.192  -4.809
  269   3HD1  ILE  33          3HD1      ILE  33   5.442   9.739  -4.372
  270    H    GLY  34           H        GLY  34   9.655   7.378  -1.266
  271   1HA   GLY  34          1HA       GLY  34  10.810   9.159   0.355
  272   2HA   GLY  34          2HA       GLY  34   9.123   9.536   0.700
  273    H    GLY  35           H        GLY  35   8.845   6.404   0.088
  274   1HA   GLY  35          1HA       GLY  35   8.932   5.693   2.937
  275   2HA   GLY  35          2HA       GLY  35   8.312   4.676   1.634
  276    H    SER  36           H        SER  36  10.103   3.771   3.708
  277    HA   SER  36           HA       SER  36  12.523   3.130   2.055
  278   1HB   SER  36          1HB       SER  36  13.442   2.924   4.559
  279   2HB   SER  36          2HB       SER  36  13.402   4.473   3.723
  280    HG   SER  36           HG       SER  36  11.990   3.600   5.887
  281    H    TYR  37           H        TYR  37   9.744   1.885   3.414
  282    HA   TYR  37           HA       TYR  37  10.784  -0.878   3.270
  283   1HB   TYR  37          1HB       TYR  37  10.957   0.422   5.650
  284   2HB   TYR  37          2HB       TYR  37   9.320  -0.221   5.774
  285    HD1  TYR  37           HD1      TYR  37  12.893  -1.102   5.384
  286    HD2  TYR  37           HD2      TYR  37   8.903  -2.597   5.939
  287    HE1  TYR  37           HE1      TYR  37  13.808  -3.341   5.934
  288    HE2  TYR  37           HE2      TYR  37   9.819  -4.834   6.491
  289    HH   TYR  37           HH       TYR  37  13.247  -5.352   6.954
  290    H    GLY  38           H        GLY  38   8.969  -2.444   3.281
  291   1HA   GLY  38          1HA       GLY  38   6.230  -1.539   3.455
  292   2HA   GLY  38          2HA       GLY  38   6.739  -1.689   1.772
  293    H    TYR  39           H        TYR  39   5.155  -3.334   4.090
  294    HA   TYR  39           HA       TYR  39   5.870  -5.954   2.852
  295   1HB   TYR  39          1HB       TYR  39   6.066  -6.967   5.039
  296   2HB   TYR  39          2HB       TYR  39   7.093  -5.535   5.028
  297    HD1  TYR  39           HD1      TYR  39   6.005  -3.312   5.874
  298    HD2  TYR  39           HD2      TYR  39   4.448  -7.226   6.710
  299    HE1  TYR  39           HE1      TYR  39   4.748  -2.399   7.809
  300    HE2  TYR  39           HE2      TYR  39   3.192  -6.316   8.645
  301    HH   TYR  39           HH       TYR  39   3.819  -3.606  10.129
  302    H    CYS  40           H        CYS  40   4.097  -7.455   2.862
  303    HA   CYS  40           HA       CYS  40   1.450  -6.181   3.006
  304   1HB   CYS  40          1HB       CYS  40   2.750  -8.280   1.608
  305   2HB   CYS  40          2HB       CYS  40   1.423  -9.017   2.503
  306    H    TYR  41           H        TYR  41   0.057  -6.387   4.704
  307    HA   TYR  41           HA       TYR  41   0.505  -8.595   6.684
  308   1HB   TYR  41          1HB       TYR  41   1.441  -6.340   7.356
  309   2HB   TYR  41          2HB       TYR  41  -0.205  -5.709   7.298
  310    HD1  TYR  41           HD1      TYR  41   0.969  -9.063   8.448
  311    HD2  TYR  41           HD2      TYR  41  -0.731  -5.279   9.564
  312    HE1  TYR  41           HE1      TYR  41   0.560  -9.922  10.738
  313    HE2  TYR  41           HE2      TYR  41  -1.141  -6.137  11.855
  314    HH   TYR  41           HH       TYR  41   0.305  -8.766  13.116
  315    H    GLY  42           H        GLY  42  -1.347  -9.817   6.317
  316   1HA   GLY  42          1HA       GLY  42  -3.667 -10.265   6.637
  317   2HA   GLY  42          2HA       GLY  42  -3.946  -8.531   6.824
  318    H    PHE  43           H        PHE  43  -2.498 -10.497   4.208
  319    HA   PHE  43           HA       PHE  43  -2.866 -10.369   1.874
  320   1HB   PHE  43          1HB       PHE  43  -5.453 -10.564   3.331
  321   2HB   PHE  43          2HB       PHE  43  -5.553 -10.188   1.612
  322    HD1  PHE  43           HD1      PHE  43  -3.753 -12.506   3.949
  323    HD2  PHE  43           HD2      PHE  43  -5.525 -11.947   0.076
  324    HE1  PHE  43           HE1      PHE  43  -3.304 -14.883   3.402
  325    HE2  PHE  43           HE2      PHE  43  -5.074 -14.326  -0.472
  326    HZ   PHE  43           HZ       PHE  43  -3.966 -15.792   1.192
  327    H    GLY  44           H        GLY  44  -1.974  -7.935   2.694
  328   1HA   GLY  44          1HA       GLY  44  -3.241  -6.120   0.817
  329   2HA   GLY  44          2HA       GLY  44  -3.536  -5.647   2.489
  330    H    CYS  45           H        CYS  45  -1.847  -4.363   0.351
  331    HA   CYS  45           HA       CYS  45   0.927  -4.709   1.252
  332   1HB   CYS  45          1HB       CYS  45  -0.545  -2.942  -0.709
  333   2HB   CYS  45          2HB       CYS  45   1.187  -2.777  -0.422
  334    H    TYR  46           H        TYR  46   1.943  -3.474   2.777
  335    HA   TYR  46           HA       TYR  46   0.648  -0.918   3.659
  336   1HB   TYR  46          1HB       TYR  46   0.395  -3.082   5.095
  337   2HB   TYR  46          2HB       TYR  46   2.097  -2.834   5.482
  338    HD1  TYR  46           HD1      TYR  46  -0.880  -0.593   5.061
  339    HD2  TYR  46           HD2      TYR  46   2.391  -1.800   7.563
  340    HE1  TYR  46           HE1      TYR  46  -1.535   1.115   6.732
  341    HE2  TYR  46           HE2      TYR  46   1.740  -0.088   9.238
  342    HH   TYR  46           HH       TYR  46  -0.805   2.261   8.567
  343    H    CYS  47           H        CYS  47   2.117   0.716   3.219
  344    HA   CYS  47           HA       CYS  47   5.040   0.040   3.251
  345   1HB   CYS  47          1HB       CYS  47   3.424   2.265   1.967
  346   2HB   CYS  47          2HB       CYS  47   5.178   2.124   1.857
  347    H    GLU  48           H        GLU  48   6.503   1.564   4.281
  348    HA   GLU  48           HA       GLU  48   5.192   3.341   6.314
  349   1HB   GLU  48          1HB       GLU  48   7.584   1.490   6.550
  350   2HB   GLU  48          2HB       GLU  48   7.061   2.602   7.814
  351   1HG   GLU  48          1HG       GLU  48   4.717   1.373   7.366
  352   2HG   GLU  48          2HG       GLU  48   5.800   0.069   6.877
  353    H    GLY  49           H        GLY  49   6.266   5.328   6.700
  354   1HA   GLY  49          1HA       GLY  49   8.099   6.883   6.503
  355   2HA   GLY  49          2HA       GLY  49   8.818   5.838   5.276
  356    H    LEU  50           H        LEU  50   5.532   6.141   4.667
  357    HA   LEU  50           HA       LEU  50   5.924   7.606   2.229
  358   1HB   LEU  50          1HB       LEU  50   3.431   7.017   3.853
  359   2HB   LEU  50          2HB       LEU  50   3.462   7.452   2.144
  360    HG   LEU  50           HG       LEU  50   5.249   5.366   2.225
  361   1HD1  LEU  50          1HD1      LEU  50   3.700   5.227   4.629
  362   2HD1  LEU  50          2HD1      LEU  50   3.203   3.904   3.574
  363   3HD1  LEU  50          3HD1      LEU  50   4.897   4.077   4.034
  364   1HD2  LEU  50          1HD2      LEU  50   2.741   5.977   1.101
  365   2HD2  LEU  50          2HD2      LEU  50   3.814   4.657   0.637
  366   3HD2  LEU  50          3HD2      LEU  50   2.548   4.385   1.836
  367    HA   PRO  51           HA       PRO  51   5.937  11.690   4.109
  368   1HB   PRO  51          1HB       PRO  51   5.631  12.865   1.517
  369   2HB   PRO  51          2HB       PRO  51   7.116  12.701   2.458
  370   1HG   PRO  51          1HG       PRO  51   6.372  11.285   0.070
  371   2HG   PRO  51          2HG       PRO  51   7.865  11.137   1.002
  372   1HD   PRO  51          1HD       PRO  51   5.675   9.255   0.835
  373   2HD   PRO  51          2HD       PRO  51   7.195   9.091   1.749
  374    H    ASP  52           H        ASP  52   4.456  13.725   3.761
  375    HA   ASP  52           HA       ASP  52   1.691  12.913   4.029
  376   1HB   ASP  52          1HB       ASP  52   3.051  14.890   5.039
  377   2HB   ASP  52          2HB       ASP  52   2.702  15.711   3.518
  378    H    SER  53           H        SER  53   3.668  13.877   1.332
  379    HA   SER  53           HA       SER  53   1.495  14.818  -0.367
  380   1HB   SER  53          1HB       SER  53   3.235  15.120  -1.928
  381   2HB   SER  53          2HB       SER  53   4.062  15.285  -0.382
  382    HG   SER  53           HG       SER  53   5.189  13.857  -1.714
  383    H    THR  54           H        THR  54   2.241  11.753   0.753
  384    HA   THR  54           HA       THR  54   1.494  10.378  -1.785
  385    HB   THR  54           HB       THR  54   2.130   8.960   0.769
  386    HG1  THR  54           HG1      THR  54   4.121  10.170  -0.830
  387   1HG2  THR  54          1HG2      THR  54   2.307   8.542  -2.145
  388   2HG2  THR  54          2HG2      THR  54   3.698   7.950  -1.236
  389   3HG2  THR  54          3HG2      THR  54   2.079   7.366  -0.850
  390    H    GLN  55           H        GLN  55  -0.388   9.105  -1.923
  391    HA   GLN  55           HA       GLN  55  -2.493   9.683   0.089
  392   1HB   GLN  55          1HB       GLN  55  -2.307   8.675  -2.736
  393   2HB   GLN  55          2HB       GLN  55  -3.772   8.345  -1.811
  394   1HG   GLN  55          1HG       GLN  55  -2.589  11.120  -2.064
  395   2HG   GLN  55          2HG       GLN  55  -3.806  10.494  -3.178
  396   1HE2  GLN  55          2HE2      GLN  55  -5.942  10.846  -2.552
  397   2HE2  GLN  55          1HE2      GLN  55  -6.449  11.176  -0.966
  398    H    THR  56           H        THR  56  -3.937   7.735   0.691
  399    HA   THR  56           HA       THR  56  -2.808   5.060   0.500
  400    HB   THR  56           HB       THR  56  -1.210   5.951   2.047
  401    HG1  THR  56           HG1      THR  56  -2.760   4.935   4.028
  402   1HG2  THR  56          1HG2      THR  56  -3.612   7.333   3.139
  403   2HG2  THR  56          2HG2      THR  56  -2.346   6.893   4.286
  404   3HG2  THR  56          3HG2      THR  56  -1.970   7.939   2.916
  405    H    TRP  57           H        TRP  57  -3.956   3.601   2.208
  406    HA   TRP  57           HA       TRP  57  -6.864   4.206   2.129
  407   1HB   TRP  57          1HB       TRP  57  -5.530   2.048   1.428
  408   2HB   TRP  57          2HB       TRP  57  -5.512   1.708   3.154
  409    HD1  TRP  57           HD1      TRP  57  -8.039   2.429   0.328
  410    HE1  TRP  57           HE1      TRP  57 -10.246   1.223   0.895
  411    HE3  TRP  57           HE3      TRP  57  -6.866   0.564   4.936
  412    HZ2  TRP  57           HZ2      TRP  57 -11.366  -0.328   3.023
  413    HZ3  TRP  57           HZ3      TRP  57  -8.521  -0.771   6.211
  414    HH2  TRP  57           HH2      TRP  57 -10.766  -1.220   5.260
  415    HA   PRO  58           HA       PRO  58  -8.569   3.502   3.030
  416   1HB   PRO  58          1HB       PRO  58 -10.478   4.749   4.638
  417   2HB   PRO  58          2HB       PRO  58 -10.097   3.023   4.645
  418   1HG   PRO  58          1HG       PRO  58  -9.528   5.023   6.688
  419   2HG   PRO  58          2HG       PRO  58  -9.379   3.265   6.784
  420   1HD   PRO  58          1HD       PRO  58  -7.260   5.217   6.495
  421   2HD   PRO  58          2HD       PRO  58  -7.110   3.445   6.623
  422    H    LEU  59           H        LEU  59 -10.279   5.072   2.119
  423    HA   LEU  59           HA       LEU  59  -9.006   7.676   1.519
  424   1HB   LEU  59          1HB       LEU  59 -11.433   6.145   0.506
  425   2HB   LEU  59          2HB       LEU  59 -10.869   7.653  -0.197
  426    HG   LEU  59           HG       LEU  59  -8.602   5.966   0.009
  427   1HD1  LEU  59          1HD1      LEU  59 -11.056   4.601  -1.130
  428   2HD1  LEU  59          2HD1      LEU  59  -9.405   4.073  -1.453
  429   3HD1  LEU  59          3HD1      LEU  59 -10.038   4.031   0.192
  430   1HD2  LEU  59          1HD2      LEU  59 -10.322   7.031  -2.230
  431   2HD2  LEU  59          2HD2      LEU  59  -8.705   7.543  -1.745
  432   3HD2  LEU  59          3HD2      LEU  59  -8.933   6.001  -2.571
  433    HA   PRO  60           HA       PRO  60 -11.556  10.354   3.951
  434   1HB   PRO  60          1HB       PRO  60 -13.170  11.320   1.703
  435   2HB   PRO  60          2HB       PRO  60 -12.010  12.199   2.706
  436   1HG   PRO  60          1HG       PRO  60 -11.617  11.356   0.041
  437   2HG   PRO  60          2HG       PRO  60 -10.386  11.993   1.135
  438   1HD   PRO  60          1HD       PRO  60 -10.656   9.297   0.144
  439   2HD   PRO  60          2HD       PRO  60  -9.393   9.941   1.213
  440    H    ASN  61           H        ASN  61 -14.180  11.057   3.940
  441    HA   ASN  61           HA       ASN  61 -15.636   8.952   4.974
  442   1HB   ASN  61          1HB       ASN  61 -16.619  11.246   3.241
  443   2HB   ASN  61          2HB       ASN  61 -17.625  10.313   4.349
  444   1HD2  ASN  61          2HD2      ASN  61 -15.153  12.812   4.161
  445   2HD2  ASN  61          1HD2      ASN  61 -15.159  13.205   5.812
  446    H    LYS  62           H        LYS  62 -15.053   9.695   1.600
  447    HA   LYS  62           HA       LYS  62 -16.976   7.684   0.619
  448   1HB   LYS  62          1HB       LYS  62 -16.062   9.963  -0.408
  449   2HB   LYS  62          2HB       LYS  62 -14.796   8.909  -1.040
  450   1HG   LYS  62          1HG       LYS  62 -16.182   8.071  -2.605
  451   2HG   LYS  62          2HG       LYS  62 -17.410   7.703  -1.394
  452   1HD   LYS  62          1HD       LYS  62 -18.565   9.632  -1.786
  453   2HD   LYS  62          2HD       LYS  62 -17.097  10.573  -2.056
  454   1HE   LYS  62          1HE       LYS  62 -16.856   9.357  -4.284
  455   2HE   LYS  62          2HE       LYS  62 -18.499   8.737  -4.022
  456   1HZ   LYS  62          1HZ       LYS  62 -18.051  11.583  -3.550
  457   2HZ   LYS  62          2HZ       LYS  62 -18.057  11.071  -5.171
  458   3HZ   LYS  62          3HZ       LYS  62 -19.412  10.794  -4.185
  459    H    THR  63           H        THR  63 -15.949   5.882   1.901
  460    HA   THR  63           HA       THR  63 -13.281   4.986   0.967
  461    HB   THR  63           HB       THR  63 -15.212   3.814   2.995
  462    HG1  THR  63           HG1      THR  63 -13.410   4.967   4.312
  463   1HG2  THR  63          1HG2      THR  63 -12.289   3.396   2.370
  464   2HG2  THR  63          2HG2      THR  63 -12.971   2.981   3.943
  465   3HG2  THR  63          3HG2      THR  63 -13.567   2.186   2.485
  466    H    CYS  64           H        CYS  64 -13.176   2.475   0.615
  467    HA   CYS  64           HA       CYS  64 -14.830   1.805  -1.672
  468   1HB   CYS  64          1HB       CYS  64 -12.376   1.170  -0.946
  469   2HB   CYS  64          2HB       CYS  64 -13.173  -0.152  -0.096
  Start of MODEL    6
    1   1H    LYS   1          1H        LYS   1   5.728   6.961   8.271
    2   2H    LYS   1          2H        LYS   1   4.371   7.983   8.225
    3   3H    LYS   1          3H        LYS   1   5.509   8.143   9.472
    4    HA   LYS   1           HA       LYS   1   4.820   6.213  10.550
    5   1HB   LYS   1          1HB       LYS   1   2.419   6.611  10.770
    6   2HB   LYS   1          2HB       LYS   1   3.234   8.159  10.544
    7   1HG   LYS   1          1HG       LYS   1   2.492   8.376   8.330
    8   2HG   LYS   1          2HG       LYS   1   2.181   6.647   8.164
    9   1HD   LYS   1          1HD       LYS   1   0.345   6.882   9.868
   10   2HD   LYS   1          2HD       LYS   1   0.592   8.628   9.818
   11   1HE   LYS   1          1HE       LYS   1  -1.259   7.761   8.288
   12   2HE   LYS   1          2HE       LYS   1  -0.006   8.712   7.466
   13   1HZ   LYS   1          1HZ       LYS   1   0.370   5.817   7.806
   14   2HZ   LYS   1          2HZ       LYS   1  -0.644   6.371   6.565
   15   3HZ   LYS   1          3HZ       LYS   1   0.985   6.849   6.604
   16    H    ASP   2           H        ASP   2   2.735   4.528  10.254
   17    HA   ASP   2           HA       ASP   2   3.416   3.002   7.768
   18   1HB   ASP   2          1HB       ASP   2   2.501   2.335  10.566
   19   2HB   ASP   2          2HB       ASP   2   2.284   1.164   9.265
   20    H    GLY   3           H        GLY   3   1.739   2.458   6.342
   21   1HA   GLY   3          1HA       GLY   3  -1.060   2.660   7.157
   22   2HA   GLY   3          2HA       GLY   3  -0.561   3.941   6.052
   23    H    TYR   4           H        TYR   4  -2.330   2.714   4.779
   24    HA   TYR   4           HA       TYR   4  -1.079   0.463   3.237
   25   1HB   TYR   4          1HB       TYR   4  -3.829   1.076   4.251
   26   2HB   TYR   4          2HB       TYR   4  -3.680   0.148   2.760
   27    HD1  TYR   4           HD1      TYR   4  -2.545  -2.055   2.749
   28    HD2  TYR   4           HD2      TYR   4  -3.149   0.154   6.386
   29    HE1  TYR   4           HE1      TYR   4  -2.056  -4.095   4.072
   30    HE2  TYR   4           HE2      TYR   4  -2.659  -1.887   7.706
   31    HH   TYR   4           HH       TYR   4  -1.675  -4.910   6.118
   32    H    LEU   5           H        LEU   5  -1.423   0.508   0.921
   33    HA   LEU   5           HA       LEU   5  -1.856   3.256  -0.150
   34   1HB   LEU   5          1HB       LEU   5  -0.393   0.785  -0.918
   35   2HB   LEU   5          2HB       LEU   5  -1.047   1.739  -2.248
   36    HG   LEU   5           HG       LEU   5   0.811   2.724  -0.065
   37   1HD1  LEU   5          1HD1      LEU   5   1.535   1.341  -2.229
   38   2HD1  LEU   5          2HD1      LEU   5   1.358   2.918  -2.997
   39   3HD1  LEU   5          3HD1      LEU   5   2.486   2.711  -1.658
   40   1HD2  LEU   5          1HD2      LEU   5  -1.125   4.131  -1.664
   41   2HD2  LEU   5          2HD2      LEU   5   0.009   4.789  -0.484
   42   3HD2  LEU   5          3HD2      LEU   5   0.495   4.609  -2.170
   43    H    VAL   6           H        VAL   6  -3.590   3.707  -1.478
   44    HA   VAL   6           HA       VAL   6  -5.649   1.589  -1.781
   45    HB   VAL   6           HB       VAL   6  -7.083   3.534  -2.318
   46   1HG1  VAL   6          1HG1      VAL   6  -5.778   2.981   0.119
   47   2HG1  VAL   6          2HG1      VAL   6  -5.799   4.737  -0.033
   48   3HG1  VAL   6          3HG1      VAL   6  -7.308   3.828  -0.103
   49   1HG2  VAL   6          1HG2      VAL   6  -5.077   4.762  -3.424
   50   2HG2  VAL   6          2HG2      VAL   6  -6.231   5.735  -2.511
   51   3HG2  VAL   6          3HG2      VAL   6  -4.684   5.291  -1.788
   52    H    GLU   7           H        GLU   7  -6.948   2.106  -4.034
   53    HA   GLU   7           HA       GLU   7  -4.858   1.950  -6.185
   54   1HB   GLU   7          1HB       GLU   7  -7.529   0.594  -5.756
   55   2HB   GLU   7          2HB       GLU   7  -6.692   0.551  -7.308
   56   1HG   GLU   7          1HG       GLU   7  -4.908  -0.095  -5.092
   57   2HG   GLU   7          2HG       GLU   7  -6.281  -1.199  -5.176
   58    H    LYS   8           H        LYS   8  -5.998   2.431  -8.425
   59    HA   LYS   8           HA       LYS   8  -6.577   5.112  -8.730
   60   1HB   LYS   8          1HB       LYS   8  -6.721   2.717 -10.233
   61   2HB   LYS   8          2HB       LYS   8  -8.261   3.541 -10.477
   62   1HG   LYS   8          1HG       LYS   8  -6.694   4.330 -12.156
   63   2HG   LYS   8          2HG       LYS   8  -6.993   5.636 -11.009
   64   1HD   LYS   8          1HD       LYS   8  -4.617   5.558 -11.356
   65   2HD   LYS   8          2HD       LYS   8  -4.920   4.869  -9.762
   66   1HE   LYS   8          1HE       LYS   8  -5.108   2.752 -11.688
   67   2HE   LYS   8          2HE       LYS   8  -3.587   3.628 -11.954
   68   1HZ   LYS   8          1HZ       LYS   8  -3.604   3.615  -9.332
   69   2HZ   LYS   8          2HZ       LYS   8  -4.520   2.205  -9.572
   70   3HZ   LYS   8          3HZ       LYS   8  -2.952   2.323 -10.216
   71    H    THR   9           H        THR   9  -9.096   2.567  -8.427
   72    HA   THR   9           HA       THR   9 -11.249   4.478  -8.137
   73    HB   THR   9           HB       THR   9 -12.351   2.240  -7.275
   74    HG1  THR   9           HG1      THR   9 -11.153   0.467  -7.637
   75   1HG2  THR   9          1HG2      THR   9 -11.201   2.586 -10.058
   76   2HG2  THR   9          2HG2      THR   9 -12.491   1.459  -9.637
   77   3HG2  THR   9          3HG2      THR   9 -12.752   3.196  -9.483
   78    H    GLY  10           H        GLY  10  -9.125   2.806  -5.877
   79   1HA   GLY  10          1HA       GLY  10  -8.866   4.213  -3.737
   80   2HA   GLY  10          2HA       GLY  10 -10.620   4.081  -3.624
   81    H    CYS  11           H        CYS  11 -10.286   1.224  -4.770
   82    HA   CYS  11           HA       CYS  11 -10.487  -0.206  -2.338
   83   1HB   CYS  11          1HB       CYS  11  -9.984  -0.809  -5.218
   84   2HB   CYS  11          2HB       CYS  11  -9.696  -2.109  -4.060
   85    H    LYS  12           H        LYS  12  -8.764  -2.248  -2.149
   86    HA   LYS  12           HA       LYS  12  -6.163  -0.920  -1.551
   87   1HB   LYS  12          1HB       LYS  12  -7.448  -3.511  -0.634
   88   2HB   LYS  12          2HB       LYS  12  -5.936  -2.856  -0.020
   89   1HG   LYS  12          1HG       LYS  12  -7.138  -0.814   0.724
   90   2HG   LYS  12          2HG       LYS  12  -8.651  -1.525   0.162
   91   1HD   LYS  12          1HD       LYS  12  -8.618  -2.065   2.458
   92   2HD   LYS  12          2HD       LYS  12  -8.023  -3.533   1.680
   93   1HE   LYS  12          1HE       LYS  12  -5.776  -3.091   2.285
   94   2HE   LYS  12          2HE       LYS  12  -6.116  -1.381   2.620
   95   1HZ   LYS  12          1HZ       LYS  12  -7.872  -2.502   4.231
   96   2HZ   LYS  12          2HZ       LYS  12  -6.709  -3.740   4.235
   97   3HZ   LYS  12          3HZ       LYS  12  -6.280  -2.174   4.726
   98    H    LYS  13           H        LYS  13  -4.467  -3.014  -1.439
   99    HA   LYS  13           HA       LYS  13  -4.474  -4.209  -4.195
  100   1HB   LYS  13          1HB       LYS  13  -2.169  -3.198  -2.491
  101   2HB   LYS  13          2HB       LYS  13  -2.020  -3.881  -4.110
  102   1HG   LYS  13          1HG       LYS  13  -3.889  -1.959  -4.564
  103   2HG   LYS  13          2HG       LYS  13  -2.958  -1.199  -3.272
  104   1HD   LYS  13          1HD       LYS  13  -1.776  -2.364  -5.811
  105   2HD   LYS  13          2HD       LYS  13  -2.045  -0.646  -5.516
  106   1HE   LYS  13          1HE       LYS  13  -0.484  -0.668  -3.640
  107   2HE   LYS  13          2HE       LYS  13  -0.293  -2.426  -3.781
  108   1HZ   LYS  13          1HZ       LYS  13   0.071  -0.973  -6.252
  109   2HZ   LYS  13          2HZ       LYS  13   1.243  -0.632  -5.073
  110   3HZ   LYS  13          3HZ       LYS  13   0.997  -2.233  -5.587
  111    H    THR  14           H        THR  14  -5.560  -6.053  -2.947
  112    HA   THR  14           HA       THR  14  -4.360  -7.483  -0.822
  113    HB   THR  14           HB       THR  14  -6.050  -8.356  -3.183
  114    HG1  THR  14           HG1      THR  14  -6.572  -7.510  -0.536
  115   1HG2  THR  14          1HG2      THR  14  -5.202  -9.801  -0.676
  116   2HG2  THR  14          2HG2      THR  14  -6.694 -10.219  -1.518
  117   3HG2  THR  14          3HG2      THR  14  -5.143 -10.372  -2.343
  118    H    CYS  15           H        CYS  15  -3.218  -9.580  -0.929
  119    HA   CYS  15           HA       CYS  15  -1.817 -10.314  -3.411
  120   1HB   CYS  15          1HB       CYS  15   0.422  -9.960  -2.230
  121   2HB   CYS  15          2HB       CYS  15  -0.426  -8.490  -2.706
  122    H    TYR  16           H        TYR  16  -1.612 -12.516  -3.349
  123    HA   TYR  16           HA       TYR  16  -2.339 -14.049  -1.012
  124   1HB   TYR  16          1HB       TYR  16  -1.058 -14.692  -3.682
  125   2HB   TYR  16          2HB       TYR  16  -1.566 -15.931  -2.533
  126    HD1  TYR  16           HD1      TYR  16  -4.062 -15.264  -1.486
  127    HD2  TYR  16           HD2      TYR  16  -2.571 -14.347  -5.410
  128    HE1  TYR  16           HE1      TYR  16  -6.388 -15.081  -2.329
  129    HE2  TYR  16           HE2      TYR  16  -4.895 -14.165  -6.251
  130    HH   TYR  16           HH       TYR  16  -7.594 -15.228  -4.440
  131    H    LYS  17           H        LYS  17   0.794 -13.567  -2.695
  132    HA   LYS  17           HA       LYS  17   2.294 -15.031  -0.673
  133   1HB   LYS  17          1HB       LYS  17   2.695 -13.670  -3.230
  134   2HB   LYS  17          2HB       LYS  17   4.037 -13.401  -2.118
  135   1HG   LYS  17          1HG       LYS  17   2.920 -16.169  -2.500
  136   2HG   LYS  17          2HG       LYS  17   4.089 -15.515  -3.647
  137   1HD   LYS  17          1HD       LYS  17   5.680 -16.242  -2.211
  138   2HD   LYS  17          2HD       LYS  17   5.207 -14.885  -1.187
  139   1HE   LYS  17          1HE       LYS  17   3.926 -16.229   0.229
  140   2HE   LYS  17          2HE       LYS  17   3.641 -17.450  -1.026
  141   1HZ   LYS  17          1HZ       LYS  17   6.120 -17.813  -0.990
  142   2HZ   LYS  17          2HZ       LYS  17   6.157 -16.905   0.446
  143   3HZ   LYS  17          3HZ       LYS  17   5.281 -18.360   0.379
  144    H    LEU  18           H        LEU  18   1.146 -13.559   1.080
  145    HA   LEU  18           HA       LEU  18   1.959 -10.836   1.441
  146   1HB   LEU  18          1HB       LEU  18   1.180 -13.011   3.416
  147   2HB   LEU  18          2HB       LEU  18   1.210 -11.286   3.780
  148    HG   LEU  18           HG       LEU  18  -0.381 -12.308   1.441
  149   1HD1  LEU  18          1HD1      LEU  18  -0.807 -13.209   4.038
  150   2HD1  LEU  18          2HD1      LEU  18  -1.922 -11.850   3.883
  151   3HD1  LEU  18          3HD1      LEU  18  -2.004 -13.193   2.742
  152   1HD2  LEU  18          1HD2      LEU  18   0.129  -9.834   1.934
  153   2HD2  LEU  18          2HD2      LEU  18  -1.566 -10.259   1.700
  154   3HD2  LEU  18          3HD2      LEU  18  -0.937 -10.011   3.329
  155    H    GLY  19           H        GLY  19   3.400 -10.252   3.468
  156   1HA   GLY  19          1HA       GLY  19   5.383 -10.765   4.790
  157   2HA   GLY  19          2HA       GLY  19   5.687 -12.136   3.727
  158    H    GLU  20           H        GLU  20   7.846 -11.333   3.432
  159    HA   GLU  20           HA       GLU  20   8.529  -8.752   2.409
  160   1HB   GLU  20          1HB       GLU  20  10.642  -9.852   1.872
  161   2HB   GLU  20          2HB       GLU  20  10.042 -10.504   3.398
  162   1HG   GLU  20          1HG       GLU  20  10.006 -12.576   2.521
  163   2HG   GLU  20          2HG       GLU  20   8.919 -12.030   1.244
  164    H    ASN  21           H        ASN  21   6.440  -8.885   0.886
  165    HA   ASN  21           HA       ASN  21   6.741 -10.369  -1.607
  166   1HB   ASN  21          1HB       ASN  21   4.594  -9.728  -0.476
  167   2HB   ASN  21          2HB       ASN  21   4.945  -8.041  -0.852
  168   1HD2  ASN  21          2HD2      ASN  21   2.983 -10.375  -1.922
  169   2HD2  ASN  21          1HD2      ASN  21   3.017 -10.089  -3.596
  170    H    ASP  22           H        ASP  22   8.761  -9.639  -2.509
  171    HA   ASP  22           HA       ASP  22   9.720  -7.025  -2.773
  172   1HB   ASP  22          1HB       ASP  22  10.247  -9.599  -3.775
  173   2HB   ASP  22          2HB       ASP  22  10.071  -8.580  -5.206
  174    H    PHE  23           H        PHE  23   7.444  -8.728  -4.946
  175    HA   PHE  23           HA       PHE  23   7.095  -6.758  -6.924
  176   1HB   PHE  23          1HB       PHE  23   6.135  -9.043  -6.909
  177   2HB   PHE  23          2HB       PHE  23   5.042  -8.571  -5.612
  178    HD1  PHE  23           HD1      PHE  23   6.102  -6.616  -8.612
  179    HD2  PHE  23           HD2      PHE  23   2.897  -8.641  -6.592
  180    HE1  PHE  23           HE1      PHE  23   4.490  -5.733 -10.281
  181    HE2  PHE  23           HE2      PHE  23   1.288  -7.758  -8.257
  182    HZ   PHE  23           HZ       PHE  23   2.082  -6.304 -10.101
  183    H    CYS  24           H        CYS  24   4.891  -7.228  -4.140
  184    HA   CYS  24           HA       CYS  24   3.461  -4.816  -4.342
  185   1HB   CYS  24          1HB       CYS  24   2.763  -6.534  -2.830
  186   2HB   CYS  24          2HB       CYS  24   4.324  -6.547  -2.011
  187    H    ASN  25           H        ASN  25   6.628  -5.445  -2.891
  188    HA   ASN  25           HA       ASN  25   6.956  -2.858  -1.647
  189   1HB   ASN  25          1HB       ASN  25   8.177  -5.066  -1.223
  190   2HB   ASN  25          2HB       ASN  25   9.088  -4.741  -2.699
  191   1HD2  ASN  25          2HD2      ASN  25  10.212  -4.836   0.030
  192   2HD2  ASN  25          1HD2      ASN  25  10.854  -3.296   0.342
  193    H    ARG  26           H        ARG  26   7.485  -4.124  -4.883
  194    HA   ARG  26           HA       ARG  26   9.165  -1.997  -5.869
  195   1HB   ARG  26          1HB       ARG  26   7.664  -4.329  -6.831
  196   2HB   ARG  26          2HB       ARG  26   7.715  -3.017  -8.008
  197   1HG   ARG  26          1HG       ARG  26  10.302  -3.030  -7.119
  198   2HG   ARG  26          2HG       ARG  26   9.895  -4.744  -7.024
  199   1HD   ARG  26          1HD       ARG  26   9.367  -3.054  -9.491
  200   2HD   ARG  26          2HD       ARG  26  10.823  -4.045  -9.273
  201    HE   ARG  26           HE       ARG  26   8.690  -5.745  -8.660
  202   1HH1  ARG  26          1HH1      ARG  26   9.699  -3.791 -11.323
  203   2HH1  ARG  26          2HH1      ARG  26   8.975  -4.816 -12.515
  204   1HH2  ARG  26          1HH2      ARG  26   7.743  -7.089 -10.209
  205   2HH2  ARG  26          2HH2      ARG  26   7.874  -6.682 -11.887
  206    H    GLU  27           H        GLU  27   5.635  -2.545  -5.919
  207    HA   GLU  27           HA       GLU  27   5.092  -0.025  -7.305
  208   1HB   GLU  27          1HB       GLU  27   3.691  -2.414  -6.316
  209   2HB   GLU  27          2HB       GLU  27   2.737  -0.936  -6.169
  210   1HG   GLU  27          1HG       GLU  27   4.203  -1.526  -8.727
  211   2HG   GLU  27          2HG       GLU  27   2.646  -2.292  -8.411
  212    H    CYS  28           H        CYS  28   5.130  -1.170  -3.954
  213    HA   CYS  28           HA       CYS  28   3.842   1.197  -2.847
  214   1HB   CYS  28          1HB       CYS  28   4.261  -1.313  -1.998
  215   2HB   CYS  28          2HB       CYS  28   5.672  -0.554  -1.262
  216    H    LYS  29           H        LYS  29   7.063   0.405  -3.863
  217    HA   LYS  29           HA       LYS  29   8.620   2.092  -2.176
  218   1HB   LYS  29          1HB       LYS  29   8.882   0.488  -4.511
  219   2HB   LYS  29          2HB       LYS  29   9.582   2.062  -4.889
  220   1HG   LYS  29          1HG       LYS  29  10.745   1.832  -2.562
  221   2HG   LYS  29          2HG       LYS  29  10.374   0.116  -2.735
  222   1HD   LYS  29          1HD       LYS  29  11.975   1.818  -4.666
  223   2HD   LYS  29          2HD       LYS  29  12.597   0.527  -3.637
  224   1HE   LYS  29          1HE       LYS  29  12.164  -0.929  -5.320
  225   2HE   LYS  29          2HE       LYS  29  10.434  -0.593  -5.099
  226   1HZ   LYS  29          1HZ       LYS  29  12.266   1.161  -6.643
  227   2HZ   LYS  29          2HZ       LYS  29  11.301  -0.042  -7.358
  228   3HZ   LYS  29          3HZ       LYS  29  10.572   1.261  -6.556
  229    H    TRP  30           H        TRP  30   7.561   2.826  -5.527
  230    HA   TRP  30           HA       TRP  30   7.050   4.901  -6.539
  231   1HB   TRP  30          1HB       TRP  30   6.182   5.138  -3.663
  232   2HB   TRP  30          2HB       TRP  30   5.995   6.506  -4.756
  233    HD1  TRP  30           HD1      TRP  30   4.089   3.750  -3.545
  234    HE1  TRP  30           HE1      TRP  30   2.223   3.047  -5.183
  235    HE3  TRP  30           HE3      TRP  30   5.663   6.171  -7.754
  236    HZ2  TRP  30           HZ2      TRP  30   1.499   3.464  -7.919
  237    HZ3  TRP  30           HZ3      TRP  30   4.369   6.003  -9.860
  238    HH2  TRP  30           HH2      TRP  30   2.290   4.654  -9.949
  239    H    LYS  31           H        LYS  31   7.829   7.151  -6.688
  240    HA   LYS  31           HA       LYS  31  10.352   7.599  -5.124
  241   1HB   LYS  31          1HB       LYS  31   9.647   8.510  -7.932
  242   2HB   LYS  31          2HB       LYS  31  11.229   8.597  -7.160
  243   1HG   LYS  31          1HG       LYS  31  11.696   6.432  -7.625
  244   2HG   LYS  31          2HG       LYS  31  10.087   5.895  -7.137
  245   1HD   LYS  31          1HD       LYS  31   9.263   6.011  -9.262
  246   2HD   LYS  31          2HD       LYS  31  10.187   7.464  -9.648
  247   1HE   LYS  31          1HE       LYS  31  12.247   5.770  -9.501
  248   2HE   LYS  31          2HE       LYS  31  10.986   4.590  -9.911
  249   1HZ   LYS  31          1HZ       LYS  31  10.745   7.038 -11.389
  250   2HZ   LYS  31          2HZ       LYS  31  12.225   6.262 -11.678
  251   3HZ   LYS  31          3HZ       LYS  31  10.766   5.435 -11.952
  252    H    HIS  32           H        HIS  32  10.905  10.013  -5.012
  253    HA   HIS  32           HA       HIS  32  10.296  12.187  -4.313
  254   1HB   HIS  32          1HB       HIS  32   8.197  11.453  -6.367
  255   2HB   HIS  32          2HB       HIS  32   8.285  13.061  -5.647
  256    HD1  HIS  32           HD1      HIS  32   9.010  14.131  -7.921
  257    HD2  HIS  32           HD2      HIS  32  11.646  11.236  -6.493
  258    HE1  HIS  32           HE1      HIS  32  11.133  14.359  -9.284
  259    H    ILE  33           H        ILE  33   9.345   9.909  -2.708
  260    HA   ILE  33           HA       ILE  33   6.958  11.222  -1.466
  261    HB   ILE  33           HB       ILE  33   7.368   8.401  -2.431
  262   1HG1  ILE  33          1HG1      ILE  33   4.851  10.069  -2.384
  263   2HG1  ILE  33          2HG1      ILE  33   6.071  10.283  -3.641
  264   1HG2  ILE  33          1HG2      ILE  33   5.470   9.257  -0.222
  265   2HG2  ILE  33          2HG2      ILE  33   5.451   7.686  -1.023
  266   3HG2  ILE  33          3HG2      ILE  33   6.839   8.160  -0.042
  267   1HD1  ILE  33          1HD1      ILE  33   5.473   7.470  -3.220
  268   2HD1  ILE  33          2HD1      ILE  33   4.017   8.381  -3.625
  269   3HD1  ILE  33          3HD1      ILE  33   5.408   8.413  -4.709
  270    H    GLY  34           H        GLY  34   9.569   8.812  -1.070
  271   1HA   GLY  34          1HA       GLY  34  11.112   8.888   0.807
  272   2HA   GLY  34          2HA       GLY  34   9.881   9.736   1.742
  273    H    GLY  35           H        GLY  35  10.720   6.585   0.364
  274   1HA   GLY  35          1HA       GLY  35   8.869   5.338   2.361
  275   2HA   GLY  35          2HA       GLY  35   9.215   4.619   0.788
  276    H    SER  36           H        SER  36   9.695   3.618   3.603
  277    HA   SER  36           HA       SER  36  12.662   3.234   3.428
  278   1HB   SER  36          1HB       SER  36  12.613   3.816   5.609
  279   2HB   SER  36          2HB       SER  36  10.874   4.062   5.489
  280    HG   SER  36           HG       SER  36  10.528   2.093   6.269
  281    H    TYR  37           H        TYR  37   9.657   1.545   4.444
  282    HA   TYR  37           HA       TYR  37  10.709  -0.960   3.215
  283   1HB   TYR  37          1HB       TYR  37  11.289  -0.593   5.733
  284   2HB   TYR  37          2HB       TYR  37   9.582  -0.927   6.014
  285    HD1  TYR  37           HD1      TYR  37   9.717  -2.792   3.324
  286    HD2  TYR  37           HD2      TYR  37  11.712  -2.670   7.126
  287    HE1  TYR  37           HE1      TYR  37  10.167  -5.227   3.166
  288    HE2  TYR  37           HE2      TYR  37  12.162  -5.103   6.970
  289    HH   TYR  37           HH       TYR  37  12.005  -6.827   4.208
  290    H    GLY  38           H        GLY  38   9.038  -1.435   1.817
  291   1HA   GLY  38          1HA       GLY  38   6.254  -1.210   2.893
  292   2HA   GLY  38          2HA       GLY  38   6.651  -0.867   1.211
  293    H    TYR  39           H        TYR  39   5.703  -3.290   3.403
  294    HA   TYR  39           HA       TYR  39   6.190  -5.390   1.314
  295   1HB   TYR  39          1HB       TYR  39   6.695  -6.915   3.058
  296   2HB   TYR  39          2HB       TYR  39   7.478  -5.423   3.573
  297    HD1  TYR  39           HD1      TYR  39   6.210  -3.883   5.186
  298    HD2  TYR  39           HD2      TYR  39   5.035  -7.935   4.388
  299    HE1  TYR  39           HE1      TYR  39   4.867  -3.906   7.272
  300    HE2  TYR  39           HE2      TYR  39   3.694  -7.961   6.473
  301    HH   TYR  39           HH       TYR  39   3.719  -6.713   8.686
  302    H    CYS  40           H        CYS  40   4.503  -7.238   1.589
  303    HA   CYS  40           HA       CYS  40   1.832  -5.978   1.733
  304   1HB   CYS  40          1HB       CYS  40   3.106  -7.963   0.214
  305   2HB   CYS  40          2HB       CYS  40   1.926  -8.835   1.196
  306    H    TYR  41           H        TYR  41   0.312  -6.433   3.312
  307    HA   TYR  41           HA       TYR  41   0.824  -8.638   5.245
  308   1HB   TYR  41          1HB       TYR  41   1.961  -6.597   6.083
  309   2HB   TYR  41          2HB       TYR  41   0.435  -5.718   5.984
  310    HD1  TYR  41           HD1      TYR  41   1.163  -9.212   7.125
  311    HD2  TYR  41           HD2      TYR  41  -0.248  -5.296   8.189
  312    HE1  TYR  41           HE1      TYR  41   0.514 -10.054   9.366
  313    HE2  TYR  41           HE2      TYR  41  -0.895  -6.137  10.430
  314    HH   TYR  41           HH       TYR  41  -1.548  -8.528  11.372
  315    H    GLY  42           H        GLY  42  -1.115  -9.509   6.008
  316   1HA   GLY  42          1HA       GLY  42  -3.428  -9.935   6.002
  317   2HA   GLY  42          2HA       GLY  42  -3.568  -8.220   6.394
  318    H    PHE  43           H        PHE  43  -2.795 -10.202   3.506
  319    HA   PHE  43           HA       PHE  43  -3.369  -9.799   1.234
  320   1HB   PHE  43          1HB       PHE  43  -5.897  -9.435   2.865
  321   2HB   PHE  43          2HB       PHE  43  -5.908  -9.566   1.104
  322    HD1  PHE  43           HD1      PHE  43  -5.122 -11.328   4.262
  323    HD2  PHE  43           HD2      PHE  43  -5.446 -11.659  -0.007
  324    HE1  PHE  43           HE1      PHE  43  -4.973 -13.796   4.444
  325    HE2  PHE  43           HE2      PHE  43  -5.296 -14.128   0.173
  326    HZ   PHE  43           HZ       PHE  43  -5.063 -15.197   2.399
  327    H    GLY  44           H        GLY  44  -2.023  -7.722   1.341
  328   1HA   GLY  44          1HA       GLY  44  -3.176  -5.606  -0.025
  329   2HA   GLY  44          2HA       GLY  44  -3.415  -5.193   1.674
  330    H    CYS  45           H        CYS  45  -1.745  -3.671  -0.064
  331    HA   CYS  45           HA       CYS  45   1.040  -4.437   0.614
  332   1HB   CYS  45          1HB       CYS  45  -0.382  -2.532  -1.202
  333   2HB   CYS  45          2HB       CYS  45   1.273  -2.141  -0.736
  334    H    TYR  46           H        TYR  46   1.969  -3.658   2.454
  335    HA   TYR  46           HA       TYR  46   0.782  -1.221   3.733
  336   1HB   TYR  46          1HB       TYR  46   0.892  -3.607   4.809
  337   2HB   TYR  46          2HB       TYR  46   2.599  -3.236   5.050
  338    HD1  TYR  46           HD1      TYR  46  -0.612  -1.296   5.340
  339    HD2  TYR  46           HD2      TYR  46   3.067  -2.503   7.204
  340    HE1  TYR  46           HE1      TYR  46  -1.183   0.053   7.343
  341    HE2  TYR  46           HE2      TYR  46   2.496  -1.153   9.204
  342    HH   TYR  46           HH       TYR  46  -0.435  -0.135   9.960
  343    H    CYS  47           H        CYS  47   2.057   0.586   3.665
  344    HA   CYS  47           HA       CYS  47   4.990   0.217   3.147
  345   1HB   CYS  47          1HB       CYS  47   2.870   1.838   1.994
  346   2HB   CYS  47          2HB       CYS  47   4.202   2.848   2.558
  347    H    GLU  48           H        GLU  48   6.400   1.094   4.631
  348    HA   GLU  48           HA       GLU  48   5.215   2.694   6.876
  349   1HB   GLU  48          1HB       GLU  48   7.812   1.149   6.916
  350   2HB   GLU  48          2HB       GLU  48   6.802   1.621   8.281
  351   1HG   GLU  48          1HG       GLU  48   5.053   0.063   7.562
  352   2HG   GLU  48          2HG       GLU  48   6.005  -0.375   6.142
  353    H    GLY  49           H        GLY  49   5.989   4.762   7.118
  354   1HA   GLY  49          1HA       GLY  49   7.993   6.244   7.203
  355   2HA   GLY  49          2HA       GLY  49   8.546   5.453   5.728
  356    H    LEU  50           H        LEU  50   6.167   5.434   4.270
  357    HA   LEU  50           HA       LEU  50   6.156   7.823   2.891
  358   1HB   LEU  50          1HB       LEU  50   3.568   7.162   2.601
  359   2HB   LEU  50          2HB       LEU  50   4.859   6.242   1.845
  360    HG   LEU  50           HG       LEU  50   4.780   4.568   3.592
  361   1HD1  LEU  50          1HD1      LEU  50   2.892   6.508   4.941
  362   2HD1  LEU  50          2HD1      LEU  50   3.020   4.816   5.415
  363   3HD1  LEU  50          3HD1      LEU  50   4.416   5.881   5.570
  364   1HD2  LEU  50          1HD2      LEU  50   3.027   4.532   1.783
  365   2HD2  LEU  50          2HD2      LEU  50   2.556   3.701   3.266
  366   3HD2  LEU  50          3HD2      LEU  50   1.924   5.311   2.919
  367    HA   PRO  51           HA       PRO  51   4.602  10.758   5.859
  368   1HB   PRO  51          1HB       PRO  51   4.086  12.659   3.792
  369   2HB   PRO  51          2HB       PRO  51   5.498  12.576   4.848
  370   1HG   PRO  51          1HG       PRO  51   5.363  11.999   2.038
  371   2HG   PRO  51          2HG       PRO  51   6.775  11.922   3.097
  372   1HD   PRO  51          1HD       PRO  51   5.261   9.722   1.963
  373   2HD   PRO  51          2HD       PRO  51   6.737   9.648   2.957
  374    H    ASP  52           H        ASP  52   2.523  11.579   6.458
  375    HA   ASP  52           HA       ASP  52   0.210  10.202   5.614
  376   1HB   ASP  52          1HB       ASP  52   0.589  11.580   7.694
  377   2HB   ASP  52          2HB       ASP  52   0.392  13.029   6.706
  378    H    SER  53           H        SER  53   1.876  12.837   4.107
  379    HA   SER  53           HA       SER  53  -0.143  14.164   2.660
  380   1HB   SER  53          1HB       SER  53   2.524  14.317   2.869
  381   2HB   SER  53          2HB       SER  53   2.439  13.460   1.333
  382    HG   SER  53           HG       SER  53   2.397  15.836   1.260
  383    H    THR  54           H        THR  54   1.734  11.278   1.640
  384    HA   THR  54           HA       THR  54   0.461  10.864  -0.857
  385    HB   THR  54           HB       THR  54   1.154   8.437   0.643
  386    HG1  THR  54           HG1      THR  54   2.602   9.476   1.788
  387   1HG2  THR  54          1HG2      THR  54   1.108   8.618  -1.821
  388   2HG2  THR  54          2HG2      THR  54   2.384   9.834  -1.749
  389   3HG2  THR  54          3HG2      THR  54   2.715   8.178  -1.240
  390    H    GLN  55           H        GLN  55  -1.277   9.424  -1.450
  391    HA   GLN  55           HA       GLN  55  -3.528   9.429   0.399
  392   1HB   GLN  55          1HB       GLN  55  -2.931   8.988  -2.407
  393   2HB   GLN  55          2HB       GLN  55  -4.040   7.753  -1.809
  394   1HG   GLN  55          1HG       GLN  55  -4.474  10.679  -1.209
  395   2HG   GLN  55          2HG       GLN  55  -5.078   9.945  -2.694
  396   1HE2  GLN  55          2HE2      GLN  55  -6.012  10.663   0.430
  397   2HE2  GLN  55          1HE2      GLN  55  -7.217   9.484   0.633
  398    H    THR  56           H        THR  56  -4.154   7.771   1.743
  399    HA   THR  56           HA       THR  56  -2.997   5.053   1.293
  400    HB   THR  56           HB       THR  56  -2.941   5.341   4.017
  401    HG1  THR  56           HG1      THR  56  -1.874   7.759   3.109
  402   1HG2  THR  56          1HG2      THR  56  -1.052   5.319   1.816
  403   2HG2  THR  56          2HG2      THR  56  -0.452   6.305   3.151
  404   3HG2  THR  56          3HG2      THR  56  -0.891   4.619   3.428
  405    H    TRP  57           H        TRP  57  -4.393   3.377   1.932
  406    HA   TRP  57           HA       TRP  57  -7.205   3.858   2.085
  407   1HB   TRP  57          1HB       TRP  57  -5.651   1.776   1.520
  408   2HB   TRP  57          2HB       TRP  57  -5.856   1.430   3.229
  409    HD1  TRP  57           HD1      TRP  57  -7.882   1.828   0.001
  410    HE1  TRP  57           HE1      TRP  57 -10.151   0.637   0.304
  411    HE3  TRP  57           HE3      TRP  57  -7.569   0.576   4.944
  412    HZ2  TRP  57           HZ2      TRP  57 -11.635  -0.672   2.372
  413    HZ3  TRP  57           HZ3      TRP  57  -9.422  -0.639   6.053
  414    HH2  TRP  57           HH2      TRP  57 -11.451  -1.264   4.775
  415    HA   PRO  58           HA       PRO  58  -8.990   3.041   2.913
  416   1HB   PRO  58          1HB       PRO  58 -10.909   4.633   4.242
  417   2HB   PRO  58          2HB       PRO  58 -10.735   2.878   4.355
  418   1HG   PRO  58          1HG       PRO  58 -10.153   4.878   6.369
  419   2HG   PRO  58          2HG       PRO  58 -10.127   3.119   6.523
  420   1HD   PRO  58          1HD       PRO  58  -7.872   4.922   6.372
  421   2HD   PRO  58          2HD       PRO  58  -7.848   3.149   6.543
  422    H    LEU  59           H        LEU  59 -10.640   4.728   1.815
  423    HA   LEU  59           HA       LEU  59  -9.005   7.072   1.005
  424   1HB   LEU  59          1HB       LEU  59 -10.842   5.224  -0.194
  425   2HB   LEU  59          2HB       LEU  59 -11.496   6.852  -0.381
  426    HG   LEU  59           HG       LEU  59  -9.041   7.463  -1.081
  427   1HD1  LEU  59          1HD1      LEU  59  -9.125   4.466  -1.217
  428   2HD1  LEU  59          2HD1      LEU  59  -8.193   5.359  -2.420
  429   3HD1  LEU  59          3HD1      LEU  59  -7.810   5.525  -0.707
  430   1HD2  LEU  59          1HD2      LEU  59 -11.386   6.774  -2.465
  431   2HD2  LEU  59          2HD2      LEU  59 -10.003   7.656  -3.113
  432   3HD2  LEU  59          3HD2      LEU  59 -10.097   5.904  -3.294
  433    HA   PRO  60           HA       PRO  60 -11.356  10.283   2.880
  434   1HB   PRO  60          1HB       PRO  60 -12.563  11.282   0.429
  435   2HB   PRO  60          2HB       PRO  60 -11.286  12.006   1.412
  436   1HG   PRO  60          1HG       PRO  60 -10.983  10.794  -1.129
  437   2HG   PRO  60          2HG       PRO  60  -9.692  11.327  -0.048
  438   1HD   PRO  60          1HD       PRO  60 -10.463   8.613  -0.718
  439   2HD   PRO  60          2HD       PRO  60  -9.105   9.150   0.299
  440    H    ASN  61           H        ASN  61 -13.804  11.417   2.193
  441    HA   ASN  61           HA       ASN  61 -15.728   9.742   3.335
  442   1HB   ASN  61          1HB       ASN  61 -15.975  12.145   3.048
  443   2HB   ASN  61          2HB       ASN  61 -15.966  11.973   1.293
  444   1HD2  ASN  61          2HD2      ASN  61 -17.669   9.630   3.313
  445   2HD2  ASN  61          1HD2      ASN  61 -19.234  10.116   2.872
  446    H    LYS  62           H        LYS  62 -14.459   9.680   0.107
  447    HA   LYS  62           HA       LYS  62 -16.674   7.865  -0.779
  448   1HB   LYS  62          1HB       LYS  62 -15.293  10.065  -1.921
  449   2HB   LYS  62          2HB       LYS  62 -14.814   8.638  -2.840
  450   1HG   LYS  62          1HG       LYS  62 -16.810   9.545  -3.864
  451   2HG   LYS  62          2HG       LYS  62 -17.253   8.044  -3.049
  452   1HD   LYS  62          1HD       LYS  62 -18.937   9.488  -2.317
  453   2HD   LYS  62          2HD       LYS  62 -17.756   9.629  -1.013
  454   1HE   LYS  62          1HE       LYS  62 -18.290  11.885  -1.548
  455   2HE   LYS  62          2HE       LYS  62 -16.773  11.596  -2.423
  456   1HZ   LYS  62          1HZ       LYS  62 -19.469  11.138  -3.580
  457   2HZ   LYS  62          2HZ       LYS  62 -18.561  12.552  -3.833
  458   3HZ   LYS  62          3HZ       LYS  62 -17.982  11.057  -4.393
  459    H    THR  63           H        THR  63 -15.437   6.204   0.658
  460    HA   THR  63           HA       THR  63 -12.848   5.236  -0.223
  461    HB   THR  63           HB       THR  63 -13.602   4.844   2.029
  462    HG1  THR  63           HG1      THR  63 -12.474   3.105   1.120
  463   1HG2  THR  63          1HG2      THR  63 -16.066   3.851   0.636
  464   2HG2  THR  63          2HG2      THR  63 -15.677   3.246   2.246
  465   3HG2  THR  63          3HG2      THR  63 -15.928   4.972   1.989
  466    H    CYS  64           H        CYS  64 -13.067   2.552  -0.592
  467    HA   CYS  64           HA       CYS  64 -14.339   2.377  -3.260
  468   1HB   CYS  64          1HB       CYS  64 -11.962   1.596  -2.408
  469   2HB   CYS  64          2HB       CYS  64 -12.847   0.165  -1.880
  Start of MODEL    7
    1   1H    LYS   1          1H        LYS   1   6.713   5.401  10.812
    2   2H    LYS   1          2H        LYS   1   6.751   6.951  10.116
    3   3H    LYS   1          3H        LYS   1   6.461   6.777  11.777
    4    HA   LYS   1           HA       LYS   1   4.310   5.949  11.460
    5   1HB   LYS   1          1HB       LYS   1   4.491   8.328  11.092
    6   2HB   LYS   1          2HB       LYS   1   5.071   8.082   9.445
    7   1HG   LYS   1          1HG       LYS   1   2.543   6.721   9.853
    8   2HG   LYS   1          2HG       LYS   1   2.401   8.435  10.247
    9   1HD   LYS   1          1HD       LYS   1   3.214   9.087   8.083
   10   2HD   LYS   1          2HD       LYS   1   3.685   7.432   7.696
   11   1HE   LYS   1          1HE       LYS   1   1.068   7.011   8.217
   12   2HE   LYS   1          2HE       LYS   1   0.986   8.684   7.630
   13   1HZ   LYS   1          1HZ       LYS   1   2.525   7.915   5.797
   14   2HZ   LYS   1          2HZ       LYS   1   2.155   6.326   6.270
   15   3HZ   LYS   1          3HZ       LYS   1   0.926   7.356   5.708
   16    H    ASP   2           H        ASP   2   3.918   3.887  10.627
   17    HA   ASP   2           HA       ASP   2   4.613   3.120   7.902
   18   1HB   ASP   2          1HB       ASP   2   2.635   1.776   9.757
   19   2HB   ASP   2          2HB       ASP   2   3.692   1.023   8.564
   20    H    GLY   3           H        GLY   3   2.713   2.139   6.513
   21   1HA   GLY   3          1HA       GLY   3   0.109   3.396   6.802
   22   2HA   GLY   3          2HA       GLY   3   1.069   4.145   5.527
   23    H    TYR   4           H        TYR   4  -1.114   3.076   4.569
   24    HA   TYR   4           HA       TYR   4  -0.292   0.435   3.410
   25   1HB   TYR   4          1HB       TYR   4  -2.699   1.338   4.843
   26   2HB   TYR   4          2HB       TYR   4  -3.051   0.508   3.326
   27    HD1  TYR   4           HD1      TYR   4  -1.759  -1.722   2.897
   28    HD2  TYR   4           HD2      TYR   4  -2.221   0.079   6.769
   29    HE1  TYR   4           HE1      TYR   4  -1.274  -3.904   3.969
   30    HE2  TYR   4           HE2      TYR   4  -1.734  -2.103   7.842
   31    HH   TYR   4           HH       TYR   4  -0.424  -4.252   7.125
   32    H    LEU   5           H        LEU   5  -0.743   0.189   1.168
   33    HA   LEU   5           HA       LEU   5  -1.023   2.683  -0.348
   34   1HB   LEU   5          1HB       LEU   5  -0.928  -0.209  -1.268
   35   2HB   LEU   5          2HB       LEU   5  -0.564   1.214  -2.243
   36    HG   LEU   5           HG       LEU   5   0.982   0.314   0.208
   37   1HD1  LEU   5          1HD1      LEU   5   1.127  -0.935  -2.116
   38   2HD1  LEU   5          2HD1      LEU   5   2.088   0.469  -2.578
   39   3HD1  LEU   5          3HD1      LEU   5   2.600  -0.545  -1.230
   40   1HD2  LEU   5          1HD2      LEU   5   0.730   2.873  -0.895
   41   2HD2  LEU   5          2HD2      LEU   5   2.017   2.326   0.178
   42   3HD2  LEU   5          3HD2      LEU   5   2.235   2.256  -1.571
   43    H    VAL   6           H        VAL   6  -2.586   2.527  -2.344
   44    HA   VAL   6           HA       VAL   6  -5.189   1.274  -1.563
   45    HB   VAL   6           HB       VAL   6  -6.292   3.403  -2.145
   46   1HG1  VAL   6          1HG1      VAL   6  -4.851   2.883   0.137
   47   2HG1  VAL   6          2HG1      VAL   6  -4.223   4.459  -0.344
   48   3HG1  VAL   6          3HG1      VAL   6  -5.952   4.245  -0.070
   49   1HG2  VAL   6          1HG2      VAL   6  -4.343   3.990  -3.769
   50   2HG2  VAL   6          2HG2      VAL   6  -5.116   5.308  -2.887
   51   3HG2  VAL   6          3HG2      VAL   6  -3.564   4.673  -2.341
   52    H    GLU   7           H        GLU   7  -6.717   2.007  -3.678
   53    HA   GLU   7           HA       GLU   7  -5.217   0.900  -6.021
   54   1HB   GLU   7          1HB       GLU   7  -7.264  -0.232  -4.881
   55   2HB   GLU   7          2HB       GLU   7  -8.212   1.031  -5.669
   56   1HG   GLU   7          1HG       GLU   7  -8.153  -0.121  -7.597
   57   2HG   GLU   7          2HG       GLU   7  -6.391  -0.031  -7.597
   58    H    LYS   8           H        LYS   8  -5.974   1.774  -8.175
   59    HA   LYS   8           HA       LYS   8  -5.688   4.536  -8.450
   60   1HB   LYS   8          1HB       LYS   8  -6.183   2.323 -10.061
   61   2HB   LYS   8          2HB       LYS   8  -7.582   3.357 -10.354
   62   1HG   LYS   8          1HG       LYS   8  -6.131   5.239 -10.907
   63   2HG   LYS   8          2HG       LYS   8  -4.700   4.289 -10.503
   64   1HD   LYS   8          1HD       LYS   8  -5.572   2.614 -12.283
   65   2HD   LYS   8          2HD       LYS   8  -6.580   3.952 -12.833
   66   1HE   LYS   8          1HE       LYS   8  -3.726   4.634 -12.368
   67   2HE   LYS   8          2HE       LYS   8  -4.042   3.550 -13.736
   68   1HZ   LYS   8          1HZ       LYS   8  -6.058   5.376 -13.875
   69   2HZ   LYS   8          2HZ       LYS   8  -4.724   6.323 -13.419
   70   3HZ   LYS   8          3HZ       LYS   8  -4.653   5.386 -14.829
   71    H    THR   9           H        THR   9  -8.709   2.694  -7.988
   72    HA   THR   9           HA       THR   9 -10.340   5.147  -7.993
   73    HB   THR   9           HB       THR   9 -12.156   3.540  -7.766
   74    HG1  THR   9           HG1      THR   9 -10.058   1.956  -6.854
   75   1HG2  THR   9          1HG2      THR   9 -10.382   3.609  -9.863
   76   2HG2  THR   9          2HG2      THR   9 -10.430   1.888  -9.479
   77   3HG2  THR   9          3HG2      THR   9 -11.919   2.744  -9.877
   78    H    GLY  10           H        GLY  10  -8.564   3.292  -5.705
   79   1HA   GLY  10          1HA       GLY  10  -8.326   4.498  -3.481
   80   2HA   GLY  10          2HA       GLY  10 -10.089   4.555  -3.458
   81    H    CYS  11           H        CYS  11 -10.351   1.844  -4.605
   82    HA   CYS  11           HA       CYS  11 -10.631   0.280  -2.299
   83   1HB   CYS  11          1HB       CYS  11 -10.251  -0.205  -5.229
   84   2HB   CYS  11          2HB       CYS  11 -10.184  -1.600  -4.151
   85    H    LYS  12           H        LYS  12  -9.217  -1.926  -2.116
   86    HA   LYS  12           HA       LYS  12  -6.390  -1.001  -1.800
   87   1HB   LYS  12          1HB       LYS  12  -7.597  -1.740   0.191
   88   2HB   LYS  12          2HB       LYS  12  -7.966  -3.281  -0.566
   89   1HG   LYS  12          1HG       LYS  12  -6.081  -3.537   0.960
   90   2HG   LYS  12          2HG       LYS  12  -5.517  -3.747  -0.692
   91   1HD   LYS  12          1HD       LYS  12  -4.556  -1.555  -0.742
   92   2HD   LYS  12          2HD       LYS  12  -5.408  -1.076   0.724
   93   1HE   LYS  12          1HE       LYS  12  -3.466  -1.632   1.791
   94   2HE   LYS  12          2HE       LYS  12  -3.993  -3.312   1.556
   95   1HZ   LYS  12          1HZ       LYS  12  -2.632  -1.832  -0.605
   96   2HZ   LYS  12          2HZ       LYS  12  -1.728  -2.620   0.600
   97   3HZ   LYS  12          3HZ       LYS  12  -2.779  -3.509  -0.397
   98    H    LYS  13           H        LYS  13  -4.779  -2.814  -2.059
   99    HA   LYS  13           HA       LYS  13  -5.475  -4.541  -4.419
  100   1HB   LYS  13          1HB       LYS  13  -3.925  -2.462  -4.673
  101   2HB   LYS  13          2HB       LYS  13  -2.729  -3.436  -3.816
  102   1HG   LYS  13          1HG       LYS  13  -2.504  -4.943  -5.551
  103   2HG   LYS  13          2HG       LYS  13  -4.161  -4.709  -6.107
  104   1HD   LYS  13          1HD       LYS  13  -3.607  -2.591  -7.113
  105   2HD   LYS  13          2HD       LYS  13  -2.007  -2.598  -6.371
  106   1HE   LYS  13          1HE       LYS  13  -1.444  -4.656  -7.684
  107   2HE   LYS  13          2HE       LYS  13  -3.014  -4.521  -8.500
  108   1HZ   LYS  13          1HZ       LYS  13  -2.080  -2.008  -8.660
  109   2HZ   LYS  13          2HZ       LYS  13  -0.639  -2.892  -8.800
  110   3HZ   LYS  13          3HZ       LYS  13  -1.913  -3.166  -9.891
  111    H    THR  14           H        THR  14  -5.961  -5.788  -2.152
  112    HA   THR  14           HA       THR  14  -3.967  -6.877  -0.530
  113    HB   THR  14           HB       THR  14  -6.575  -7.873  -1.661
  114    HG1  THR  14           HG1      THR  14  -7.276  -7.372   0.333
  115   1HG2  THR  14          1HG2      THR  14  -4.495  -9.461  -0.301
  116   2HG2  THR  14          2HG2      THR  14  -6.097  -9.576   0.429
  117   3HG2  THR  14          3HG2      THR  14  -5.869  -9.996  -1.269
  118    H    CYS  15           H        CYS  15  -2.458  -8.526  -0.758
  119    HA   CYS  15           HA       CYS  15  -2.176  -9.719  -3.494
  120   1HB   CYS  15          1HB       CYS  15   0.194  -9.801  -2.993
  121   2HB   CYS  15          2HB       CYS  15  -0.380  -8.189  -2.568
  122    H    TYR  16           H        TYR  16  -1.207 -12.001  -3.403
  123    HA   TYR  16           HA       TYR  16  -2.657 -13.542  -1.328
  124   1HB   TYR  16          1HB       TYR  16  -1.705 -13.879  -4.081
  125   2HB   TYR  16          2HB       TYR  16  -1.440 -15.308  -3.078
  126    HD1  TYR  16           HD1      TYR  16  -4.086 -12.708  -3.667
  127    HD2  TYR  16           HD2      TYR  16  -3.187 -16.839  -2.907
  128    HE1  TYR  16           HE1      TYR  16  -6.499 -13.256  -3.800
  129    HE2  TYR  16           HE2      TYR  16  -5.602 -17.387  -3.038
  130    HH   TYR  16           HH       TYR  16  -7.827 -15.551  -4.417
  131    H    LYS  17           H        LYS  17   0.608 -13.815  -2.812
  132    HA   LYS  17           HA       LYS  17   1.655 -15.345  -0.591
  133   1HB   LYS  17          1HB       LYS  17   2.481 -15.398  -2.940
  134   2HB   LYS  17          2HB       LYS  17   3.056 -13.740  -2.753
  135   1HG   LYS  17          1HG       LYS  17   4.576 -14.422  -0.972
  136   2HG   LYS  17          2HG       LYS  17   3.946 -16.068  -1.025
  137   1HD   LYS  17          1HD       LYS  17   4.638 -15.602  -3.660
  138   2HD   LYS  17          2HD       LYS  17   5.912 -14.769  -2.769
  139   1HE   LYS  17          1HE       LYS  17   6.863 -16.737  -2.168
  140   2HE   LYS  17          2HE       LYS  17   5.313 -17.359  -1.568
  141   1HZ   LYS  17          1HZ       LYS  17   5.552 -17.059  -4.449
  142   2HZ   LYS  17          2HZ       LYS  17   6.489 -18.296  -3.759
  143   3HZ   LYS  17          3HZ       LYS  17   4.807 -18.288  -3.544
  144    H    LEU  18           H        LEU  18   2.092 -14.486   1.400
  145    HA   LEU  18           HA       LEU  18   2.273 -11.624   1.868
  146   1HB   LEU  18          1HB       LEU  18   2.991 -14.010   3.606
  147   2HB   LEU  18          2HB       LEU  18   2.688 -12.370   4.178
  148    HG   LEU  18           HG       LEU  18   0.667 -14.067   2.686
  149   1HD1  LEU  18          1HD1      LEU  18   1.512 -14.390   5.304
  150   2HD1  LEU  18          2HD1      LEU  18   0.115 -13.327   5.471
  151   3HD1  LEU  18          3HD1      LEU  18  -0.056 -14.889   4.669
  152   1HD2  LEU  18          1HD2      LEU  18   0.844 -11.255   3.396
  153   2HD2  LEU  18          2HD2      LEU  18  -0.364 -12.077   2.407
  154   3HD2  LEU  18          3HD2      LEU  18  -0.555 -12.009   4.159
  155    H    GLY  19           H        GLY  19   4.346 -11.234   3.566
  156   1HA   GLY  19          1HA       GLY  19   6.705 -11.151   3.791
  157   2HA   GLY  19          2HA       GLY  19   6.845 -12.288   2.453
  158    H    GLU  20           H        GLU  20   8.624 -10.526   2.059
  159    HA   GLU  20           HA       GLU  20   7.987  -7.927   1.113
  160   1HB   GLU  20          1HB       GLU  20  10.227  -9.197   1.648
  161   2HB   GLU  20          2HB       GLU  20  10.178  -9.609  -0.067
  162   1HG   GLU  20          1HG       GLU  20  10.187  -6.835   1.149
  163   2HG   GLU  20          2HG       GLU  20  11.435  -7.562   0.135
  164    H    ASN  21           H        ASN  21   5.997  -8.318  -0.182
  165    HA   ASN  21           HA       ASN  21   6.258  -9.812  -2.701
  166   1HB   ASN  21          1HB       ASN  21   4.199  -9.463  -1.133
  167   2HB   ASN  21          2HB       ASN  21   4.052  -7.899  -1.936
  168   1HD2  ASN  21          2HD2      ASN  21   2.423 -10.560  -2.107
  169   2HD2  ASN  21          1HD2      ASN  21   2.295 -10.829  -3.779
  170    H    ASP  22           H        ASP  22   7.898  -8.689  -3.855
  171    HA   ASP  22           HA       ASP  22   8.560  -6.097  -4.235
  172   1HB   ASP  22          1HB       ASP  22   8.874  -8.438  -5.615
  173   2HB   ASP  22          2HB       ASP  22   7.963  -7.478  -6.781
  174    H    PHE  23           H        PHE  23   5.557  -7.539  -5.473
  175    HA   PHE  23           HA       PHE  23   4.558  -5.583  -7.165
  176   1HB   PHE  23          1HB       PHE  23   3.621  -7.756  -5.632
  177   2HB   PHE  23          2HB       PHE  23   2.561  -6.405  -5.228
  178    HD1  PHE  23           HD1      PHE  23   4.083  -8.187  -8.145
  179    HD2  PHE  23           HD2      PHE  23   0.846  -5.762  -6.699
  180    HE1  PHE  23           HE1      PHE  23   2.913  -8.454 -10.317
  181    HE2  PHE  23           HE2      PHE  23  -0.324  -6.028  -8.870
  182    HZ   PHE  23           HZ       PHE  23   0.710  -7.375 -10.678
  183    H    CYS  24           H        CYS  24   4.572  -5.516  -3.599
  184    HA   CYS  24           HA       CYS  24   3.164  -2.992  -3.386
  185   1HB   CYS  24          1HB       CYS  24   4.985  -4.460  -1.454
  186   2HB   CYS  24          2HB       CYS  24   3.790  -3.235  -1.028
  187    H    ASN  25           H        ASN  25   6.596  -3.927  -3.462
  188    HA   ASN  25           HA       ASN  25   7.746  -1.466  -2.639
  189   1HB   ASN  25          1HB       ASN  25   8.494  -3.902  -4.122
  190   2HB   ASN  25          2HB       ASN  25   9.467  -2.489  -4.532
  191   1HD2  ASN  25          2HD2      ASN  25   8.742  -4.806  -2.001
  192   2HD2  ASN  25          1HD2      ASN  25   9.891  -4.239  -0.887
  193    H    ARG  26           H        ARG  26   6.704  -2.550  -5.882
  194    HA   ARG  26           HA       ARG  26   7.589  -0.146  -7.240
  195   1HB   ARG  26          1HB       ARG  26   6.855  -2.638  -7.980
  196   2HB   ARG  26          2HB       ARG  26   5.338  -1.793  -8.290
  197   1HG   ARG  26          1HG       ARG  26   6.733  -0.053  -9.546
  198   2HG   ARG  26          2HG       ARG  26   8.061  -1.209  -9.464
  199   1HD   ARG  26          1HD       ARG  26   5.782  -2.654 -10.350
  200   2HD   ARG  26          2HD       ARG  26   5.855  -1.166 -11.310
  201    HE   ARG  26           HE       ARG  26   7.646  -3.377 -11.562
  202   1HH1  ARG  26          1HH1      ARG  26   7.725   0.076 -11.265
  203   2HH1  ARG  26          2HH1      ARG  26   9.361   0.200 -11.808
  204   1HH2  ARG  26          1HH2      ARG  26   9.762  -3.201 -12.293
  205   2HH2  ARG  26          2HH2      ARG  26  10.506  -1.640 -12.397
  206    H    GLU  27           H        GLU  27   4.357  -1.308  -6.212
  207    HA   GLU  27           HA       GLU  27   2.880   0.995  -6.995
  208   1HB   GLU  27          1HB       GLU  27   2.593  -1.209  -4.965
  209   2HB   GLU  27          2HB       GLU  27   1.397   0.087  -5.021
  210   1HG   GLU  27          1HG       GLU  27   1.958  -0.830  -7.698
  211   2HG   GLU  27          2HG       GLU  27   1.520  -2.202  -6.680
  212    H    CYS  28           H        CYS  28   4.566   0.225  -3.948
  213    HA   CYS  28           HA       CYS  28   3.757   2.648  -2.574
  214   1HB   CYS  28          1HB       CYS  28   4.636   0.359  -1.705
  215   2HB   CYS  28          2HB       CYS  28   6.239   1.009  -2.048
  216    H    LYS  29           H        LYS  29   6.588   1.675  -4.485
  217    HA   LYS  29           HA       LYS  29   7.871   4.316  -4.118
  218   1HB   LYS  29          1HB       LYS  29   8.867   1.854  -4.274
  219   2HB   LYS  29          2HB       LYS  29   8.807   2.181  -6.006
  220   1HG   LYS  29          1HG       LYS  29  10.263   4.041  -5.819
  221   2HG   LYS  29          2HG       LYS  29  10.049   4.134  -4.070
  222   1HD   LYS  29          1HD       LYS  29  11.282   2.093  -3.732
  223   2HD   LYS  29          2HD       LYS  29  11.314   1.763  -5.465
  224   1HE   LYS  29          1HE       LYS  29  12.621   3.908  -5.773
  225   2HE   LYS  29          2HE       LYS  29  12.744   4.008  -4.005
  226   1HZ   LYS  29          1HZ       LYS  29  13.548   1.653  -5.632
  227   2HZ   LYS  29          2HZ       LYS  29  14.626   2.803  -5.004
  228   3HZ   LYS  29          3HZ       LYS  29  13.722   1.824  -3.950
  229    H    TRP  30           H        TRP  30   5.256   3.843  -5.649
  230    HA   TRP  30           HA       TRP  30   5.319   3.951  -8.385
  231   1HB   TRP  30          1HB       TRP  30   3.690   4.923  -6.240
  232   2HB   TRP  30          2HB       TRP  30   3.750   6.167  -7.489
  233    HD1  TRP  30           HD1      TRP  30   1.459   3.736  -6.643
  234    HE1  TRP  30           HE1      TRP  30   0.345   2.576  -8.659
  235    HE3  TRP  30           HE3      TRP  30   4.780   4.974 -10.316
  236    HZ2  TRP  30           HZ2      TRP  30   0.806   2.218 -11.460
  237    HZ3  TRP  30           HZ3      TRP  30   4.423   4.211 -12.645
  238    HH2  TRP  30           HH2      TRP  30   2.441   2.835 -13.222
  239    H    LYS  31           H        LYS  31   6.249   6.643  -6.228
  240    HA   LYS  31           HA       LYS  31   7.766   7.836  -8.499
  241   1HB   LYS  31          1HB       LYS  31   5.262   8.669  -7.858
  242   2HB   LYS  31          2HB       LYS  31   6.213   9.689  -6.778
  243   1HG   LYS  31          1HG       LYS  31   7.545   9.677  -9.282
  244   2HG   LYS  31          2HG       LYS  31   5.834   9.952  -9.612
  245   1HD   LYS  31          1HD       LYS  31   6.385  11.522  -7.358
  246   2HD   LYS  31          2HD       LYS  31   7.780  11.747  -8.413
  247   1HE   LYS  31          1HE       LYS  31   6.193  12.229 -10.311
  248   2HE   LYS  31          2HE       LYS  31   4.864  12.191  -9.136
  249   1HZ   LYS  31          1HZ       LYS  31   6.698  13.722  -7.889
  250   2HZ   LYS  31          2HZ       LYS  31   6.922  14.183  -9.509
  251   3HZ   LYS  31          3HZ       LYS  31   5.393  14.331  -8.792
  252    H    HIS  32           H        HIS  32   8.623   6.428  -6.050
  253    HA   HIS  32           HA       HIS  32  10.094   6.733  -4.215
  254   1HB   HIS  32          1HB       HIS  32  10.938   9.149  -5.834
  255   2HB   HIS  32          2HB       HIS  32  11.953   8.112  -4.832
  256    HD1  HIS  32           HD1      HIS  32  10.102   8.140  -8.127
  257    HD2  HIS  32           HD2      HIS  32  12.849   5.756  -6.092
  258    HE1  HIS  32           HE1      HIS  32  10.918   6.411  -9.788
  259    H    ILE  33           H        ILE  33   7.559   7.828  -3.666
  260    HA   ILE  33           HA       ILE  33   7.711  10.607  -2.844
  261    HB   ILE  33           HB       ILE  33   5.869   8.274  -2.267
  262   1HG1  ILE  33          1HG1      ILE  33   4.419  10.143  -3.593
  263   2HG1  ILE  33          2HG1      ILE  33   6.025  10.504  -4.228
  264   1HG2  ILE  33          1HG2      ILE  33   5.556  11.182  -1.455
  265   2HG2  ILE  33          2HG2      ILE  33   4.322   9.934  -1.280
  266   3HG2  ILE  33          3HG2      ILE  33   5.819   9.831  -0.353
  267   1HD1  ILE  33          1HD1      ILE  33   4.914   7.692  -4.145
  268   2HD1  ILE  33          2HD1      ILE  33   4.677   8.762  -5.527
  269   3HD1  ILE  33          3HD1      ILE  33   6.307   8.281  -5.053
  270    H    GLY  34           H        GLY  34   9.005   7.745  -1.528
  271   1HA   GLY  34          1HA       GLY  34  10.552   8.221   0.430
  272   2HA   GLY  34          2HA       GLY  34   9.167   9.014   1.174
  273    H    GLY  35           H        GLY  35   9.694   5.892  -0.468
  274   1HA   GLY  35          1HA       GLY  35   8.353   4.593   1.871
  275   2HA   GLY  35          2HA       GLY  35   8.131   4.032   0.213
  276    H    SER  36           H        SER  36  10.362   4.150   2.921
  277    HA   SER  36           HA       SER  36  12.543   2.807   1.517
  278   1HB   SER  36          1HB       SER  36  13.650   3.213   3.491
  279   2HB   SER  36          2HB       SER  36  12.302   4.316   3.747
  280    HG   SER  36           HG       SER  36  12.939   2.494   5.359
  281    H    TYR  37           H        TYR  37  10.426   1.726   4.208
  282    HA   TYR  37           HA       TYR  37  11.000  -1.099   3.525
  283   1HB   TYR  37          1HB       TYR  37  10.341   0.468   5.823
  284   2HB   TYR  37          2HB       TYR  37   9.066  -0.732   5.612
  285    HD1  TYR  37           HD1      TYR  37  12.812  -0.523   5.367
  286    HD2  TYR  37           HD2      TYR  37   9.389  -2.806   6.600
  287    HE1  TYR  37           HE1      TYR  37  14.310  -2.280   6.271
  288    HE2  TYR  37           HE2      TYR  37  10.887  -4.562   7.507
  289    HH   TYR  37           HH       TYR  37  14.347  -4.490   6.951
  290    H    GLY  38           H        GLY  38   9.589  -2.290   2.277
  291   1HA   GLY  38          1HA       GLY  38   6.719  -1.584   2.264
  292   2HA   GLY  38          2HA       GLY  38   7.554  -1.481   0.717
  293    H    TYR  39           H        TYR  39   5.946  -3.558   2.860
  294    HA   TYR  39           HA       TYR  39   6.563  -5.876   1.096
  295   1HB   TYR  39          1HB       TYR  39   6.944  -7.265   3.144
  296   2HB   TYR  39          2HB       TYR  39   8.144  -5.985   2.969
  297    HD1  TYR  39           HD1      TYR  39   5.208  -7.146   4.866
  298    HD2  TYR  39           HD2      TYR  39   8.142  -4.041   4.430
  299    HE1  TYR  39           HE1      TYR  39   4.579  -6.238   7.088
  300    HE2  TYR  39           HE2      TYR  39   7.515  -3.131   6.649
  301    HH   TYR  39           HH       TYR  39   5.339  -3.224   8.125
  302    H    CYS  40           H        CYS  40   4.838  -7.452   1.109
  303    HA   CYS  40           HA       CYS  40   2.214  -6.359   1.705
  304   1HB   CYS  40          1HB       CYS  40   3.364  -8.323   0.084
  305   2HB   CYS  40          2HB       CYS  40   2.353  -9.228   1.211
  306    H    TYR  41           H        TYR  41   1.369  -6.336   3.740
  307    HA   TYR  41           HA       TYR  41   1.972  -8.647   5.561
  308   1HB   TYR  41          1HB       TYR  41   2.991  -6.321   6.026
  309   2HB   TYR  41          2HB       TYR  41   1.347  -5.807   6.396
  310    HD1  TYR  41           HD1      TYR  41   1.042  -9.028   7.309
  311    HD2  TYR  41           HD2      TYR  41   3.290  -5.571   8.510
  312    HE1  TYR  41           HE1      TYR  41   1.262  -9.966   9.593
  313    HE2  TYR  41           HE2      TYR  41   3.511  -6.510  10.793
  314    HH   TYR  41           HH       TYR  41   2.766  -8.105  12.204
  315    H    GLY  42           H        GLY  42   0.104  -9.827   5.787
  316   1HA   GLY  42          1HA       GLY  42  -2.152 -10.243   6.363
  317   2HA   GLY  42          2HA       GLY  42  -2.379  -8.505   6.570
  318    H    PHE  43           H        PHE  43  -1.199 -10.243   3.708
  319    HA   PHE  43           HA       PHE  43  -1.992 -10.221   1.485
  320   1HB   PHE  43          1HB       PHE  43  -4.489 -10.177   3.192
  321   2HB   PHE  43          2HB       PHE  43  -4.566 -10.298   1.433
  322    HD1  PHE  43           HD1      PHE  43  -2.801 -11.850   4.358
  323    HD2  PHE  43           HD2      PHE  43  -4.483 -12.413   0.445
  324    HE1  PHE  43           HE1      PHE  43  -2.322 -14.279   4.502
  325    HE2  PHE  43           HE2      PHE  43  -4.004 -14.842   0.588
  326    HZ   PHE  43           HZ       PHE  43  -2.923 -15.776   2.617
  327    H    GLY  44           H        GLY  44  -1.090  -7.739   2.434
  328   1HA   GLY  44          1HA       GLY  44  -2.529  -5.927   0.664
  329   2HA   GLY  44          2HA       GLY  44  -2.699  -5.500   2.369
  330    H    CYS  45           H        CYS  45  -1.131  -4.284  -0.005
  331    HA   CYS  45           HA       CYS  45   1.675  -4.549   0.610
  332   1HB   CYS  45          1HB       CYS  45  -0.034  -2.547  -0.880
  333   2HB   CYS  45          2HB       CYS  45   1.723  -2.411  -0.802
  334    H    TYR  46           H        TYR  46   2.608  -3.809   2.465
  335    HA   TYR  46           HA       TYR  46   1.483  -1.346   3.757
  336   1HB   TYR  46          1HB       TYR  46   1.521  -3.723   4.861
  337   2HB   TYR  46          2HB       TYR  46   3.242  -3.406   5.080
  338    HD1  TYR  46           HD1      TYR  46   0.274  -1.123   5.238
  339    HD2  TYR  46           HD2      TYR  46   3.581  -2.886   7.340
  340    HE1  TYR  46           HE1      TYR  46  -0.230   0.288   7.214
  341    HE2  TYR  46           HE2      TYR  46   3.074  -1.478   9.316
  342    HH   TYR  46           HH       TYR  46   1.382  -0.200  10.277
  343    H    CYS  47           H        CYS  47   3.045   0.247   4.467
  344    HA   CYS  47           HA       CYS  47   5.864  -0.209   3.560
  345   1HB   CYS  47          1HB       CYS  47   3.807   1.643   2.550
  346   2HB   CYS  47          2HB       CYS  47   5.357   2.410   2.894
  347    H    GLU  48           H        GLU  48   7.277   1.671   4.361
  348    HA   GLU  48           HA       GLU  48   6.305   2.813   6.951
  349   1HB   GLU  48          1HB       GLU  48   8.478   0.876   6.374
  350   2HB   GLU  48          2HB       GLU  48   8.902   2.177   7.486
  351   1HG   GLU  48          1HG       GLU  48   6.996   1.628   8.912
  352   2HG   GLU  48          2HG       GLU  48   6.473   0.386   7.774
  353    H    GLY  49           H        GLY  49   7.672   4.687   7.630
  354   1HA   GLY  49          1HA       GLY  49   9.098   6.536   7.200
  355   2HA   GLY  49          2HA       GLY  49   9.592   5.760   5.696
  356    H    LEU  50           H        LEU  50   6.275   5.672   5.781
  357    HA   LEU  50           HA       LEU  50   5.951   7.528   3.628
  358   1HB   LEU  50          1HB       LEU  50   3.918   6.431   5.595
  359   2HB   LEU  50          2HB       LEU  50   3.576   7.042   3.976
  360    HG   LEU  50           HG       LEU  50   5.632   4.905   4.161
  361   1HD1  LEU  50          1HD1      LEU  50   2.951   4.616   5.281
  362   2HD1  LEU  50          2HD1      LEU  50   3.238   3.489   3.954
  363   3HD1  LEU  50          3HD1      LEU  50   4.317   3.501   5.350
  364   1HD2  LEU  50          1HD2      LEU  50   3.340   5.660   2.337
  365   2HD2  LEU  50          2HD2      LEU  50   5.068   5.686   1.983
  366   3HD2  LEU  50          3HD2      LEU  50   4.225   4.146   2.147
  367    HA   PRO  51           HA       PRO  51   6.000  11.314   6.010
  368   1HB   PRO  51          1HB       PRO  51   4.515  12.581   3.870
  369   2HB   PRO  51          2HB       PRO  51   6.219  12.777   4.289
  370   1HG   PRO  51          1HG       PRO  51   5.148  11.420   2.027
  371   2HG   PRO  51          2HG       PRO  51   6.842  11.511   2.518
  372   1HD   PRO  51          1HD       PRO  51   5.067   9.223   2.632
  373   2HD   PRO  51          2HD       PRO  51   6.793   9.300   3.064
  374    H    ASP  52           H        ASP  52   4.437  12.426   7.283
  375    HA   ASP  52           HA       ASP  52   1.924  11.118   7.752
  376   1HB   ASP  52          1HB       ASP  52   3.576  13.211   8.827
  377   2HB   ASP  52          2HB       ASP  52   1.911  13.789   8.740
  378    H    SER  53           H        SER  53   2.847  13.271   5.288
  379    HA   SER  53           HA       SER  53   0.110  14.413   4.996
  380   1HB   SER  53          1HB       SER  53   2.865  15.003   3.952
  381   2HB   SER  53          2HB       SER  53   1.460  15.633   3.097
  382    HG   SER  53           HG       SER  53   0.888  16.196   5.491
  383    H    THR  54           H        THR  54   1.916  11.765   3.871
  384    HA   THR  54           HA       THR  54   0.922  11.715   1.125
  385    HB   THR  54           HB       THR  54   1.826   9.247   2.524
  386    HG1  THR  54           HG1      THR  54   3.404  10.265   3.441
  387   1HG2  THR  54          1HG2      THR  54   1.499   9.697  -0.013
  388   2HG2  THR  54          2HG2      THR  54   3.021  10.581   0.103
  389   3HG2  THR  54          3HG2      THR  54   2.967   8.864   0.502
  390    H    GLN  55           H        GLN  55  -0.813  10.456   0.330
  391    HA   GLN  55           HA       GLN  55  -3.025   9.956   2.132
  392   1HB   GLN  55          1HB       GLN  55  -4.044   9.059   0.030
  393   2HB   GLN  55          2HB       GLN  55  -3.290  10.635  -0.210
  394   1HG   GLN  55          1HG       GLN  55  -1.587   9.781  -1.495
  395   2HG   GLN  55          2HG       GLN  55  -1.563   8.245  -0.628
  396   1HE2  GLN  55          2HE2      GLN  55  -4.163   7.318  -0.885
  397   2HE2  GLN  55          1HE2      GLN  55  -4.562   7.118  -2.523
  398    H    THR  56           H        THR  56  -4.064   7.765   2.349
  399    HA   THR  56           HA       THR  56  -2.523   5.364   1.780
  400    HB   THR  56           HB       THR  56  -1.216   6.430   3.612
  401    HG1  THR  56           HG1      THR  56  -2.651   4.060   4.179
  402   1HG2  THR  56          1HG2      THR  56  -3.887   6.248   5.008
  403   2HG2  THR  56          2HG2      THR  56  -2.373   6.364   5.906
  404   3HG2  THR  56          3HG2      THR  56  -2.852   7.663   4.813
  405    H    TRP  57           H        TRP  57  -3.640   3.428   2.547
  406    HA   TRP  57           HA       TRP  57  -6.536   3.692   2.585
  407   1HB   TRP  57          1HB       TRP  57  -4.819   1.859   1.704
  408   2HB   TRP  57          2HB       TRP  57  -5.019   1.210   3.327
  409    HD1  TRP  57           HD1      TRP  57  -7.311   2.421   0.447
  410    HE1  TRP  57           HE1      TRP  57  -9.387   0.891   0.382
  411    HE3  TRP  57           HE3      TRP  57  -6.302  -0.603   4.433
  412    HZ2  TRP  57           HZ2      TRP  57 -10.473  -1.323   1.830
  413    HZ3  TRP  57           HZ3      TRP  57  -7.871  -2.412   5.068
  414    HH2  TRP  57           HH2      TRP  57  -9.953  -2.776   3.773
  415    HA   PRO  58           HA       PRO  58  -8.192   2.714   3.169
  416   1HB   PRO  58          1HB       PRO  58 -10.347   3.491   4.776
  417   2HB   PRO  58          2HB       PRO  58  -9.805   1.830   4.514
  418   1HG   PRO  58          1HG       PRO  58  -9.604   3.451   6.927
  419   2HG   PRO  58          2HG       PRO  58  -9.287   1.725   6.722
  420   1HD   PRO  58          1HD       PRO  58  -7.359   3.867   6.998
  421   2HD   PRO  58          2HD       PRO  58  -7.044   2.122   6.821
  422    H    LEU  59           H        LEU  59  -9.972   4.311   2.382
  423    HA   LEU  59           HA       LEU  59  -8.842   7.005   2.202
  424   1HB   LEU  59          1HB       LEU  59 -11.061   5.362   1.052
  425   2HB   LEU  59          2HB       LEU  59 -11.203   7.109   0.906
  426    HG   LEU  59           HG       LEU  59 -10.066   6.286  -1.067
  427   1HD1  LEU  59          1HD1      LEU  59  -9.173   8.364   0.200
  428   2HD1  LEU  59          2HD1      LEU  59  -7.832   7.326   0.674
  429   3HD1  LEU  59          3HD1      LEU  59  -8.138   7.649  -1.032
  430   1HD2  LEU  59          1HD2      LEU  59  -9.324   4.144   0.080
  431   2HD2  LEU  59          2HD2      LEU  59  -8.120   4.878  -0.978
  432   3HD2  LEU  59          3HD2      LEU  59  -7.989   5.067   0.770
  433    HA   PRO  60           HA       PRO  60 -11.180   9.314   5.150
  434   1HB   PRO  60          1HB       PRO  60 -12.911  10.614   3.180
  435   2HB   PRO  60          2HB       PRO  60 -11.650  11.321   4.196
  436   1HG   PRO  60          1HG       PRO  60 -11.485  10.859   1.423
  437   2HG   PRO  60          2HG       PRO  60 -10.147  11.283   2.495
  438   1HD   PRO  60          1HD       PRO  60 -10.656   8.757   1.166
  439   2HD   PRO  60          2HD       PRO  60  -9.248   9.215   2.152
  440    H    ASN  61           H        ASN  61 -13.830  10.111   5.240
  441    HA   ASN  61           HA       ASN  61 -15.252   7.840   6.077
  442   1HB   ASN  61          1HB       ASN  61 -16.057  10.565   5.047
  443   2HB   ASN  61          2HB       ASN  61 -17.258   9.418   5.639
  444   1HD2  ASN  61          2HD2      ASN  61 -16.298   8.325   7.885
  445   2HD2  ASN  61          1HD2      ASN  61 -15.806   9.487   9.021
  446    H    LYS  62           H        LYS  62 -15.173   9.381   2.884
  447    HA   LYS  62           HA       LYS  62 -17.083   7.413   1.770
  448   1HB   LYS  62          1HB       LYS  62 -15.983  10.023   1.132
  449   2HB   LYS  62          2HB       LYS  62 -15.879   8.948  -0.263
  450   1HG   LYS  62          1HG       LYS  62 -18.391   9.413   1.369
  451   2HG   LYS  62          2HG       LYS  62 -18.044  10.176  -0.183
  452   1HD   LYS  62          1HD       LYS  62 -18.034   8.052  -1.316
  453   2HD   LYS  62          2HD       LYS  62 -18.104   7.175   0.212
  454   1HE   LYS  62          1HE       LYS  62 -20.282   9.150  -0.375
  455   2HE   LYS  62          2HE       LYS  62 -20.324   7.573  -1.188
  456   1HZ   LYS  62          1HZ       LYS  62 -19.688   6.748   1.201
  457   2HZ   LYS  62          2HZ       LYS  62 -20.455   8.188   1.676
  458   3HZ   LYS  62          3HZ       LYS  62 -21.311   7.027   0.785
  459    H    THR  63           H        THR  63 -15.610   5.540   2.282
  460    HA   THR  63           HA       THR  63 -13.006   5.253   1.116
  461    HB   THR  63           HB       THR  63 -14.054   3.920   2.977
  462    HG1  THR  63           HG1      THR  63 -12.543   2.586   2.462
  463   1HG2  THR  63          1HG2      THR  63 -15.613   2.809   0.639
  464   2HG2  THR  63          2HG2      THR  63 -15.448   1.946   2.167
  465   3HG2  THR  63          3HG2      THR  63 -16.251   3.515   2.123
  466    H    CYS  64           H        CYS  64 -13.067   2.898  -0.277
  467    HA   CYS  64           HA       CYS  64 -13.823   3.745  -2.950
  468   1HB   CYS  64          1HB       CYS  64 -11.851   2.339  -2.310
  469   2HB   CYS  64          2HB       CYS  64 -12.960   1.043  -1.866
  Start of MODEL    8
    1   1H    LYS   1          1H        LYS   1   6.072   6.190   8.193
    2   2H    LYS   1          2H        LYS   1   6.244   7.128   9.599
    3   3H    LYS   1          3H        LYS   1   6.560   5.459   9.644
    4    HA   LYS   1           HA       LYS   1   4.430   5.756  10.632
    5   1HB   LYS   1          1HB       LYS   1   4.427   7.818   8.553
    6   2HB   LYS   1          2HB       LYS   1   2.888   6.968   8.665
    7   1HG   LYS   1          1HG       LYS   1   2.634   7.521  10.974
    8   2HG   LYS   1          2HG       LYS   1   4.310   8.059  11.100
    9   1HD   LYS   1          1HD       LYS   1   2.084   9.387   9.532
   10   2HD   LYS   1          2HD       LYS   1   2.917  10.032  10.949
   11   1HE   LYS   1          1HE       LYS   1   5.061   9.590   9.365
   12   2HE   LYS   1          2HE       LYS   1   3.837   9.900   8.117
   13   1HZ   LYS   1          1HZ       LYS   1   3.160  11.886   9.338
   14   2HZ   LYS   1          2HZ       LYS   1   4.375  11.609  10.492
   15   3HZ   LYS   1          3HZ       LYS   1   4.796  11.980   8.892
   16    H    ASP   2           H        ASP   2   3.945   3.596  10.373
   17    HA   ASP   2           HA       ASP   2   3.818   2.279   7.786
   18   1HB   ASP   2          1HB       ASP   2   2.698   1.356  10.442
   19   2HB   ASP   2          2HB       ASP   2   3.335   0.361   9.135
   20    H    GLY   3           H        GLY   3   1.902   1.548   6.704
   21   1HA   GLY   3          1HA       GLY   3  -0.746   2.048   7.777
   22   2HA   GLY   3          2HA       GLY   3  -0.304   3.244   6.559
   23    H    TYR   4           H        TYR   4  -2.351   1.956   5.688
   24    HA   TYR   4           HA       TYR   4  -1.388  -0.388   4.085
   25   1HB   TYR   4          1HB       TYR   4  -3.932   0.410   5.428
   26   2HB   TYR   4          2HB       TYR   4  -4.071  -0.511   3.930
   27    HD1  TYR   4           HD1      TYR   4  -2.994  -2.754   3.732
   28    HD2  TYR   4           HD2      TYR   4  -3.111  -0.602   7.450
   29    HE1  TYR   4           HE1      TYR   4  -2.435  -4.836   4.955
   30    HE2  TYR   4           HE2      TYR   4  -2.552  -2.685   8.672
   31    HH   TYR   4           HH       TYR   4  -2.708  -5.755   7.241
   32    H    LEU   5           H        LEU   5  -0.466   1.285   2.563
   33    HA   LEU   5           HA       LEU   5  -1.706   3.324   1.200
   34   1HB   LEU   5          1HB       LEU   5   0.433   1.478   0.803
   35   2HB   LEU   5          2HB       LEU   5  -0.438   1.618  -0.725
   36    HG   LEU   5           HG       LEU   5   0.030   4.173   0.697
   37   1HD1  LEU   5          1HD1      LEU   5   2.160   2.972   1.116
   38   2HD1  LEU   5          2HD1      LEU   5   2.307   2.655  -0.613
   39   3HD1  LEU   5          3HD1      LEU   5   2.378   4.312  -0.011
   40   1HD2  LEU   5          1HD2      LEU   5  -0.363   3.125  -1.998
   41   2HD2  LEU   5          2HD2      LEU   5  -0.622   4.759  -1.388
   42   3HD2  LEU   5          3HD2      LEU   5   0.982   4.263  -1.930
   43    H    VAL   6           H        VAL   6  -3.056   3.477  -0.673
   44    HA   VAL   6           HA       VAL   6  -4.868   1.128  -1.077
   45    HB   VAL   6           HB       VAL   6  -6.490   2.804  -1.713
   46   1HG1  VAL   6          1HG1      VAL   6  -5.440   2.608   0.786
   47   2HG1  VAL   6          2HG1      VAL   6  -5.183   4.324   0.470
   48   3HG1  VAL   6          3HG1      VAL   6  -6.807   3.647   0.386
   49   1HG2  VAL   6          1HG2      VAL   6  -4.137   4.721  -1.638
   50   2HG2  VAL   6          2HG2      VAL   6  -5.046   4.234  -3.069
   51   3HG2  VAL   6          3HG2      VAL   6  -5.820   5.214  -1.824
   52    H    GLU   7           H        GLU   7  -5.949   1.784  -3.512
   53    HA   GLU   7           HA       GLU   7  -3.687   1.232  -5.351
   54   1HB   GLU   7          1HB       GLU   7  -6.106   0.114  -5.080
   55   2HB   GLU   7          2HB       GLU   7  -6.543   1.388  -6.219
   56   1HG   GLU   7          1HG       GLU   7  -5.012   0.605  -7.855
   57   2HG   GLU   7          2HG       GLU   7  -4.163  -0.410  -6.689
   58    H    LYS   8           H        LYS   8  -3.844   2.364  -7.562
   59    HA   LYS   8           HA       LYS   8  -3.359   5.079  -7.477
   60   1HB   LYS   8          1HB       LYS   8  -4.311   3.110  -9.469
   61   2HB   LYS   8          2HB       LYS   8  -4.611   4.795  -9.896
   62   1HG   LYS   8          1HG       LYS   8  -1.971   4.623  -8.820
   63   2HG   LYS   8          2HG       LYS   8  -2.146   3.357 -10.036
   64   1HD   LYS   8          1HD       LYS   8  -3.397   5.737 -11.022
   65   2HD   LYS   8          2HD       LYS   8  -1.774   6.148 -10.463
   66   1HE   LYS   8          1HE       LYS   8  -0.746   4.828 -12.057
   67   2HE   LYS   8          2HE       LYS   8  -2.072   3.649 -12.083
   68   1HZ   LYS   8          1HZ       LYS   8  -2.424   6.441 -13.004
   69   2HZ   LYS   8          2HZ       LYS   8  -1.925   5.206 -14.058
   70   3HZ   LYS   8          3HZ       LYS   8  -3.434   5.106 -13.291
   71    H    THR   9           H        THR   9  -6.559   3.736  -8.411
   72    HA   THR   9           HA       THR   9  -7.936   6.236  -8.315
   73    HB   THR   9           HB       THR   9  -9.937   4.696  -8.240
   74    HG1  THR   9           HG1      THR   9  -9.653   2.653  -7.789
   75   1HG2  THR   9          1HG2      THR   9  -7.932   4.981 -10.221
   76   2HG2  THR   9          2HG2      THR   9  -8.429   3.288 -10.238
   77   3HG2  THR   9          3HG2      THR   9  -9.629   4.563 -10.458
   78    H    GLY  10           H        GLY  10  -7.291   3.799  -5.844
   79   1HA   GLY  10          1HA       GLY  10  -7.132   5.010  -3.539
   80   2HA   GLY  10          2HA       GLY  10  -8.812   5.432  -3.866
   81    H    CYS  11           H        CYS  11  -8.892   2.627  -5.273
   82    HA   CYS  11           HA       CYS  11 -10.177   1.233  -3.134
   83   1HB   CYS  11          1HB       CYS  11  -9.170   0.622  -5.891
   84   2HB   CYS  11          2HB       CYS  11  -9.705  -0.716  -4.873
   85    H    LYS  12           H        LYS  12  -9.291  -1.236  -2.817
   86    HA   LYS  12           HA       LYS  12  -6.616  -0.901  -1.555
   87   1HB   LYS  12          1HB       LYS  12  -7.379  -3.014  -0.390
   88   2HB   LYS  12          2HB       LYS  12  -8.424  -1.624  -0.130
   89   1HG   LYS  12          1HG       LYS  12 -10.105  -2.458  -1.515
   90   2HG   LYS  12          2HG       LYS  12  -8.986  -3.471  -2.427
   91   1HD   LYS  12          1HD       LYS  12  -9.075  -5.179  -0.904
   92   2HD   LYS  12          2HD       LYS  12  -9.236  -4.082   0.468
   93   1HE   LYS  12          1HE       LYS  12 -11.467  -4.472   0.488
   94   2HE   LYS  12          2HE       LYS  12 -11.582  -3.798  -1.149
   95   1HZ   LYS  12          1HZ       LYS  12 -10.461  -6.145  -1.670
   96   2HZ   LYS  12          2HZ       LYS  12 -11.367  -6.575  -0.304
   97   3HZ   LYS  12          3HZ       LYS  12 -12.143  -5.912  -1.662
   98    H    LYS  13           H        LYS  13  -5.660  -3.392  -1.419
   99    HA   LYS  13           HA       LYS  13  -5.759  -4.774  -4.021
  100   1HB   LYS  13          1HB       LYS  13  -3.333  -4.360  -4.420
  101   2HB   LYS  13          2HB       LYS  13  -4.264  -2.861  -4.424
  102   1HG   LYS  13          1HG       LYS  13  -3.650  -3.050  -1.781
  103   2HG   LYS  13          2HG       LYS  13  -2.230  -3.813  -2.496
  104   1HD   LYS  13          1HD       LYS  13  -3.084  -1.355  -3.874
  105   2HD   LYS  13          2HD       LYS  13  -2.560  -1.101  -2.209
  106   1HE   LYS  13          1HE       LYS  13  -0.382  -1.622  -2.687
  107   2HE   LYS  13          2HE       LYS  13  -0.841  -2.917  -3.809
  108   1HZ   LYS  13          1HZ       LYS  13  -1.787  -0.916  -5.168
  109   2HZ   LYS  13          2HZ       LYS  13  -0.633  -0.028  -4.296
  110   3HZ   LYS  13          3HZ       LYS  13  -0.142  -1.325  -5.278
  111    H    THR  14           H        THR  14  -6.421  -6.487  -2.501
  112    HA   THR  14           HA       THR  14  -4.706  -7.374  -0.343
  113    HB   THR  14           HB       THR  14  -6.813  -8.908  -1.891
  114    HG1  THR  14           HG1      THR  14  -8.266  -7.691  -0.986
  115   1HG2  THR  14          1HG2      THR  14  -5.369 -10.058  -0.130
  116   2HG2  THR  14          2HG2      THR  14  -6.136  -8.998   1.052
  117   3HG2  THR  14          3HG2      THR  14  -7.112 -10.141   0.129
  118    H    CYS  15           H        CYS  15  -3.491  -9.391  -0.311
  119    HA   CYS  15           HA       CYS  15  -2.715 -10.487  -2.985
  120   1HB   CYS  15          1HB       CYS  15  -0.359 -10.293  -2.329
  121   2HB   CYS  15          2HB       CYS  15  -1.127  -8.709  -2.221
  122    H    TYR  16           H        TYR  16  -2.619 -12.716  -2.923
  123    HA   TYR  16           HA       TYR  16  -3.209 -14.083  -0.389
  124   1HB   TYR  16          1HB       TYR  16  -3.062 -14.704  -3.309
  125   2HB   TYR  16          2HB       TYR  16  -2.947 -16.051  -2.177
  126    HD1  TYR  16           HD1      TYR  16  -4.914 -12.850  -2.251
  127    HD2  TYR  16           HD2      TYR  16  -4.988 -17.132  -1.916
  128    HE1  TYR  16           HE1      TYR  16  -7.369 -12.780  -1.907
  129    HE2  TYR  16           HE2      TYR  16  -7.444 -17.061  -1.574
  130    HH   TYR  16           HH       TYR  16  -9.345 -15.299  -2.283
  131    H    LYS  17           H        LYS  17  -0.405 -12.851  -1.396
  132    HA   LYS  17           HA       LYS  17   1.179 -15.206  -0.420
  133   1HB   LYS  17          1HB       LYS  17   1.417 -13.449  -2.818
  134   2HB   LYS  17          2HB       LYS  17   2.921 -13.940  -2.038
  135   1HG   LYS  17          1HG       LYS  17   1.065 -16.172  -2.281
  136   2HG   LYS  17          2HG       LYS  17   1.432 -15.458  -3.852
  137   1HD   LYS  17          1HD       LYS  17   3.367 -16.615  -3.816
  138   2HD   LYS  17          2HD       LYS  17   3.895 -15.539  -2.521
  139   1HE   LYS  17          1HE       LYS  17   4.112 -17.839  -1.734
  140   2HE   LYS  17          2HE       LYS  17   2.743 -17.100  -0.881
  141   1HZ   LYS  17          1HZ       LYS  17   1.937 -18.130  -3.407
  142   2HZ   LYS  17          2HZ       LYS  17   2.664 -19.351  -2.479
  143   3HZ   LYS  17          3HZ       LYS  17   1.334 -18.493  -1.860
  144    H    LEU  18           H        LEU  18   1.399 -14.367   1.710
  145    HA   LEU  18           HA       LEU  18   1.945 -11.676   2.432
  146   1HB   LEU  18          1HB       LEU  18   2.515 -14.390   3.625
  147   2HB   LEU  18          2HB       LEU  18   3.004 -12.915   4.460
  148    HG   LEU  18           HG       LEU  18   0.180 -13.433   3.499
  149   1HD1  LEU  18          1HD1      LEU  18   1.620 -14.412   5.844
  150   2HD1  LEU  18          2HD1      LEU  18   0.211 -13.447   6.288
  151   3HD1  LEU  18          3HD1      LEU  18   0.021 -14.858   5.246
  152   1HD2  LEU  18          1HD2      LEU  18   1.620 -11.238   4.904
  153   2HD2  LEU  18          2HD2      LEU  18   0.242 -11.156   3.807
  154   3HD2  LEU  18          3HD2      LEU  18   0.002 -11.623   5.491
  155    H    GLY  19           H        GLY  19   4.247 -11.354   3.712
  156   1HA   GLY  19          1HA       GLY  19   6.630 -11.374   3.565
  157   2HA   GLY  19          2HA       GLY  19   6.509 -12.358   2.107
  158    H    GLU  20           H        GLU  20   8.250 -10.479   1.729
  159    HA   GLU  20           HA       GLU  20   7.284  -7.853   1.047
  160   1HB   GLU  20          1HB       GLU  20   9.519  -7.697  -0.030
  161   2HB   GLU  20          2HB       GLU  20   9.619  -8.406   1.581
  162   1HG   GLU  20          1HG       GLU  20  10.414 -10.352   0.767
  163   2HG   GLU  20          2HG       GLU  20   9.135 -10.438  -0.444
  164    H    ASN  21           H        ASN  21   5.380  -8.339  -0.275
  165    HA   ASN  21           HA       ASN  21   5.539  -9.821  -2.750
  166   1HB   ASN  21          1HB       ASN  21   3.567  -8.910  -1.184
  167   2HB   ASN  21          2HB       ASN  21   3.610  -7.571  -2.332
  168   1HD2  ASN  21          2HD2      ASN  21   2.141 -10.527  -1.812
  169   2HD2  ASN  21          1HD2      ASN  21   1.754 -10.924  -3.417
  170    H    ASP  22           H        ASP  22   7.377  -8.999  -3.881
  171    HA   ASP  22           HA       ASP  22   8.427  -6.599  -4.446
  172   1HB   ASP  22          1HB       ASP  22   8.029  -9.058  -5.840
  173   2HB   ASP  22          2HB       ASP  22   7.827  -7.746  -7.000
  174    H    PHE  23           H        PHE  23   5.250  -7.602  -5.727
  175    HA   PHE  23           HA       PHE  23   4.657  -5.515  -7.476
  176   1HB   PHE  23          1HB       PHE  23   3.304  -7.524  -5.983
  177   2HB   PHE  23          2HB       PHE  23   2.406  -6.023  -5.753
  178    HD1  PHE  23           HD1      PHE  23   4.112  -7.962  -8.477
  179    HD2  PHE  23           HD2      PHE  23   0.846  -5.401  -7.370
  180    HE1  PHE  23           HE1      PHE  23   3.173  -8.171 -10.762
  181    HE2  PHE  23           HE2      PHE  23  -0.093  -5.610  -9.654
  182    HZ   PHE  23           HZ       PHE  23   1.070  -6.995 -11.351
  183    H    CYS  24           H        CYS  24   3.812  -5.473  -3.978
  184    HA   CYS  24           HA       CYS  24   3.256  -2.633  -3.975
  185   1HB   CYS  24          1HB       CYS  24   3.017  -4.891  -2.277
  186   2HB   CYS  24          2HB       CYS  24   3.978  -3.705  -1.394
  187    H    ASN  25           H        ASN  25   6.070  -4.605  -3.002
  188    HA   ASN  25           HA       ASN  25   7.754  -2.769  -1.800
  189   1HB   ASN  25          1HB       ASN  25   7.930  -5.216  -3.287
  190   2HB   ASN  25          2HB       ASN  25   9.251  -4.165  -3.797
  191   1HD2  ASN  25          2HD2      ASN  25  11.083  -4.375  -2.514
  192   2HD2  ASN  25          1HD2      ASN  25  11.084  -4.815  -0.874
  193    H    ARG  26           H        ARG  26   7.449  -3.222  -5.350
  194    HA   ARG  26           HA       ARG  26   9.088  -0.960  -6.046
  195   1HB   ARG  26          1HB       ARG  26   8.437  -2.938  -7.482
  196   2HB   ARG  26          2HB       ARG  26   6.822  -2.239  -7.607
  197   1HG   ARG  26          1HG       ARG  26   8.317  -1.639  -9.533
  198   2HG   ARG  26          2HG       ARG  26   7.700  -0.243  -8.660
  199   1HD   ARG  26          1HD       ARG  26   9.762   0.197  -7.634
  200   2HD   ARG  26          2HD       ARG  26  10.347  -1.458  -7.863
  201    HE   ARG  26           HE       ARG  26  10.619   0.737  -9.724
  202   1HH1  ARG  26          1HH1      ARG  26   9.862  -2.633  -9.617
  203   2HH1  ARG  26          2HH1      ARG  26  10.145  -2.873 -11.309
  204   1HH2  ARG  26          1HH2      ARG  26  11.002   0.431 -11.908
  205   2HH2  ARG  26          2HH2      ARG  26  10.792  -1.141 -12.603
  206    H    GLU  27           H        GLU  27   5.575  -1.385  -5.611
  207    HA   GLU  27           HA       GLU  27   4.734   1.208  -6.454
  208   1HB   GLU  27          1HB       GLU  27   3.466  -0.992  -5.783
  209   2HB   GLU  27          2HB       GLU  27   3.501  -0.306  -4.158
  210   1HG   GLU  27          1HG       GLU  27   2.648   1.530  -6.331
  211   2HG   GLU  27          2HG       GLU  27   1.529   0.228  -5.928
  212    H    CYS  28           H        CYS  28   5.737  -0.024  -3.261
  213    HA   CYS  28           HA       CYS  28   5.407   2.531  -1.908
  214   1HB   CYS  28          1HB       CYS  28   5.532  -0.040  -1.141
  215   2HB   CYS  28          2HB       CYS  28   7.229   0.381  -0.912
  216    H    LYS  29           H        LYS  29   8.102   0.781  -3.417
  217    HA   LYS  29           HA       LYS  29  10.078   2.796  -2.583
  218   1HB   LYS  29          1HB       LYS  29  10.189   0.158  -3.085
  219   2HB   LYS  29          2HB       LYS  29  10.599   0.750  -4.696
  220   1HG   LYS  29          1HG       LYS  29  12.588   1.681  -4.001
  221   2HG   LYS  29          2HG       LYS  29  11.984   2.020  -2.379
  222   1HD   LYS  29          1HD       LYS  29  13.166   0.203  -1.728
  223   2HD   LYS  29          2HD       LYS  29  11.900  -0.747  -2.506
  224   1HE   LYS  29          1HE       LYS  29  13.662  -1.585  -3.727
  225   2HE   LYS  29          2HE       LYS  29  13.457  -0.092  -4.666
  226   1HZ   LYS  29          1HZ       LYS  29  14.952   1.022  -3.090
  227   2HZ   LYS  29          2HZ       LYS  29  15.218  -0.457  -2.299
  228   3HZ   LYS  29          3HZ       LYS  29  15.728  -0.251  -3.904
  229    H    TRP  30           H        TRP  30   7.977   3.985  -4.069
  230    HA   TRP  30           HA       TRP  30   9.006   4.339  -6.835
  231   1HB   TRP  30          1HB       TRP  30   6.493   4.721  -5.323
  232   2HB   TRP  30          2HB       TRP  30   6.807   5.950  -6.546
  233    HD1  TRP  30           HD1      TRP  30   4.694   3.316  -6.497
  234    HE1  TRP  30           HE1      TRP  30   4.624   1.897  -8.645
  235    HE3  TRP  30           HE3      TRP  30   9.126   4.715  -8.638
  236    HZ2  TRP  30           HZ2      TRP  30   6.224   1.416 -10.961
  237    HZ3  TRP  30           HZ3      TRP  30   9.822   3.755 -10.813
  238    HH2  TRP  30           HH2      TRP  30   8.378   2.110 -11.977
  239    H    LYS  31           H        LYS  31   8.208   7.007  -7.235
  240    HA   LYS  31           HA       LYS  31  10.308   8.461  -5.691
  241   1HB   LYS  31          1HB       LYS  31   8.952   8.680  -8.353
  242   2HB   LYS  31          2HB       LYS  31   9.600  10.154  -7.634
  243   1HG   LYS  31          1HG       LYS  31  11.362   7.746  -7.628
  244   2HG   LYS  31          2HG       LYS  31  11.104   8.556  -9.173
  245   1HD   LYS  31          1HD       LYS  31  11.542  10.686  -7.494
  246   2HD   LYS  31          2HD       LYS  31  12.615   9.463  -6.813
  247   1HE   LYS  31          1HE       LYS  31  13.791   9.199  -8.882
  248   2HE   LYS  31          2HE       LYS  31  12.553  10.100  -9.779
  249   1HZ   LYS  31          1HZ       LYS  31  13.047  11.962  -8.129
  250   2HZ   LYS  31          2HZ       LYS  31  14.479  11.117  -7.782
  251   3HZ   LYS  31          3HZ       LYS  31  14.193  11.682  -9.354
  252    H    HIS  32           H        HIS  32   9.703  10.811  -5.171
  253    HA   HIS  32           HA       HIS  32   8.302  12.333  -4.029
  254   1HB   HIS  32          1HB       HIS  32   7.185  12.160  -6.260
  255   2HB   HIS  32          2HB       HIS  32   6.185  10.854  -5.623
  256    HD1  HIS  32           HD1      HIS  32   4.317  12.850  -6.321
  257    HD2  HIS  32           HD2      HIS  32   6.568  13.387  -2.854
  258    HE1  HIS  32           HE1      HIS  32   3.077  14.557  -4.918
  259    H    ILE  33           H        ILE  33   8.690   9.397  -3.052
  260    HA   ILE  33           HA       ILE  33   6.397   9.440  -1.112
  261    HB   ILE  33           HB       ILE  33   7.781   7.165  -2.554
  262   1HG1  ILE  33          1HG1      ILE  33   4.861   7.960  -2.320
  263   2HG1  ILE  33          2HG1      ILE  33   5.900   8.396  -3.676
  264   1HG2  ILE  33          1HG2      ILE  33   6.635   7.204   0.099
  265   2HG2  ILE  33          2HG2      ILE  33   5.652   6.194  -0.963
  266   3HG2  ILE  33          3HG2      ILE  33   7.371   5.853  -0.766
  267   1HD1  ILE  33          1HD1      ILE  33   5.908   5.527  -2.959
  268   2HD1  ILE  33          2HD1      ILE  33   4.381   6.135  -3.600
  269   3HD1  ILE  33          3HD1      ILE  33   5.860   6.292  -4.548
  270    H    GLY  34           H        GLY  34   9.703   8.098  -1.575
  271   1HA   GLY  34          1HA       GLY  34  11.527   8.088  -0.091
  272   2HA   GLY  34          2HA       GLY  34  10.651   9.251   0.903
  273    H    GLY  35           H        GLY  35   9.151   6.211   0.052
  274   1HA   GLY  35          1HA       GLY  35   8.638   5.531   2.781
  275   2HA   GLY  35          2HA       GLY  35   8.478   4.421   1.418
  276    H    SER  36           H        SER  36   9.522   3.553   3.898
  277    HA   SER  36           HA       SER  36  12.420   3.166   3.219
  278   1HB   SER  36          1HB       SER  36  12.110   2.633   5.920
  279   2HB   SER  36          2HB       SER  36  12.670   4.160   5.245
  280    HG   SER  36           HG       SER  36  10.165   3.430   6.243
  281    H    TYR  37           H        TYR  37   9.384   1.644   3.647
  282    HA   TYR  37           HA       TYR  37  10.496  -0.987   3.099
  283   1HB   TYR  37          1HB       TYR  37  10.867  -0.337   5.631
  284   2HB   TYR  37          2HB       TYR  37   9.160  -0.755   5.781
  285    HD1  TYR  37           HD1      TYR  37   8.605  -3.001   4.239
  286    HD2  TYR  37           HD2      TYR  37  12.306  -2.068   6.211
  287    HE1  TYR  37           HE1      TYR  37   9.195  -5.409   4.269
  288    HE2  TYR  37           HE2      TYR  37  12.896  -4.477   6.240
  289    HH   TYR  37           HH       TYR  37  11.577  -6.690   6.187
  290    H    GLY  38           H        GLY  38   8.913  -1.962   1.906
  291   1HA   GLY  38          1HA       GLY  38   6.075  -1.520   2.691
  292   2HA   GLY  38          2HA       GLY  38   6.557  -1.259   1.015
  293    H    TYR  39           H        TYR  39   5.120  -3.475   2.932
  294    HA   TYR  39           HA       TYR  39   5.725  -5.656   1.028
  295   1HB   TYR  39          1HB       TYR  39   6.611  -7.125   2.671
  296   2HB   TYR  39          2HB       TYR  39   7.395  -5.582   3.004
  297    HD1  TYR  39           HD1      TYR  39   5.860  -3.976   4.584
  298    HD2  TYR  39           HD2      TYR  39   5.790  -8.270   4.519
  299    HE1  TYR  39           HE1      TYR  39   4.927  -3.998   6.883
  300    HE2  TYR  39           HE2      TYR  39   4.855  -8.291   6.817
  301    HH   TYR  39           HH       TYR  39   4.999  -5.889   8.881
  302    H    CYS  40           H        CYS  40   4.169  -7.470   1.312
  303    HA   CYS  40           HA       CYS  40   1.505  -6.492   1.965
  304   1HB   CYS  40          1HB       CYS  40   2.750  -8.535   0.441
  305   2HB   CYS  40          2HB       CYS  40   1.676  -9.342   1.583
  306    H    TYR  41           H        TYR  41   0.385  -6.811   3.844
  307    HA   TYR  41           HA       TYR  41   1.402  -8.829   5.807
  308   1HB   TYR  41          1HB       TYR  41   2.236  -6.559   6.346
  309   2HB   TYR  41          2HB       TYR  41   0.579  -5.954   6.337
  310    HD1  TYR  41           HD1      TYR  41   2.084  -9.101   7.713
  311    HD2  TYR  41           HD2      TYR  41  -0.043  -5.462   8.537
  312    HE1  TYR  41           HE1      TYR  41   1.809  -9.797  10.078
  313    HE2  TYR  41           HE2      TYR  41  -0.317  -6.157  10.901
  314    HH   TYR  41           HH       TYR  41  -0.245  -8.028  12.285
  315    H    GLY  42           H        GLY  42  -0.268  -9.949   6.835
  316   1HA   GLY  42          1HA       GLY  42  -2.458 -10.691   7.243
  317   2HA   GLY  42          2HA       GLY  42  -2.914  -8.986   7.246
  318    H    PHE  43           H        PHE  43  -1.489 -10.817   4.570
  319    HA   PHE  43           HA       PHE  43  -2.324 -11.302   2.418
  320   1HB   PHE  43          1HB       PHE  43  -5.024 -10.870   3.725
  321   2HB   PHE  43          2HB       PHE  43  -4.662 -11.880   2.328
  322    HD1  PHE  43           HD1      PHE  43  -2.787 -13.734   2.753
  323    HD2  PHE  43           HD2      PHE  43  -5.173 -11.888   5.814
  324    HE1  PHE  43           HE1      PHE  43  -2.341 -15.654   4.261
  325    HE2  PHE  43           HE2      PHE  43  -4.727 -13.809   7.320
  326    HZ   PHE  43           HZ       PHE  43  -3.311 -15.691   6.543
  327    H    GLY  44           H        GLY  44  -2.073  -8.394   3.578
  328   1HA   GLY  44          1HA       GLY  44  -3.446  -7.123   1.252
  329   2HA   GLY  44          2HA       GLY  44  -3.622  -6.412   2.856
  330    H    CYS  45           H        CYS  45  -2.503  -4.885   0.835
  331    HA   CYS  45           HA       CYS  45   0.420  -5.061   0.888
  332   1HB   CYS  45          1HB       CYS  45  -1.718  -3.671  -0.507
  333   2HB   CYS  45          2HB       CYS  45  -0.415  -2.561  -0.084
  334    H    TYR  46           H        TYR  46   1.813  -3.798   2.142
  335    HA   TYR  46           HA       TYR  46   0.619  -1.731   3.942
  336   1HB   TYR  46          1HB       TYR  46   0.813  -4.101   4.907
  337   2HB   TYR  46          2HB       TYR  46   2.559  -3.876   4.819
  338    HD1  TYR  46           HD1      TYR  46  -0.570  -2.384   6.206
  339    HD2  TYR  46           HD2      TYR  46   3.704  -2.664   6.495
  340    HE1  TYR  46           HE1      TYR  46  -0.632  -1.127   8.343
  341    HE2  TYR  46           HE2      TYR  46   3.645  -1.415   8.632
  342    HH   TYR  46           HH       TYR  46   1.551  -1.120  10.534
  343    H    CYS  47           H        CYS  47   2.011   0.037   4.231
  344    HA   CYS  47           HA       CYS  47   4.766  -0.203   3.062
  345   1HB   CYS  47          1HB       CYS  47   2.548   1.753   2.799
  346   2HB   CYS  47          2HB       CYS  47   4.174   2.434   2.886
  347    H    GLU  48           H        GLU  48   6.255   1.584   3.999
  348    HA   GLU  48           HA       GLU  48   5.608   2.273   6.827
  349   1HB   GLU  48          1HB       GLU  48   8.061   0.749   5.891
  350   2HB   GLU  48          2HB       GLU  48   7.731   1.242   7.552
  351   1HG   GLU  48          1HG       GLU  48   5.637  -0.122   7.495
  352   2HG   GLU  48          2HG       GLU  48   6.087  -0.687   5.885
  353    H    GLY  49           H        GLY  49   6.583   4.216   7.458
  354   1HA   GLY  49          1HA       GLY  49   8.176   5.998   7.370
  355   2HA   GLY  49          2HA       GLY  49   8.832   5.308   5.885
  356    H    LEU  50           H        LEU  50   6.281   5.056   4.555
  357    HA   LEU  50           HA       LEU  50   6.022   7.216   2.958
  358   1HB   LEU  50          1HB       LEU  50   3.570   6.593   2.869
  359   2HB   LEU  50          2HB       LEU  50   4.680   5.234   2.723
  360    HG   LEU  50           HG       LEU  50   3.782   5.974   5.473
  361   1HD1  LEU  50          1HD1      LEU  50   1.934   5.469   3.351
  362   2HD1  LEU  50          2HD1      LEU  50   1.945   4.072   4.426
  363   3HD1  LEU  50          3HD1      LEU  50   1.596   5.676   5.070
  364   1HD2  LEU  50          1HD2      LEU  50   4.942   3.717   4.046
  365   2HD2  LEU  50          2HD2      LEU  50   4.905   4.044   5.779
  366   3HD2  LEU  50          3HD2      LEU  50   3.541   3.237   5.004
  367    HA   PRO  51           HA       PRO  51   5.166  10.498   5.953
  368   1HB   PRO  51          1HB       PRO  51   5.112  12.388   3.825
  369   2HB   PRO  51          2HB       PRO  51   6.460  12.046   4.913
  370   1HG   PRO  51          1HG       PRO  51   6.207  11.387   2.110
  371   2HG   PRO  51          2HG       PRO  51   7.600  11.160   3.170
  372   1HD   PRO  51          1HD       PRO  51   5.824   9.139   2.143
  373   2HD   PRO  51          2HD       PRO  51   7.207   8.915   3.243
  374    H    ASP  52           H        ASP  52   3.471  12.479   5.693
  375    HA   ASP  52           HA       ASP  52   0.865  11.309   5.362
  376   1HB   ASP  52          1HB       ASP  52   2.053  14.026   5.819
  377   2HB   ASP  52          2HB       ASP  52   0.335  13.909   5.433
  378    H    SER  53           H        SER  53   3.086  12.632   3.099
  379    HA   SER  53           HA       SER  53   1.405  13.812   1.150
  380   1HB   SER  53          1HB       SER  53   4.086  12.993   1.479
  381   2HB   SER  53          2HB       SER  53   3.530  12.210   0.004
  382    HG   SER  53           HG       SER  53   3.678  14.087  -0.908
  383    H    THR  54           H        THR  54   1.941  10.428   1.960
  384    HA   THR  54           HA       THR  54   0.394   9.550  -0.434
  385    HB   THR  54           HB       THR  54   1.867   7.977   1.703
  386    HG1  THR  54           HG1      THR  54   3.501   7.895   0.084
  387   1HG2  THR  54          1HG2      THR  54   0.204   7.252  -0.552
  388   2HG2  THR  54          2HG2      THR  54   1.845   6.641  -0.767
  389   3HG2  THR  54          3HG2      THR  54   0.926   6.212   0.676
  390    H    GLN  55           H        GLN  55  -1.535   8.300  -0.177
  391    HA   GLN  55           HA       GLN  55  -2.951   8.747   2.402
  392   1HB   GLN  55          1HB       GLN  55  -3.649   8.202  -0.464
  393   2HB   GLN  55          2HB       GLN  55  -4.836   7.805   0.777
  394   1HG   GLN  55          1HG       GLN  55  -3.502  10.480   0.905
  395   2HG   GLN  55          2HG       GLN  55  -4.750  10.233  -0.315
  396   1HE2  GLN  55          2HE2      GLN  55  -5.216   8.284   2.510
  397   2HE2  GLN  55          1HE2      GLN  55  -6.407   9.246   3.235
  398    H    THR  56           H        THR  56  -4.251   6.899   3.281
  399    HA   THR  56           HA       THR  56  -3.076   4.225   2.601
  400    HB   THR  56           HB       THR  56  -2.007   5.072   4.601
  401    HG1  THR  56           HG1      THR  56  -3.961   3.524   5.806
  402   1HG2  THR  56          1HG2      THR  56  -4.607   6.250   5.017
  403   2HG2  THR  56          2HG2      THR  56  -4.116   5.350   6.452
  404   3HG2  THR  56          3HG2      THR  56  -3.081   6.627   5.817
  405    H    TRP  57           H        TRP  57  -4.472   2.418   3.419
  406    HA   TRP  57           HA       TRP  57  -7.337   2.974   2.899
  407   1HB   TRP  57          1HB       TRP  57  -5.622   1.089   2.053
  408   2HB   TRP  57          2HB       TRP  57  -6.182   0.282   3.514
  409    HD1  TRP  57           HD1      TRP  57  -7.694   2.007   0.400
  410    HE1  TRP  57           HE1      TRP  57  -9.878   0.782  -0.214
  411    HE3  TRP  57           HE3      TRP  57  -7.908  -1.383   4.214
  412    HZ2  TRP  57           HZ2      TRP  57 -11.500  -1.351   0.781
  413    HZ3  TRP  57           HZ3      TRP  57  -9.781  -2.998   4.355
  414    HH2  TRP  57           HH2      TRP  57 -11.577  -2.987   2.646
  415    HA   PRO  58           HA       PRO  58  -9.172   1.913   3.208
  416   1HB   PRO  58          1HB       PRO  58 -11.369   2.872   4.711
  417   2HB   PRO  58          2HB       PRO  58 -11.051   1.194   4.258
  418   1HG   PRO  58          1HG       PRO  58 -10.915   2.385   6.880
  419   2HG   PRO  58          2HG       PRO  58 -10.659   0.695   6.432
  420   1HD   PRO  58          1HD       PRO  58  -8.671   2.680   7.181
  421   2HD   PRO  58          2HD       PRO  58  -8.431   0.948   6.845
  422    H    LEU  59           H        LEU  59 -10.746   3.736   2.372
  423    HA   LEU  59           HA       LEU  59  -9.290   6.278   2.449
  424   1HB   LEU  59          1HB       LEU  59 -11.584   5.025   0.989
  425   2HB   LEU  59          2HB       LEU  59 -11.455   6.783   0.965
  426    HG   LEU  59           HG       LEU  59  -9.185   6.643   0.077
  427   1HD1  LEU  59          1HD1      LEU  59  -9.620   3.649   0.287
  428   2HD1  LEU  59          2HD1      LEU  59  -8.260   4.406  -0.543
  429   3HD1  LEU  59          3HD1      LEU  59  -8.451   4.605   1.199
  430   1HD2  LEU  59          1HD2      LEU  59 -11.475   6.086  -1.307
  431   2HD2  LEU  59          2HD2      LEU  59  -9.893   6.275  -2.064
  432   3HD2  LEU  59          3HD2      LEU  59 -10.503   4.663  -1.686
  433    HA   PRO  60           HA       PRO  60 -11.641   8.447   5.476
  434   1HB   PRO  60          1HB       PRO  60 -12.174  10.729   3.814
  435   2HB   PRO  60          2HB       PRO  60 -10.926  10.552   5.051
  436   1HG   PRO  60          1HG       PRO  60 -10.572  10.642   2.211
  437   2HG   PRO  60          2HG       PRO  60  -9.333  10.430   3.451
  438   1HD   PRO  60          1HD       PRO  60 -10.347   8.455   1.597
  439   2HD   PRO  60          2HD       PRO  60  -9.077   8.254   2.829
  440    H    ASN  61           H        ASN  61 -13.716  10.265   5.094
  441    HA   ASN  61           HA       ASN  61 -16.052   8.763   4.997
  442   1HB   ASN  61          1HB       ASN  61 -15.625  11.210   5.623
  443   2HB   ASN  61          2HB       ASN  61 -15.764  11.573   3.901
  444   1HD2  ASN  61          2HD2      ASN  61 -17.602  12.144   6.351
  445   2HD2  ASN  61          1HD2      ASN  61 -19.129  11.623   5.822
  446    H    LYS  62           H        LYS  62 -14.126   9.971   2.334
  447    HA   LYS  62           HA       LYS  62 -16.178   9.252   0.318
  448   1HB   LYS  62          1HB       LYS  62 -14.236  11.176   0.512
  449   2HB   LYS  62          2HB       LYS  62 -13.429   9.978  -0.500
  450   1HG   LYS  62          1HG       LYS  62 -14.642  10.652  -2.270
  451   2HG   LYS  62          2HG       LYS  62 -16.123  10.218  -1.415
  452   1HD   LYS  62          1HD       LYS  62 -15.925  12.466  -0.213
  453   2HD   LYS  62          2HD       LYS  62 -14.688  12.880  -1.401
  454   1HE   LYS  62          1HE       LYS  62 -17.019  11.765  -2.727
  455   2HE   LYS  62          2HE       LYS  62 -17.470  13.164  -1.732
  456   1HZ   LYS  62          1HZ       LYS  62 -15.108  13.135  -3.529
  457   2HZ   LYS  62          2HZ       LYS  62 -16.623  13.726  -4.008
  458   3HZ   LYS  62          3HZ       LYS  62 -15.788  14.474  -2.731
  459    H    THR  63           H        THR  63 -16.318   7.077  -0.123
  460    HA   THR  63           HA       THR  63 -14.095   5.238   0.285
  461    HB   THR  63           HB       THR  63 -16.580   4.656  -1.303
  462    HG1  THR  63           HG1      THR  63 -16.566   4.788   1.511
  463   1HG2  THR  63          1HG2      THR  63 -14.538   3.136  -0.123
  464   2HG2  THR  63          2HG2      THR  63 -15.934   2.929   0.936
  465   3HG2  THR  63          3HG2      THR  63 -16.059   2.530  -0.778
  466    H    CYS  64           H        CYS  64 -13.388   3.764  -1.556
  467    HA   CYS  64           HA       CYS  64 -12.238   5.243  -3.709
  468   1HB   CYS  64          1HB       CYS  64 -11.311   3.149  -2.922
  469   2HB   CYS  64          2HB       CYS  64 -12.814   2.295  -3.274
  Start of MODEL    9
    1   1H    LYS   1          1H        LYS   1   6.461   4.391  11.247
    2   2H    LYS   1          2H        LYS   1   6.743   5.577  10.063
    3   3H    LYS   1          3H        LYS   1   6.435   6.038  11.667
    4    HA   LYS   1           HA       LYS   1   4.176   5.382  11.540
    5   1HB   LYS   1          1HB       LYS   1   5.425   7.335  10.003
    6   2HB   LYS   1          2HB       LYS   1   4.346   6.543   8.855
    7   1HG   LYS   1          1HG       LYS   1   3.388   7.392  11.590
    8   2HG   LYS   1          2HG       LYS   1   3.368   8.502  10.219
    9   1HD   LYS   1          1HD       LYS   1   2.244   6.236   9.134
   10   2HD   LYS   1          2HD       LYS   1   1.629   6.197  10.786
   11   1HE   LYS   1          1HE       LYS   1   1.520   8.725   9.121
   12   2HE   LYS   1          2HE       LYS   1   0.213   7.523   9.094
   13   1HZ   LYS   1          1HZ       LYS   1   0.280   7.618  11.582
   14   2HZ   LYS   1          2HZ       LYS   1   1.287   8.979  11.448
   15   3HZ   LYS   1          3HZ       LYS   1  -0.296   9.027  10.836
   16    H    ASP   2           H        ASP   2   2.441   4.382  10.234
   17    HA   ASP   2           HA       ASP   2   3.426   2.478   8.144
   18   1HB   ASP   2          1HB       ASP   2   1.474   1.802  10.358
   19   2HB   ASP   2          2HB       ASP   2   2.282   0.682   9.261
   20    H    GLY   3           H        GLY   3   1.543   1.585   6.855
   21   1HA   GLY   3          1HA       GLY   3  -1.034   2.910   7.013
   22   2HA   GLY   3          2HA       GLY   3  -0.050   3.540   5.691
   23    H    TYR   4           H        TYR   4  -2.105   2.491   4.608
   24    HA   TYR   4           HA       TYR   4  -1.359  -0.313   3.852
   25   1HB   TYR   4          1HB       TYR   4  -3.742   0.767   5.081
   26   2HB   TYR   4          2HB       TYR   4  -4.141   0.062   3.513
   27    HD1  TYR   4           HD1      TYR   4  -2.954  -2.265   3.004
   28    HD2  TYR   4           HD2      TYR   4  -3.619  -0.656   6.932
   29    HE1  TYR   4           HE1      TYR   4  -2.746  -4.539   3.973
   30    HE2  TYR   4           HE2      TYR   4  -3.408  -2.929   7.900
   31    HH   TYR   4           HH       TYR   4  -3.063  -5.779   5.828
   32    H    LEU   5           H        LEU   5  -1.002  -0.502   1.696
   33    HA   LEU   5           HA       LEU   5  -1.044   1.610  -0.158
   34   1HB   LEU   5          1HB       LEU   5  -0.510  -1.181  -0.039
   35   2HB   LEU   5          2HB       LEU   5  -1.529  -0.904  -1.451
   36    HG   LEU   5           HG       LEU   5   0.719   1.002  -0.987
   37   1HD1  LEU   5          1HD1      LEU   5   1.468  -1.499  -0.678
   38   2HD1  LEU   5          2HD1      LEU   5   1.257  -1.580  -2.427
   39   3HD1  LEU   5          3HD1      LEU   5   2.403  -0.436  -1.730
   40   1HD2  LEU   5          1HD2      LEU   5  -0.999   1.104  -2.867
   41   2HD2  LEU   5          2HD2      LEU   5   0.685   1.113  -3.386
   42   3HD2  LEU   5          3HD2      LEU   5  -0.265  -0.367  -3.503
   43    H    VAL   6           H        VAL   6  -2.439   1.939  -2.033
   44    HA   VAL   6           HA       VAL   6  -5.283   1.067  -1.633
   45    HB   VAL   6           HB       VAL   6  -5.961   3.305  -2.227
   46   1HG1  VAL   6          1HG1      VAL   6  -4.081   2.833  -0.067
   47   2HG1  VAL   6          2HG1      VAL   6  -4.009   4.506  -0.618
   48   3HG1  VAL   6          3HG1      VAL   6  -5.542   3.820  -0.077
   49   1HG2  VAL   6          1HG2      VAL   6  -3.316   3.343  -3.439
   50   2HG2  VAL   6          2HG2      VAL   6  -4.709   4.375  -3.770
   51   3HG2  VAL   6          3HG2      VAL   6  -3.594   4.789  -2.468
   52    H    GLU   7           H        GLU   7  -6.335   2.064  -3.964
   53    HA   GLU   7           HA       GLU   7  -4.573   1.104  -6.168
   54   1HB   GLU   7          1HB       GLU   7  -6.353  -0.385  -6.959
   55   2HB   GLU   7          2HB       GLU   7  -5.927  -0.789  -5.297
   56   1HG   GLU   7          1HG       GLU   7  -8.062  -0.470  -4.684
   57   2HG   GLU   7          2HG       GLU   7  -7.953   1.213  -5.203
   58    H    LYS   8           H        LYS   8  -5.739   1.525  -8.342
   59    HA   LYS   8           HA       LYS   8  -6.047   4.146  -8.955
   60   1HB   LYS   8          1HB       LYS   8  -6.439   1.793 -10.224
   61   2HB   LYS   8          2HB       LYS   8  -8.104   2.375 -10.159
   62   1HG   LYS   8          1HG       LYS   8  -5.930   4.256 -11.023
   63   2HG   LYS   8          2HG       LYS   8  -6.552   3.072 -12.174
   64   1HD   LYS   8          1HD       LYS   8  -8.205   4.561 -12.585
   65   2HD   LYS   8          2HD       LYS   8  -8.856   4.092 -11.014
   66   1HE   LYS   8          1HE       LYS   8  -7.653   5.903  -9.913
   67   2HE   LYS   8          2HE       LYS   8  -6.840   6.329 -11.432
   68   1HZ   LYS   8          1HZ       LYS   8  -9.174   6.478 -12.389
   69   2HZ   LYS   8          2HZ       LYS   8  -9.723   6.504 -10.785
   70   3HZ   LYS   8          3HZ       LYS   8  -8.695   7.734 -11.350
   71    H    THR   9           H        THR   9  -9.001   2.198  -8.292
   72    HA   THR   9           HA       THR   9 -10.699   4.503  -8.037
   73    HB   THR   9           HB       THR   9 -12.281   2.796  -7.134
   74    HG1  THR   9           HG1      THR   9 -10.168   1.687  -6.254
   75   1HG2  THR   9          1HG2      THR   9 -10.596   2.038  -9.527
   76   2HG2  THR   9          2HG2      THR   9 -12.098   1.213  -9.107
   77   3HG2  THR   9          3HG2      THR   9 -12.119   2.927  -9.523
   78    H    GLY  10           H        GLY  10  -8.590   2.863  -5.777
   79   1HA   GLY  10          1HA       GLY  10  -7.886   4.176  -3.791
   80   2HA   GLY  10          2HA       GLY  10  -9.555   4.721  -3.640
   81    H    CYS  11           H        CYS  11  -9.682   1.522  -4.516
   82    HA   CYS  11           HA       CYS  11 -10.572   0.672  -1.887
   83   1HB   CYS  11          1HB       CYS  11  -9.928  -0.834  -4.447
   84   2HB   CYS  11          2HB       CYS  11 -10.818  -1.503  -3.080
   85    H    LYS  12           H        LYS  12  -9.531  -1.048  -0.608
   86    HA   LYS  12           HA       LYS  12  -6.718  -0.722  -0.239
   87   1HB   LYS  12          1HB       LYS  12  -6.969  -2.528   1.319
   88   2HB   LYS  12          2HB       LYS  12  -8.488  -1.640   1.352
   89   1HG   LYS  12          1HG       LYS  12  -9.594  -3.276   0.018
   90   2HG   LYS  12          2HG       LYS  12  -8.071  -4.039  -0.437
   91   1HD   LYS  12          1HD       LYS  12  -7.741  -4.505   2.067
   92   2HD   LYS  12          2HD       LYS  12  -9.446  -4.090   2.250
   93   1HE   LYS  12          1HE       LYS  12  -8.323  -6.279   0.463
   94   2HE   LYS  12          2HE       LYS  12  -9.268  -6.509   1.947
   95   1HZ   LYS  12          1HZ       LYS  12 -10.931  -4.939   0.794
   96   2HZ   LYS  12          2HZ       LYS  12 -10.132  -5.378  -0.635
   97   3HZ   LYS  12          3HZ       LYS  12 -10.887  -6.568   0.313
   98    H    LYS  13           H        LYS  13  -5.698  -3.309  -0.147
   99    HA   LYS  13           HA       LYS  13  -5.967  -4.464  -2.871
  100   1HB   LYS  13          1HB       LYS  13  -4.037  -2.515  -2.159
  101   2HB   LYS  13          2HB       LYS  13  -3.175  -4.049  -2.279
  102   1HG   LYS  13          1HG       LYS  13  -4.710  -4.251  -4.483
  103   2HG   LYS  13          2HG       LYS  13  -4.577  -2.496  -4.394
  104   1HD   LYS  13          1HD       LYS  13  -2.370  -2.512  -4.939
  105   2HD   LYS  13          2HD       LYS  13  -2.040  -3.918  -3.928
  106   1HE   LYS  13          1HE       LYS  13  -1.768  -4.953  -5.968
  107   2HE   LYS  13          2HE       LYS  13  -3.538  -5.073  -5.897
  108   1HZ   LYS  13          1HZ       LYS  13  -3.448  -2.676  -6.803
  109   2HZ   LYS  13          2HZ       LYS  13  -1.875  -3.084  -7.300
  110   3HZ   LYS  13          3HZ       LYS  13  -3.202  -3.964  -7.883
  111    H    THR  14           H        THR  14  -6.205  -6.609  -2.371
  112    HA   THR  14           HA       THR  14  -4.769  -7.752  -0.036
  113    HB   THR  14           HB       THR  14  -6.988  -8.620  -1.896
  114    HG1  THR  14           HG1      THR  14  -6.779  -8.222   0.904
  115   1HG2  THR  14          1HG2      THR  14  -5.256 -10.261  -0.103
  116   2HG2  THR  14          2HG2      THR  14  -6.984 -10.612  -0.115
  117   3HG2  THR  14          3HG2      THR  14  -6.055 -10.708  -1.611
  118    H    CYS  15           H        CYS  15  -3.015  -9.129  -0.300
  119    HA   CYS  15           HA       CYS  15  -2.238  -9.777  -3.116
  120   1HB   CYS  15          1HB       CYS  15  -0.072  -9.296  -2.491
  121   2HB   CYS  15          2HB       CYS  15  -0.904  -8.315  -1.293
  122    H    TYR  16           H        TYR  16  -1.121 -11.897  -3.401
  123    HA   TYR  16           HA       TYR  16  -2.364 -13.983  -1.657
  124   1HB   TYR  16          1HB       TYR  16  -1.054 -14.375  -4.351
  125   2HB   TYR  16          2HB       TYR  16  -2.319 -15.347  -3.599
  126    HD1  TYR  16           HD1      TYR  16  -4.578 -14.116  -3.091
  127    HD2  TYR  16           HD2      TYR  16  -1.641 -12.710  -5.894
  128    HE1  TYR  16           HE1      TYR  16  -6.302 -12.719  -4.197
  129    HE2  TYR  16           HE2      TYR  16  -3.365 -11.312  -6.999
  130    HH   TYR  16           HH       TYR  16  -6.358 -11.692  -6.929
  131    H    LYS  17           H        LYS  17   0.675 -12.613  -2.644
  132    HA   LYS  17           HA       LYS  17   2.172 -14.909  -1.435
  133   1HB   LYS  17          1HB       LYS  17   3.269 -12.597  -3.050
  134   2HB   LYS  17          2HB       LYS  17   3.988 -14.188  -2.806
  135   1HG   LYS  17          1HG       LYS  17   1.810 -15.069  -3.957
  136   2HG   LYS  17          2HG       LYS  17   1.665 -13.415  -4.553
  137   1HD   LYS  17          1HD       LYS  17   2.886 -14.844  -6.164
  138   2HD   LYS  17          2HD       LYS  17   3.916 -13.556  -5.538
  139   1HE   LYS  17          1HE       LYS  17   5.382 -15.083  -4.740
  140   2HE   LYS  17          2HE       LYS  17   4.094 -15.871  -3.807
  141   1HZ   LYS  17          1HZ       LYS  17   4.547 -16.234  -6.723
  142   2HZ   LYS  17          2HZ       LYS  17   5.029 -17.340  -5.532
  143   3HZ   LYS  17          3HZ       LYS  17   3.377 -17.026  -5.780
  144    H    LEU  18           H        LEU  18   2.362 -14.454   0.767
  145    HA   LEU  18           HA       LEU  18   2.676 -11.717   1.754
  146   1HB   LEU  18          1HB       LEU  18   2.851 -14.470   3.019
  147   2HB   LEU  18          2HB       LEU  18   2.893 -12.961   3.933
  148    HG   LEU  18           HG       LEU  18   0.647 -13.714   2.048
  149   1HD1  LEU  18          1HD1      LEU  18   1.212 -14.920   4.484
  150   2HD1  LEU  18          2HD1      LEU  18   0.059 -13.658   4.915
  151   3HD1  LEU  18          3HD1      LEU  18  -0.371 -14.869   3.707
  152   1HD2  LEU  18          1HD2      LEU  18   1.340 -11.256   2.956
  153   2HD2  LEU  18          2HD2      LEU  18  -0.331 -11.732   2.656
  154   3HD2  LEU  18          3HD2      LEU  18   0.328 -11.794   4.292
  155    H    GLY  19           H        GLY  19   4.591 -11.336   3.346
  156   1HA   GLY  19          1HA       GLY  19   6.935 -11.650   3.869
  157   2HA   GLY  19          2HA       GLY  19   7.087 -12.658   2.429
  158    H    GLU  20           H        GLU  20   9.000 -11.144   2.127
  159    HA   GLU  20           HA       GLU  20   8.724  -8.375   1.534
  160   1HB   GLU  20          1HB       GLU  20  10.742 -10.149   1.746
  161   2HB   GLU  20          2HB       GLU  20  10.640 -10.054  -0.013
  162   1HG   GLU  20          1HG       GLU  20  10.541  -7.442   0.479
  163   2HG   GLU  20          2HG       GLU  20  11.365  -7.927   1.962
  164    H    ASN  21           H        ASN  21   6.576  -8.538   0.329
  165    HA   ASN  21           HA       ASN  21   6.632  -9.646  -2.390
  166   1HB   ASN  21          1HB       ASN  21   4.676  -9.502  -0.717
  167   2HB   ASN  21          2HB       ASN  21   4.589  -7.794  -1.149
  168   1HD2  ASN  21          2HD2      ASN  21   2.544  -9.858  -1.748
  169   2HD2  ASN  21          1HD2      ASN  21   2.402  -9.910  -3.439
  170    H    ASP  22           H        ASP  22   8.313  -8.389  -3.422
  171    HA   ASP  22           HA       ASP  22   8.782  -5.663  -3.418
  172   1HB   ASP  22          1HB       ASP  22   9.702  -7.729  -4.810
  173   2HB   ASP  22          2HB       ASP  22   8.605  -7.102  -6.041
  174    H    PHE  23           H        PHE  23   6.286  -7.333  -5.376
  175    HA   PHE  23           HA       PHE  23   5.252  -5.252  -6.878
  176   1HB   PHE  23          1HB       PHE  23   4.490  -7.809  -6.067
  177   2HB   PHE  23          2HB       PHE  23   3.153  -6.784  -5.541
  178    HD1  PHE  23           HD1      PHE  23   5.466  -6.409  -8.455
  179    HD2  PHE  23           HD2      PHE  23   1.439  -7.101  -7.131
  180    HE1  PHE  23           HE1      PHE  23   4.668  -6.242 -10.796
  181    HE2  PHE  23           HE2      PHE  23   0.642  -6.933  -9.475
  182    HZ   PHE  23           HZ       PHE  23   2.258  -6.504 -11.307
  183    H    CYS  24           H        CYS  24   4.098  -6.028  -3.556
  184    HA   CYS  24           HA       CYS  24   2.413  -3.816  -3.173
  185   1HB   CYS  24          1HB       CYS  24   4.278  -5.313  -1.305
  186   2HB   CYS  24          2HB       CYS  24   3.062  -4.171  -0.737
  187    H    ASN  25           H        ASN  25   5.934  -4.049  -2.577
  188    HA   ASN  25           HA       ASN  25   6.347  -1.399  -1.617
  189   1HB   ASN  25          1HB       ASN  25   8.077  -3.002  -1.380
  190   2HB   ASN  25          2HB       ASN  25   8.002  -3.459  -3.081
  191   1HD2  ASN  25          2HD2      ASN  25   9.222  -2.211  -4.594
  192   2HD2  ASN  25          1HD2      ASN  25  10.226  -0.922  -4.132
  193    H    ARG  26           H        ARG  26   6.472  -2.717  -4.943
  194    HA   ARG  26           HA       ARG  26   7.197  -0.335  -6.306
  195   1HB   ARG  26          1HB       ARG  26   6.550  -2.954  -6.903
  196   2HB   ARG  26          2HB       ARG  26   5.212  -2.062  -7.628
  197   1HG   ARG  26          1HG       ARG  26   6.826  -2.091  -9.342
  198   2HG   ARG  26          2HG       ARG  26   7.062  -0.511  -8.593
  199   1HD   ARG  26          1HD       ARG  26   9.157  -1.055  -7.896
  200   2HD   ARG  26          2HD       ARG  26   8.620  -2.632  -7.287
  201    HE   ARG  26           HE       ARG  26   8.481  -2.862 -10.065
  202   1HH1  ARG  26          1HH1      ARG  26  10.880  -2.034  -7.721
  203   2HH1  ARG  26          2HH1      ARG  26  12.194  -2.656  -8.660
  204   1HH2  ARG  26          1HH2      ARG  26  10.189  -3.675 -11.296
  205   2HH2  ARG  26          2HH2      ARG  26  11.805  -3.583 -10.678
  206    H    GLU  27           H        GLU  27   3.993  -1.571  -5.349
  207    HA   GLU  27           HA       GLU  27   2.529   0.655  -6.515
  208   1HB   GLU  27          1HB       GLU  27   1.858  -1.474  -4.456
  209   2HB   GLU  27          2HB       GLU  27   0.671  -0.409  -5.210
  210   1HG   GLU  27          1HG       GLU  27   2.520  -1.949  -6.988
  211   2HG   GLU  27          2HG       GLU  27   1.180  -2.809  -6.229
  212    H    CYS  28           H        CYS  28   3.802  -0.141  -3.289
  213    HA   CYS  28           HA       CYS  28   2.528   1.867  -1.755
  214   1HB   CYS  28          1HB       CYS  28   4.684   0.004  -1.563
  215   2HB   CYS  28          2HB       CYS  28   5.274   1.559  -0.976
  216    H    LYS  29           H        LYS  29   5.477   2.039  -3.750
  217    HA   LYS  29           HA       LYS  29   5.969   4.860  -3.150
  218   1HB   LYS  29          1HB       LYS  29   7.147   2.616  -4.641
  219   2HB   LYS  29          2HB       LYS  29   7.353   4.167  -5.455
  220   1HG   LYS  29          1HG       LYS  29   8.833   4.904  -3.909
  221   2HG   LYS  29          2HG       LYS  29   7.855   4.309  -2.569
  222   1HD   LYS  29          1HD       LYS  29   8.704   2.050  -2.887
  223   2HD   LYS  29          2HD       LYS  29   9.588   2.551  -4.329
  224   1HE   LYS  29          1HE       LYS  29  11.274   3.521  -3.116
  225   2HE   LYS  29          2HE       LYS  29  10.162   4.124  -1.872
  226   1HZ   LYS  29          1HZ       LYS  29   9.894   1.468  -1.606
  227   2HZ   LYS  29          2HZ       LYS  29  11.532   1.576  -2.039
  228   3HZ   LYS  29          3HZ       LYS  29  10.955   2.409  -0.676
  229    H    TRP  30           H        TRP  30   3.378   4.854  -3.882
  230    HA   TRP  30           HA       TRP  30   2.742   4.939  -6.656
  231   1HB   TRP  30          1HB       TRP  30   1.514   5.308  -4.143
  232   2HB   TRP  30          2HB       TRP  30   1.179   6.775  -5.061
  233    HD1  TRP  30           HD1      TRP  30  -0.401   3.686  -4.428
  234    HE1  TRP  30           HE1      TRP  30  -1.891   2.892  -6.378
  235    HE3  TRP  30           HE3      TRP  30   1.380   6.673  -8.163
  236    HZ2  TRP  30           HZ2      TRP  30  -2.272   3.453  -9.159
  237    HZ3  TRP  30           HZ3      TRP  30   0.437   6.525 -10.450
  238    HH2  TRP  30           HH2      TRP  30  -1.385   4.920 -10.953
  239    H    LYS  31           H        LYS  31   2.758   7.882  -4.605
  240    HA   LYS  31           HA       LYS  31   3.789   9.367  -6.993
  241   1HB   LYS  31          1HB       LYS  31   1.551   9.660  -5.326
  242   2HB   LYS  31          2HB       LYS  31   2.640  10.967  -4.862
  243   1HG   LYS  31          1HG       LYS  31   2.645  10.724  -7.724
  244   2HG   LYS  31          2HG       LYS  31   0.977  10.831  -7.160
  245   1HD   LYS  31          1HD       LYS  31   1.470  12.868  -5.930
  246   2HD   LYS  31          2HD       LYS  31   3.185  12.728  -6.317
  247   1HE   LYS  31          1HE       LYS  31   2.696  13.015  -8.712
  248   2HE   LYS  31          2HE       LYS  31   0.960  13.105  -8.355
  249   1HZ   LYS  31          1HZ       LYS  31   1.933  14.855  -6.597
  250   2HZ   LYS  31          2HZ       LYS  31   3.053  15.059  -7.858
  251   3HZ   LYS  31          3HZ       LYS  31   1.396  15.296  -8.144
  252    H    HIS  32           H        HIS  32   4.708   8.403  -3.815
  253    HA   HIS  32           HA       HIS  32   7.021  10.284  -3.971
  254   1HB   HIS  32          1HB       HIS  32   4.750  10.496  -2.238
  255   2HB   HIS  32          2HB       HIS  32   6.162  10.104  -1.255
  256    HD1  HIS  32           HD1      HIS  32   4.542  12.992  -1.886
  257    HD2  HIS  32           HD2      HIS  32   8.434  11.863  -2.864
  258    HE1  HIS  32           HE1      HIS  32   5.843  15.136  -2.239
  259    H    ILE  33           H        ILE  33   8.629   9.688  -2.133
  260    HA   ILE  33           HA       ILE  33   8.860   6.707  -2.045
  261    HB   ILE  33           HB       ILE  33  11.020   8.726  -1.437
  262   1HG1  ILE  33          1HG1      ILE  33  10.021   9.431  -3.568
  263   2HG1  ILE  33          2HG1      ILE  33  11.599   8.699  -3.856
  264   1HG2  ILE  33          1HG2      ILE  33  10.858   5.896  -1.645
  265   2HG2  ILE  33          2HG2      ILE  33  11.791   6.461  -3.031
  266   3HG2  ILE  33          3HG2      ILE  33  12.303   6.878  -1.396
  267   1HD1  ILE  33          1HD1      ILE  33   8.958   7.229  -4.081
  268   2HD1  ILE  33          2HD1      ILE  33   9.856   7.885  -5.449
  269   3HD1  ILE  33          3HD1      ILE  33  10.551   6.587  -4.480
  270    H    GLY  34           H        GLY  34   7.763   9.136  -0.123
  271   1HA   GLY  34          1HA       GLY  34   8.984   9.145   2.328
  272   2HA   GLY  34          2HA       GLY  34   7.229   9.087   2.180
  273    H    GLY  35           H        GLY  35   7.272   6.420   0.903
  274   1HA   GLY  35          1HA       GLY  35   7.235   4.840   3.341
  275   2HA   GLY  35          2HA       GLY  35   6.940   4.228   1.712
  276    H    SER  36           H        SER  36   9.276   4.552   4.226
  277    HA   SER  36           HA       SER  36  11.636   4.021   2.610
  278   1HB   SER  36          1HB       SER  36  12.722   4.078   4.701
  279   2HB   SER  36          2HB       SER  36  11.326   5.123   4.950
  280    HG   SER  36           HG       SER  36  11.186   3.759   6.614
  281    H    TYR  37           H        TYR  37   9.024   2.086   3.424
  282    HA   TYR  37           HA       TYR  37  10.451  -0.365   2.657
  283   1HB   TYR  37          1HB       TYR  37  10.987  -0.064   5.062
  284   2HB   TYR  37          2HB       TYR  37   9.260  -0.046   5.426
  285    HD1  TYR  37           HD1      TYR  37  11.668  -2.127   3.426
  286    HD2  TYR  37           HD2      TYR  37   8.330  -2.057   6.133
  287    HE1  TYR  37           HE1      TYR  37  11.644  -4.608   3.464
  288    HE2  TYR  37           HE2      TYR  37   8.306  -4.540   6.168
  289    HH   TYR  37           HH       TYR  37   9.396  -6.395   5.560
  290    H    GLY  38           H        GLY  38   8.994  -1.766   1.691
  291   1HA   GLY  38          1HA       GLY  38   6.113  -1.501   2.364
  292   2HA   GLY  38          2HA       GLY  38   6.591  -1.288   0.680
  293    H    TYR  39           H        TYR  39   5.009  -3.430   2.178
  294    HA   TYR  39           HA       TYR  39   5.867  -5.682   0.606
  295   1HB   TYR  39          1HB       TYR  39   7.007  -6.974   2.219
  296   2HB   TYR  39          2HB       TYR  39   7.628  -5.351   2.498
  297    HD1  TYR  39           HD1      TYR  39   5.118  -4.217   3.859
  298    HD2  TYR  39           HD2      TYR  39   7.301  -7.874   4.412
  299    HE1  TYR  39           HE1      TYR  39   4.335  -4.330   6.207
  300    HE2  TYR  39           HE2      TYR  39   6.516  -7.986   6.762
  301    HH   TYR  39           HH       TYR  39   5.272  -7.042   8.327
  302    H    CYS  40           H        CYS  40   4.532  -7.677   1.242
  303    HA   CYS  40           HA       CYS  40   1.853  -6.761   2.086
  304   1HB   CYS  40          1HB       CYS  40   2.425  -8.227   0.067
  305   2HB   CYS  40          2HB       CYS  40   2.722  -9.525   1.224
  306    H    TYR  41           H        TYR  41   0.860  -7.340   3.976
  307    HA   TYR  41           HA       TYR  41   2.259  -9.282   5.783
  308   1HB   TYR  41          1HB       TYR  41   2.764  -7.093   6.599
  309   2HB   TYR  41          2HB       TYR  41   1.122  -6.523   6.295
  310    HD1  TYR  41           HD1      TYR  41   3.084  -8.961   8.332
  311    HD2  TYR  41           HD2      TYR  41  -0.536  -6.681   7.965
  312    HE1  TYR  41           HE1      TYR  41   2.419  -9.648  10.622
  313    HE2  TYR  41           HE2      TYR  41  -1.200  -7.366  10.254
  314    HH   TYR  41           HH       TYR  41   0.908  -9.450  12.235
  315    H    GLY  42           H        GLY  42   0.854 -10.953   6.197
  316   1HA   GLY  42          1HA       GLY  42  -1.182 -11.972   6.897
  317   2HA   GLY  42          2HA       GLY  42  -1.961 -10.387   6.831
  318    H    PHE  43           H        PHE  43  -2.296  -9.488   4.597
  319    HA   PHE  43           HA       PHE  43  -2.221 -11.269   2.300
  320   1HB   PHE  43          1HB       PHE  43  -4.684 -10.956   3.985
  321   2HB   PHE  43          2HB       PHE  43  -4.875 -11.110   2.238
  322    HD1  PHE  43           HD1      PHE  43  -2.633 -12.905   1.534
  323    HD2  PHE  43           HD2      PHE  43  -5.362 -13.043   4.850
  324    HE1  PHE  43           HE1      PHE  43  -2.285 -15.351   1.718
  325    HE2  PHE  43           HE2      PHE  43  -5.016 -15.490   5.032
  326    HZ   PHE  43           HZ       PHE  43  -3.476 -16.645   3.468
  327    H    GLY  44           H        GLY  44  -1.630  -8.432   3.211
  328   1HA   GLY  44          1HA       GLY  44  -2.746  -7.103   0.823
  329   2HA   GLY  44          2HA       GLY  44  -3.166  -6.377   2.376
  330    H    CYS  45           H        CYS  45  -1.571  -5.103   0.333
  331    HA   CYS  45           HA       CYS  45   1.245  -5.259   1.064
  332   1HB   CYS  45          1HB       CYS  45  -0.369  -3.198  -0.474
  333   2HB   CYS  45          2HB       CYS  45   1.386  -3.363  -0.509
  334    H    TYR  46           H        TYR  46   2.201  -4.184   2.757
  335    HA   TYR  46           HA       TYR  46   0.693  -1.905   4.000
  336   1HB   TYR  46          1HB       TYR  46   0.902  -4.229   5.154
  337   2HB   TYR  46          2HB       TYR  46   2.580  -3.768   5.436
  338    HD1  TYR  46           HD1      TYR  46  -0.867  -2.307   5.739
  339    HD2  TYR  46           HD2      TYR  46   3.078  -2.632   7.408
  340    HE1  TYR  46           HE1      TYR  46  -1.577  -0.937   7.681
  341    HE2  TYR  46           HE2      TYR  46   2.368  -1.263   9.351
  342    HH   TYR  46           HH       TYR  46   0.093  -0.774  10.517
  343    H    CYS  47           H        CYS  47   1.883  -0.032   4.292
  344    HA   CYS  47           HA       CYS  47   4.744  -0.076   3.435
  345   1HB   CYS  47          1HB       CYS  47   2.465   1.595   3.009
  346   2HB   CYS  47          2HB       CYS  47   3.672   2.543   3.878
  347    H    GLU  48           H        GLU  48   6.363   0.731   4.838
  348    HA   GLU  48           HA       GLU  48   5.461   1.462   7.606
  349   1HB   GLU  48          1HB       GLU  48   7.790  -0.268   6.715
  350   2HB   GLU  48          2HB       GLU  48   7.411   0.142   8.388
  351   1HG   GLU  48          1HG       GLU  48   5.058  -0.845   7.845
  352   2HG   GLU  48          2HG       GLU  48   5.878  -1.615   6.485
  353    H    GLY  49           H        GLY  49   6.668   3.118   8.604
  354   1HA   GLY  49          1HA       GLY  49   8.240   4.859   8.802
  355   2HA   GLY  49          2HA       GLY  49   9.189   4.070   7.542
  356    H    LEU  50           H        LEU  50   5.826   4.955   7.079
  357    HA   LEU  50           HA       LEU  50   6.684   6.812   4.919
  358   1HB   LEU  50          1HB       LEU  50   4.197   6.540   4.332
  359   2HB   LEU  50          2HB       LEU  50   5.206   5.105   4.177
  360    HG   LEU  50           HG       LEU  50   3.945   5.538   6.834
  361   1HD1  LEU  50          1HD1      LEU  50   2.424   5.341   4.305
  362   2HD1  LEU  50          2HD1      LEU  50   1.951   4.184   5.549
  363   3HD1  LEU  50          3HD1      LEU  50   1.903   5.914   5.890
  364   1HD2  LEU  50          1HD2      LEU  50   5.129   3.433   5.270
  365   2HD2  LEU  50          2HD2      LEU  50   4.631   3.391   6.962
  366   3HD2  LEU  50          3HD2      LEU  50   3.482   2.971   5.693
  367    HA   PRO  51           HA       PRO  51   5.749   9.995   8.037
  368   1HB   PRO  51          1HB       PRO  51   6.292  11.870   5.888
  369   2HB   PRO  51          2HB       PRO  51   7.233  11.567   7.351
  370   1HG   PRO  51          1HG       PRO  51   7.897  10.811   4.686
  371   2HG   PRO  51          2HG       PRO  51   8.774  10.406   6.164
  372   1HD   PRO  51          1HD       PRO  51   7.222   8.643   4.485
  373   2HD   PRO  51          2HD       PRO  51   8.113   8.233   5.970
  374    H    ASP  52           H        ASP  52   3.981  11.506   8.215
  375    HA   ASP  52           HA       ASP  52   1.526  10.884   7.092
  376   1HB   ASP  52          1HB       ASP  52   2.559  12.744   8.824
  377   2HB   ASP  52          2HB       ASP  52   2.014  13.770   7.495
  378    H    SER  53           H        SER  53   4.135  12.649   5.567
  379    HA   SER  53           HA       SER  53   2.651  14.052   3.567
  380   1HB   SER  53          1HB       SER  53   5.420  12.851   3.325
  381   2HB   SER  53          2HB       SER  53   4.811  14.311   2.549
  382    HG   SER  53           HG       SER  53   5.003  15.384   4.387
  383    H    THR  54           H        THR  54   3.494  10.677   3.882
  384    HA   THR  54           HA       THR  54   3.115  10.058   1.036
  385    HB   THR  54           HB       THR  54   3.177   8.145   3.376
  386    HG1  THR  54           HG1      THR  54   5.366   9.395   2.078
  387   1HG2  THR  54          1HG2      THR  54   2.768   7.413   0.953
  388   2HG2  THR  54          2HG2      THR  54   4.438   7.893   0.645
  389   3HG2  THR  54          3HG2      THR  54   4.088   6.613   1.806
  390    H    GLN  55           H        GLN  55   1.245   9.217   0.114
  391    HA   GLN  55           HA       GLN  55  -1.245   9.406   1.699
  392   1HB   GLN  55          1HB       GLN  55  -0.383   9.341  -1.148
  393   2HB   GLN  55          2HB       GLN  55  -1.986   8.689  -0.808
  394   1HG   GLN  55          1HG       GLN  55  -1.904  11.011   0.712
  395   2HG   GLN  55          2HG       GLN  55  -1.072  11.466  -0.775
  396   1HE2  GLN  55          2HE2      GLN  55  -4.129  10.050   0.443
  397   2HE2  GLN  55          1HE2      GLN  55  -5.053  10.479  -0.914
  398    H    THR  56           H        THR  56  -2.695   7.614   1.937
  399    HA   THR  56           HA       THR  56  -1.991   4.956   0.938
  400    HB   THR  56           HB       THR  56  -0.410   4.941   2.673
  401    HG1  THR  56           HG1      THR  56  -2.790   4.085   3.941
  402   1HG2  THR  56          1HG2      THR  56  -2.419   6.640   4.116
  403   2HG2  THR  56          2HG2      THR  56  -1.192   5.768   5.032
  404   3HG2  THR  56          3HG2      THR  56  -0.710   6.953   3.819
  405    H    TRP  57           H        TRP  57  -3.493   3.286   2.045
  406    HA   TRP  57           HA       TRP  57  -6.235   4.279   1.967
  407   1HB   TRP  57          1HB       TRP  57  -5.023   1.987   1.297
  408   2HB   TRP  57          2HB       TRP  57  -5.441   1.566   2.953
  409    HD1  TRP  57           HD1      TRP  57  -7.171   2.936  -0.225
  410    HE1  TRP  57           HE1      TRP  57  -9.600   2.073  -0.252
  411    HE3  TRP  57           HE3      TRP  57  -7.278   0.469   4.242
  412    HZ2  TRP  57           HZ2      TRP  57 -11.358   0.539   1.406
  413    HZ3  TRP  57           HZ3      TRP  57  -9.337  -0.684   4.995
  414    HH2  TRP  57           HH2      TRP  57 -11.376  -0.653   3.585
  415    HA   PRO  58           HA       PRO  58  -8.178   3.715   2.723
  416   1HB   PRO  58          1HB       PRO  58  -9.785   5.552   4.153
  417   2HB   PRO  58          2HB       PRO  58  -9.955   3.794   4.135
  418   1HG   PRO  58          1HG       PRO  58  -9.016   5.501   6.290
  419   2HG   PRO  58          2HG       PRO  58  -9.374   3.771   6.328
  420   1HD   PRO  58          1HD       PRO  58  -6.785   5.028   6.347
  421   2HD   PRO  58          2HD       PRO  58  -7.146   3.285   6.326
  422    H    LEU  59           H        LEU  59  -8.200   5.099   0.969
  423    HA   LEU  59           HA       LEU  59  -6.626   7.479   0.866
  424   1HB   LEU  59          1HB       LEU  59  -8.716   6.110  -0.802
  425   2HB   LEU  59          2HB       LEU  59  -8.204   7.726  -1.271
  426    HG   LEU  59           HG       LEU  59  -6.510   5.232  -1.042
  427   1HD1  LEU  59          1HD1      LEU  59  -7.874   6.340  -3.158
  428   2HD1  LEU  59          2HD1      LEU  59  -6.271   7.048  -3.345
  429   3HD1  LEU  59          3HD1      LEU  59  -6.461   5.295  -3.310
  430   1HD2  LEU  59          1HD2      LEU  59  -5.704   8.135  -1.037
  431   2HD2  LEU  59          2HD2      LEU  59  -5.073   6.812  -0.058
  432   3HD2  LEU  59          3HD2      LEU  59  -4.653   6.923  -1.768
  433    HA   PRO  60           HA       PRO  60  -9.085  10.846   2.262
  434   1HB   PRO  60          1HB       PRO  60  -9.368  12.083  -0.352
  435   2HB   PRO  60          2HB       PRO  60  -8.380  12.604   1.015
  436   1HG   PRO  60          1HG       PRO  60  -7.471  11.431  -1.413
  437   2HG   PRO  60          2HG       PRO  60  -6.504  11.824   0.011
  438   1HD   PRO  60          1HD       PRO  60  -7.217   9.213  -0.971
  439   2HD   PRO  60          2HD       PRO  60  -6.258   9.606   0.474
  440    H    ASN  61           H        ASN  61 -11.083  12.281   0.905
  441    HA   ASN  61           HA       ASN  61 -13.433  10.866   1.294
  442   1HB   ASN  61          1HB       ASN  61 -12.802  12.890  -0.883
  443   2HB   ASN  61          2HB       ASN  61 -14.418  12.508  -0.288
  444   1HD2  ASN  61          2HD2      ASN  61 -14.502  12.678   2.308
  445   2HD2  ASN  61          1HD2      ASN  61 -13.774  14.071   2.948
  446    H    LYS  62           H        LYS  62 -11.185  10.627  -1.368
  447    HA   LYS  62           HA       LYS  62 -12.926   9.182  -3.194
  448   1HB   LYS  62          1HB       LYS  62 -10.249  10.236  -3.042
  449   2HB   LYS  62          2HB       LYS  62 -10.175   8.570  -3.616
  450   1HG   LYS  62          1HG       LYS  62 -11.414   9.025  -5.523
  451   2HG   LYS  62          2HG       LYS  62 -12.248  10.391  -4.782
  452   1HD   LYS  62          1HD       LYS  62  -9.355  10.804  -4.944
  453   2HD   LYS  62          2HD       LYS  62 -10.093  10.565  -6.530
  454   1HE   LYS  62          1HE       LYS  62 -11.611  12.357  -4.720
  455   2HE   LYS  62          2HE       LYS  62 -10.039  12.981  -5.261
  456   1HZ   LYS  62          1HZ       LYS  62 -11.591  11.604  -7.286
  457   2HZ   LYS  62          2HZ       LYS  62 -12.261  13.070  -6.756
  458   3HZ   LYS  62          3HZ       LYS  62 -10.688  13.039  -7.398
  459    H    THR  63           H        THR  63 -13.535   7.839  -0.996
  460    HA   THR  63           HA       THR  63 -11.812   5.765  -0.078
  461    HB   THR  63           HB       THR  63 -13.799   6.351   1.127
  462    HG1  THR  63           HG1      THR  63 -14.575   3.938  -0.086
  463   1HG2  THR  63          1HG2      THR  63 -14.953   6.344  -1.551
  464   2HG2  THR  63          2HG2      THR  63 -15.973   5.497  -0.389
  465   3HG2  THR  63          3HG2      THR  63 -15.507   7.172  -0.096
  466    H    CYS  64           H        CYS  64 -12.839   3.345  -0.444
  467    HA   CYS  64           HA       CYS  64 -11.949   2.439  -2.962
  468   1HB   CYS  64          1HB       CYS  64 -12.222   0.971  -1.061
  469   2HB   CYS  64          2HB       CYS  64 -13.943   1.333  -0.963
  Start of MODEL   10
    1   1H    LYS   1          1H        LYS   1   6.563   4.702   9.048
    2   2H    LYS   1          2H        LYS   1   6.488   6.180   9.882
    3   3H    LYS   1          3H        LYS   1   6.674   4.725  10.739
    4    HA   LYS   1           HA       LYS   1   4.442   5.012  11.045
    5   1HB   LYS   1          1HB       LYS   1   4.215   7.122  10.035
    6   2HB   LYS   1          2HB       LYS   1   4.801   6.544   8.475
    7   1HG   LYS   1          1HG       LYS   1   2.739   5.852   7.820
    8   2HG   LYS   1          2HG       LYS   1   2.345   5.210   9.415
    9   1HD   LYS   1          1HD       LYS   1   1.272   7.107  10.028
   10   2HD   LYS   1          2HD       LYS   1   2.553   8.135   9.385
   11   1HE   LYS   1          1HE       LYS   1   1.387   8.525   7.480
   12   2HE   LYS   1          2HE       LYS   1   1.051   6.797   7.258
   13   1HZ   LYS   1          1HZ       LYS   1  -0.565   7.026   9.144
   14   2HZ   LYS   1          2HZ       LYS   1  -0.385   8.708   9.017
   15   3HZ   LYS   1          3HZ       LYS   1  -1.018   7.825   7.713
   16    H    ASP   2           H        ASP   2   2.838   3.455  10.603
   17    HA   ASP   2           HA       ASP   2   3.429   1.600   8.319
   18   1HB   ASP   2          1HB       ASP   2   1.922   1.026  10.889
   19   2HB   ASP   2          2HB       ASP   2   2.606  -0.145   9.761
   20    H    GLY   3           H        GLY   3   1.838   1.504   6.764
   21   1HA   GLY   3          1HA       GLY   3  -0.984   1.789   7.477
   22   2HA   GLY   3          2HA       GLY   3  -0.356   3.137   6.525
   23    H    TYR   4           H        TYR   4  -2.194   2.043   5.128
   24    HA   TYR   4           HA       TYR   4  -0.946  -0.068   3.394
   25   1HB   TYR   4          1HB       TYR   4  -3.737   0.575   4.315
   26   2HB   TYR   4          2HB       TYR   4  -3.507  -0.294   2.797
   27    HD1  TYR   4           HD1      TYR   4  -1.971  -2.381   2.846
   28    HD2  TYR   4           HD2      TYR   4  -3.657  -0.575   6.360
   29    HE1  TYR   4           HE1      TYR   4  -1.597  -4.485   4.107
   30    HE2  TYR   4           HE2      TYR   4  -3.283  -2.676   7.620
   31    HH   TYR   4           HH       TYR   4  -2.540  -4.760   7.539
   32    H    LEU   5           H        LEU   5  -1.502   0.151   1.054
   33    HA   LEU   5           HA       LEU   5  -1.625   3.024   0.242
   34   1HB   LEU   5          1HB       LEU   5  -0.673   0.469  -1.084
   35   2HB   LEU   5          2HB       LEU   5  -0.705   2.031  -1.904
   36    HG   LEU   5           HG       LEU   5   0.665   1.735   0.762
   37   1HD1  LEU   5          1HD1      LEU   5   1.580   0.004  -0.789
   38   2HD1  LEU   5          2HD1      LEU   5   1.932   1.278  -1.957
   39   3HD1  LEU   5          3HD1      LEU   5   2.759   1.257  -0.400
   40   1HD2  LEU   5          1HD2      LEU   5   0.189   3.989  -0.230
   41   2HD2  LEU   5          2HD2      LEU   5   1.913   3.672  -0.035
   42   3HD2  LEU   5          3HD2      LEU   5   1.167   3.539  -1.627
   43    H    VAL   6           H        VAL   6  -3.160   3.696  -1.342
   44    HA   VAL   6           HA       VAL   6  -5.439   1.795  -1.758
   45    HB   VAL   6           HB       VAL   6  -6.779   3.812  -1.978
   46   1HG1  VAL   6          1HG1      VAL   6  -5.177   3.218   0.313
   47   2HG1  VAL   6          2HG1      VAL   6  -5.370   4.967   0.206
   48   3HG1  VAL   6          3HG1      VAL   6  -6.791   3.924   0.261
   49   1HG2  VAL   6          1HG2      VAL   6  -4.374   4.937  -2.905
   50   2HG2  VAL   6          2HG2      VAL   6  -5.917   5.768  -2.701
   51   3HG2  VAL   6          3HG2      VAL   6  -4.727   5.786  -1.400
   52    H    GLU   7           H        GLU   7  -6.671   2.796  -3.933
   53    HA   GLU   7           HA       GLU   7  -4.590   3.033  -6.070
   54   1HB   GLU   7          1HB       GLU   7  -5.722   1.326  -7.360
   55   2HB   GLU   7          2HB       GLU   7  -5.439   0.677  -5.746
   56   1HG   GLU   7          1HG       GLU   7  -7.641   0.166  -5.780
   57   2HG   GLU   7          2HG       GLU   7  -7.893   1.878  -5.448
   58    H    LYS   8           H        LYS   8  -5.763   3.630  -8.222
   59    HA   LYS   8           HA       LYS   8  -6.777   6.130  -8.309
   60   1HB   LYS   8          1HB       LYS   8  -7.300   3.648  -9.868
   61   2HB   LYS   8          2HB       LYS   8  -8.321   5.042 -10.220
   62   1HG   LYS   8          1HG       LYS   8  -6.652   5.990 -11.391
   63   2HG   LYS   8          2HG       LYS   8  -5.618   5.949  -9.962
   64   1HD   LYS   8          1HD       LYS   8  -4.998   3.609 -10.490
   65   2HD   LYS   8          2HD       LYS   8  -5.996   3.684 -11.944
   66   1HE   LYS   8          1HE       LYS   8  -4.325   5.970 -12.039
   67   2HE   LYS   8          2HE       LYS   8  -3.282   4.606 -11.590
   68   1HZ   LYS   8          1HZ       LYS   8  -4.724   3.387 -13.377
   69   2HZ   LYS   8          2HZ       LYS   8  -4.951   4.960 -13.980
   70   3HZ   LYS   8          3HZ       LYS   8  -3.386   4.322 -13.847
   71    H    THR   9           H        THR   9  -9.108   3.385  -8.212
   72    HA   THR   9           HA       THR   9 -11.325   5.106  -7.553
   73    HB   THR   9           HB       THR   9 -12.444   2.909  -7.155
   74    HG1  THR   9           HG1      THR   9 -11.021   1.071  -7.626
   75   1HG2  THR   9          1HG2      THR   9 -11.930   3.921  -9.467
   76   2HG2  THR   9          2HG2      THR   9 -10.657   2.705  -9.573
   77   3HG2  THR   9          3HG2      THR   9 -12.340   2.206  -9.410
   78    H    GLY  10           H        GLY  10  -8.975   3.330  -5.637
   79   1HA   GLY  10          1HA       GLY  10  -8.573   4.342  -3.365
   80   2HA   GLY  10          2HA       GLY  10 -10.325   4.355  -3.171
   81    H    CYS  11           H        CYS  11 -10.106   1.601  -4.718
   82    HA   CYS  11           HA       CYS  11 -10.388  -0.068  -2.405
   83   1HB   CYS  11          1HB       CYS  11 -10.114  -0.370  -5.366
   84   2HB   CYS  11          2HB       CYS  11  -9.886  -1.814  -4.380
   85    H    LYS  12           H        LYS  12  -8.828  -1.174  -1.227
   86    HA   LYS  12           HA       LYS  12  -6.049  -0.545  -1.462
   87   1HB   LYS  12          1HB       LYS  12  -5.833  -2.444   0.149
   88   2HB   LYS  12          2HB       LYS  12  -7.121  -1.327   0.591
   89   1HG   LYS  12          1HG       LYS  12  -8.787  -2.838   0.108
   90   2HG   LYS  12          2HG       LYS  12  -7.860  -3.601  -1.185
   91   1HD   LYS  12          1HD       LYS  12  -6.317  -4.495   0.660
   92   2HD   LYS  12          2HD       LYS  12  -7.578  -4.011   1.797
   93   1HE   LYS  12          1HE       LYS  12  -8.931  -5.396  -0.256
   94   2HE   LYS  12          2HE       LYS  12  -7.485  -6.360   0.104
   95   1HZ   LYS  12          1HZ       LYS  12  -8.080  -5.791   2.538
   96   2HZ   LYS  12          2HZ       LYS  12  -9.635  -5.504   1.926
   97   3HZ   LYS  12          3HZ       LYS  12  -8.926  -7.038   1.752
   98    H    LYS  13           H        LYS  13  -4.629  -2.878  -1.414
   99    HA   LYS  13           HA       LYS  13  -5.236  -4.200  -4.042
  100   1HB   LYS  13          1HB       LYS  13  -2.954  -2.616  -3.101
  101   2HB   LYS  13          2HB       LYS  13  -2.474  -4.175  -3.772
  102   1HG   LYS  13          1HG       LYS  13  -3.539  -3.717  -5.860
  103   2HG   LYS  13          2HG       LYS  13  -4.400  -2.328  -5.195
  104   1HD   LYS  13          1HD       LYS  13  -2.687  -1.175  -6.186
  105   2HD   LYS  13          2HD       LYS  13  -1.862  -1.565  -4.676
  106   1HE   LYS  13          1HE       LYS  13  -1.555  -3.830  -6.369
  107   2HE   LYS  13          2HE       LYS  13  -1.166  -2.397  -7.343
  108   1HZ   LYS  13          1HZ       LYS  13  -0.216  -2.451  -4.579
  109   2HZ   LYS  13          2HZ       LYS  13   0.584  -3.462  -5.687
  110   3HZ   LYS  13          3HZ       LYS  13   0.512  -1.786  -5.959
  111    H    THR  14           H        THR  14  -5.917  -6.207  -3.222
  112    HA   THR  14           HA       THR  14  -4.715  -7.503  -0.934
  113    HB   THR  14           HB       THR  14  -6.541  -8.325  -3.201
  114    HG1  THR  14           HG1      THR  14  -7.066  -8.260  -0.438
  115   1HG2  THR  14          1HG2      THR  14  -5.063 -10.017  -1.318
  116   2HG2  THR  14          2HG2      THR  14  -6.809 -10.256  -1.238
  117   3HG2  THR  14          3HG2      THR  14  -5.958 -10.467  -2.768
  118    H    CYS  15           H        CYS  15  -3.300  -9.323  -0.925
  119    HA   CYS  15           HA       CYS  15  -1.941  -9.962  -3.511
  120   1HB   CYS  15          1HB       CYS  15  -0.088  -8.901  -2.749
  121   2HB   CYS  15          2HB       CYS  15  -0.968  -8.428  -1.302
  122    H    TYR  16           H        TYR  16  -0.901 -12.118  -3.458
  123    HA   TYR  16           HA       TYR  16  -2.343 -13.972  -1.634
  124   1HB   TYR  16          1HB       TYR  16  -1.079 -14.022  -4.318
  125   2HB   TYR  16          2HB       TYR  16  -0.942 -15.516  -3.389
  126    HD1  TYR  16           HD1      TYR  16  -3.355 -15.719  -1.866
  127    HD2  TYR  16           HD2      TYR  16  -2.831 -14.215  -5.855
  128    HE1  TYR  16           HE1      TYR  16  -5.720 -16.260  -2.379
  129    HE2  TYR  16           HE2      TYR  16  -5.197 -14.758  -6.370
  130    HH   TYR  16           HH       TYR  16  -7.406 -15.903  -3.868
  131    H    LYS  17           H        LYS  17   1.016 -13.509  -2.830
  132    HA   LYS  17           HA       LYS  17   2.168 -15.196  -0.763
  133   1HB   LYS  17          1HB       LYS  17   3.251 -13.133  -2.707
  134   2HB   LYS  17          2HB       LYS  17   4.285 -14.116  -1.669
  135   1HG   LYS  17          1HG       LYS  17   2.278 -15.224  -3.654
  136   2HG   LYS  17          2HG       LYS  17   4.016 -15.109  -3.935
  137   1HD   LYS  17          1HD       LYS  17   4.398 -16.993  -2.764
  138   2HD   LYS  17          2HD       LYS  17   3.478 -16.382  -1.388
  139   1HE   LYS  17          1HE       LYS  17   1.572 -17.009  -3.397
  140   2HE   LYS  17          2HE       LYS  17   2.691 -18.384  -3.303
  141   1HZ   LYS  17          1HZ       LYS  17   2.504 -18.068  -0.794
  142   2HZ   LYS  17          2HZ       LYS  17   1.120 -17.140  -1.127
  143   3HZ   LYS  17          3HZ       LYS  17   1.181 -18.776  -1.586
  144    H    LEU  18           H        LEU  18   1.293 -14.274   1.209
  145    HA   LEU  18           HA       LEU  18   1.463 -11.524   1.944
  146   1HB   LEU  18          1HB       LEU  18   1.521 -14.014   3.678
  147   2HB   LEU  18          2HB       LEU  18   1.012 -12.402   4.186
  148    HG   LEU  18           HG       LEU  18  -0.317 -14.175   2.129
  149   1HD1  LEU  18          1HD1      LEU  18  -0.665 -14.225   4.788
  150   2HD1  LEU  18          2HD1      LEU  18  -1.741 -12.882   4.405
  151   3HD1  LEU  18          3HD1      LEU  18  -2.005 -14.462   3.668
  152   1HD2  LEU  18          1HD2      LEU  18  -0.424 -11.241   2.585
  153   2HD2  LEU  18          2HD2      LEU  18  -0.719 -12.160   1.110
  154   3HD2  LEU  18          3HD2      LEU  18  -1.971 -12.053   2.349
  155    H    GLY  19           H        GLY  19   2.926 -10.476   3.354
  156   1HA   GLY  19          1HA       GLY  19   5.054  -9.861   4.106
  157   2HA   GLY  19          2HA       GLY  19   5.287 -11.564   4.481
  158    H    GLU  20           H        GLU  20   7.319  -9.885   3.520
  159    HA   GLU  20           HA       GLU  20   8.854  -9.595   1.713
  160   1HB   GLU  20          1HB       GLU  20   8.272 -12.476   2.283
  161   2HB   GLU  20          2HB       GLU  20   9.363 -12.098   0.949
  162   1HG   GLU  20          1HG       GLU  20  10.319 -10.426   2.880
  163   2HG   GLU  20          2HG       GLU  20   9.767 -11.785   3.859
  164    H    ASN  21           H        ASN  21   6.597  -8.749   0.569
  165    HA   ASN  21           HA       ASN  21   6.094 -10.409  -1.861
  166   1HB   ASN  21          1HB       ASN  21   4.231  -9.600  -0.406
  167   2HB   ASN  21          2HB       ASN  21   4.705  -7.941  -0.773
  168   1HD2  ASN  21          2HD2      ASN  21   2.727 -10.504  -1.813
  169   2HD2  ASN  21          1HD2      ASN  21   2.371  -9.919  -3.365
  170    H    ASP  22           H        ASP  22   7.993  -9.864  -3.074
  171    HA   ASP  22           HA       ASP  22   9.280  -7.452  -3.450
  172   1HB   ASP  22          1HB       ASP  22   9.977  -9.484  -4.539
  173   2HB   ASP  22          2HB       ASP  22   8.463  -9.586  -5.440
  174    H    PHE  23           H        PHE  23   6.366  -8.492  -5.280
  175    HA   PHE  23           HA       PHE  23   5.977  -6.248  -6.895
  176   1HB   PHE  23          1HB       PHE  23   4.573  -8.527  -6.082
  177   2HB   PHE  23          2HB       PHE  23   3.509  -7.187  -5.651
  178    HD1  PHE  23           HD1      PHE  23   5.948  -7.663  -8.456
  179    HD2  PHE  23           HD2      PHE  23   1.872  -6.955  -7.304
  180    HE1  PHE  23           HE1      PHE  23   5.323  -7.389 -10.839
  181    HE2  PHE  23           HE2      PHE  23   1.246  -6.680  -9.689
  182    HZ   PHE  23           HZ       PHE  23   2.971  -6.897 -11.455
  183    H    CYS  24           H        CYS  24   4.516  -6.676  -3.634
  184    HA   CYS  24           HA       CYS  24   3.461  -4.057  -3.381
  185   1HB   CYS  24          1HB       CYS  24   4.482  -6.132  -1.429
  186   2HB   CYS  24          2HB       CYS  24   3.715  -4.641  -0.885
  187    H    ASN  25           H        ASN  25   6.672  -5.331  -2.463
  188    HA   ASN  25           HA       ASN  25   7.740  -3.097  -1.139
  189   1HB   ASN  25          1HB       ASN  25   8.868  -5.237  -1.299
  190   2HB   ASN  25          2HB       ASN  25   8.977  -5.098  -3.053
  191   1HD2  ASN  25          2HD2      ASN  25  10.935  -4.274  -3.809
  192   2HD2  ASN  25          1HD2      ASN  25  12.007  -3.324  -2.898
  193    H    ARG  26           H        ARG  26   7.523  -3.699  -4.653
  194    HA   ARG  26           HA       ARG  26   9.002  -1.369  -5.468
  195   1HB   ARG  26          1HB       ARG  26   7.062  -3.316  -6.663
  196   2HB   ARG  26          2HB       ARG  26   7.447  -1.854  -7.572
  197   1HG   ARG  26          1HG       ARG  26   9.937  -2.668  -6.755
  198   2HG   ARG  26          2HG       ARG  26   9.124  -4.211  -7.015
  199   1HD   ARG  26          1HD       ARG  26   8.458  -2.406  -9.163
  200   2HD   ARG  26          2HD       ARG  26  10.219  -2.507  -8.998
  201    HE   ARG  26           HE       ARG  26   8.530  -4.573 -10.026
  202   1HH1  ARG  26          1HH1      ARG  26  11.098  -4.151  -7.737
  203   2HH1  ARG  26          2HH1      ARG  26  11.488  -5.834  -7.691
  204   1HH2  ARG  26          1HH2      ARG  26   9.063  -6.751  -9.984
  205   2HH2  ARG  26          2HH2      ARG  26  10.353  -7.298  -8.967
  206    H    GLU  27           H        GLU  27   5.476  -1.978  -5.263
  207    HA   GLU  27           HA       GLU  27   4.463   0.489  -6.070
  208   1HB   GLU  27          1HB       GLU  27   3.045  -1.370  -5.494
  209   2HB   GLU  27          2HB       GLU  27   3.657  -1.398  -3.841
  210   1HG   GLU  27          1HG       GLU  27   2.745   0.992  -3.630
  211   2HG   GLU  27          2HG       GLU  27   1.869   0.669  -5.128
  212    H    CYS  28           H        CYS  28   5.778  -0.363  -2.867
  213    HA   CYS  28           HA       CYS  28   5.259   2.276  -1.731
  214   1HB   CYS  28          1HB       CYS  28   5.635  -0.205  -0.753
  215   2HB   CYS  28          2HB       CYS  28   7.285   0.400  -0.606
  216    H    LYS  29           H        LYS  29   7.894   0.727  -3.459
  217    HA   LYS  29           HA       LYS  29   9.766   2.940  -2.789
  218   1HB   LYS  29          1HB       LYS  29   9.869   0.146  -3.665
  219   2HB   LYS  29          2HB       LYS  29  10.981   1.178  -4.564
  220   1HG   LYS  29          1HG       LYS  29  10.794   1.117  -1.539
  221   2HG   LYS  29          2HG       LYS  29  11.984   0.213  -2.474
  222   1HD   LYS  29          1HD       LYS  29  11.795   3.080  -3.162
  223   2HD   LYS  29          2HD       LYS  29  12.388   2.746  -1.534
  224   1HE   LYS  29          1HE       LYS  29  14.286   1.637  -2.301
  225   2HE   LYS  29          2HE       LYS  29  13.513   1.165  -3.828
  226   1HZ   LYS  29          1HZ       LYS  29  13.342   3.795  -4.020
  227   2HZ   LYS  29          2HZ       LYS  29  14.755   3.697  -3.082
  228   3HZ   LYS  29          3HZ       LYS  29  14.682   2.930  -4.598
  229    H    TRP  30           H        TRP  30   7.314   3.205  -4.622
  230    HA   TRP  30           HA       TRP  30   8.542   3.619  -7.264
  231   1HB   TRP  30          1HB       TRP  30   6.219   4.220  -7.880
  232   2HB   TRP  30          2HB       TRP  30   6.325   2.664  -7.077
  233    HD1  TRP  30           HD1      TRP  30   3.606   3.565  -6.940
  234    HE1  TRP  30           HE1      TRP  30   2.443   4.553  -4.875
  235    HE3  TRP  30           HE3      TRP  30   7.679   5.179  -4.238
  236    HZ2  TRP  30           HZ2      TRP  30   3.109   5.843  -2.439
  237    HZ3  TRP  30           HZ3      TRP  30   7.358   6.280  -2.062
  238    HH2  TRP  30           HH2      TRP  30   5.080   6.615  -1.152
  239    H    LYS  31           H        LYS  31   6.793   5.970  -7.831
  240    HA   LYS  31           HA       LYS  31   8.529   8.038  -6.530
  241   1HB   LYS  31          1HB       LYS  31   6.952   8.277  -9.101
  242   2HB   LYS  31          2HB       LYS  31   8.340   9.236  -8.587
  243   1HG   LYS  31          1HG       LYS  31   8.352   6.301  -9.352
  244   2HG   LYS  31          2HG       LYS  31   9.080   7.629 -10.255
  245   1HD   LYS  31          1HD       LYS  31  10.188   7.923  -7.737
  246   2HD   LYS  31          2HD       LYS  31  10.115   6.172  -7.935
  247   1HE   LYS  31          1HE       LYS  31  11.130   6.606 -10.294
  248   2HE   LYS  31          2HE       LYS  31  11.575   8.193  -9.636
  249   1HZ   LYS  31          1HZ       LYS  31  12.090   5.718  -8.110
  250   2HZ   LYS  31          2HZ       LYS  31  13.195   6.253  -9.280
  251   3HZ   LYS  31          3HZ       LYS  31  12.827   7.240  -7.948
  252    H    HIS  32           H        HIS  32   7.398   9.063  -4.915
  253    HA   HIS  32           HA       HIS  32   4.762  10.238  -5.538
  254   1HB   HIS  32          1HB       HIS  32   5.186   7.790  -3.974
  255   2HB   HIS  32          2HB       HIS  32   4.263   9.012  -3.097
  256    HD1  HIS  32           HD1      HIS  32   2.059   9.912  -4.306
  257    HD2  HIS  32           HD2      HIS  32   3.784   6.548  -6.063
  258    HE1  HIS  32           HE1      HIS  32   0.313   8.944  -5.864
  259    H    ILE  33           H        ILE  33   6.525   9.431  -2.517
  260    HA   ILE  33           HA       ILE  33   7.055  12.335  -2.104
  261    HB   ILE  33           HB       ILE  33   5.618  10.481  -0.182
  262   1HG1  ILE  33          1HG1      ILE  33   4.708  12.951  -1.698
  263   2HG1  ILE  33          2HG1      ILE  33   4.214  11.294  -2.042
  264   1HG2  ILE  33          1HG2      ILE  33   7.024  13.056   0.140
  265   2HG2  ILE  33          2HG2      ILE  33   5.383  13.043   0.783
  266   3HG2  ILE  33          3HG2      ILE  33   6.564  11.868   1.358
  267   1HD1  ILE  33          1HD1      ILE  33   3.838  11.995   0.767
  268   2HD1  ILE  33          2HD1      ILE  33   2.926  13.048  -0.315
  269   3HD1  ILE  33          3HD1      ILE  33   2.691  11.301  -0.379
  270    H    GLY  34           H        GLY  34   7.454   9.055  -0.735
  271   1HA   GLY  34          1HA       GLY  34  10.343   9.415  -0.551
  272   2HA   GLY  34          2HA       GLY  34   9.548   9.405   1.023
  273    H    GLY  35           H        GLY  35   8.035   7.503   1.374
  274   1HA   GLY  35          1HA       GLY  35   7.655   5.184   1.429
  275   2HA   GLY  35          2HA       GLY  35   8.307   5.117  -0.208
  276    H    SER  36           H        SER  36   8.909   4.328   3.035
  277    HA   SER  36           HA       SER  36  11.849   4.263   2.787
  278   1HB   SER  36          1HB       SER  36  11.653   4.323   5.043
  279   2HB   SER  36          2HB       SER  36   9.907   4.405   4.830
  280    HG   SER  36           HG       SER  36  10.128   2.593   5.963
  281    H    TYR  37           H        TYR  37   9.433   1.767   3.671
  282    HA   TYR  37           HA       TYR  37  10.423  -0.123   1.670
  283   1HB   TYR  37          1HB       TYR  37  12.216  -0.093   3.408
  284   2HB   TYR  37          2HB       TYR  37  11.018  -0.571   4.613
  285    HD1  TYR  37           HD1      TYR  37  12.476  -1.610   1.325
  286    HD2  TYR  37           HD2      TYR  37  10.494  -2.833   4.934
  287    HE1  TYR  37           HE1      TYR  37  12.760  -3.990   0.676
  288    HE2  TYR  37           HE2      TYR  37  10.777  -5.211   4.286
  289    HH   TYR  37           HH       TYR  37  11.150  -6.363   1.634
  290    H    GLY  38           H        GLY  38   8.837  -1.719   1.356
  291   1HA   GLY  38          1HA       GLY  38   6.901  -2.242   3.522
  292   2HA   GLY  38          2HA       GLY  38   6.243  -1.509   2.062
  293    H    TYR  39           H        TYR  39   5.250  -3.902   2.754
  294    HA   TYR  39           HA       TYR  39   5.983  -5.613   0.485
  295   1HB   TYR  39          1HB       TYR  39   6.451  -7.556   2.057
  296   2HB   TYR  39          2HB       TYR  39   7.678  -6.288   2.080
  297    HD1  TYR  39           HD1      TYR  39   4.556  -7.401   3.811
  298    HD2  TYR  39           HD2      TYR  39   8.243  -5.218   4.096
  299    HE1  TYR  39           HE1      TYR  39   4.175  -7.074   6.240
  300    HE2  TYR  39           HE2      TYR  39   7.864  -4.891   6.525
  301    HH   TYR  39           HH       TYR  39   4.847  -5.591   8.018
  302    H    CYS  40           H        CYS  40   4.640  -7.945   1.398
  303    HA   CYS  40           HA       CYS  40   1.858  -6.923   1.472
  304   1HB   CYS  40          1HB       CYS  40   2.658  -8.686  -0.115
  305   2HB   CYS  40          2HB       CYS  40   2.942  -9.751   1.261
  306    H    TYR  41           H        TYR  41   0.760  -6.789   3.368
  307    HA   TYR  41           HA       TYR  41   1.366  -8.732   5.546
  308   1HB   TYR  41          1HB       TYR  41   2.552  -6.327   5.554
  309   2HB   TYR  41          2HB       TYR  41   1.004  -5.850   6.256
  310    HD1  TYR  41           HD1      TYR  41   2.914  -9.052   6.558
  311    HD2  TYR  41           HD2      TYR  41   1.385  -5.575   8.564
  312    HE1  TYR  41           HE1      TYR  41   3.605 -10.006   8.739
  313    HE2  TYR  41           HE2      TYR  41   2.080  -6.528  10.745
  314    HH   TYR  41           HH       TYR  41   2.590  -8.654  11.739
  315    H    GLY  42           H        GLY  42  -0.643  -9.679   5.710
  316   1HA   GLY  42          1HA       GLY  42  -2.903  -9.759   6.437
  317   2HA   GLY  42          2HA       GLY  42  -2.915  -7.996   6.496
  318    H    PHE  43           H        PHE  43  -2.076 -10.155   3.794
  319    HA   PHE  43           HA       PHE  43  -2.960 -10.274   1.608
  320   1HB   PHE  43          1HB       PHE  43  -5.246  -9.733   3.459
  321   2HB   PHE  43          2HB       PHE  43  -5.552  -9.625   1.725
  322    HD1  PHE  43           HD1      PHE  43  -4.290 -11.622   0.347
  323    HD2  PHE  43           HD2      PHE  43  -5.646 -11.814   4.421
  324    HE1  PHE  43           HE1      PHE  43  -4.369 -14.097   0.205
  325    HE2  PHE  43           HE2      PHE  43  -5.724 -14.289   4.276
  326    HZ   PHE  43           HZ       PHE  43  -5.084 -15.430   2.172
  327    H    GLY  44           H        GLY  44  -1.466  -8.097   1.773
  328   1HA   GLY  44          1HA       GLY  44  -2.362  -6.287  -0.127
  329   2HA   GLY  44          2HA       GLY  44  -2.897  -5.597   1.405
  330    H    CYS  45           H        CYS  45  -0.898  -4.452  -0.364
  331    HA   CYS  45           HA       CYS  45   1.757  -4.990   0.683
  332   1HB   CYS  45          1HB       CYS  45   0.723  -2.551  -0.782
  333   2HB   CYS  45          2HB       CYS  45   2.367  -3.181  -0.785
  334    H    TYR  46           H        TYR  46   1.867  -4.620   2.926
  335    HA   TYR  46           HA       TYR  46   0.807  -2.079   4.041
  336   1HB   TYR  46          1HB       TYR  46   0.606  -4.416   5.081
  337   2HB   TYR  46          2HB       TYR  46   2.334  -4.307   5.419
  338    HD1  TYR  46           HD1      TYR  46  -0.692  -2.101   5.717
  339    HD2  TYR  46           HD2      TYR  46   2.910  -3.561   7.545
  340    HE1  TYR  46           HE1      TYR  46  -1.170  -0.748   7.739
  341    HE2  TYR  46           HE2      TYR  46   2.431  -2.205   9.566
  342    HH   TYR  46           HH       TYR  46  -0.070  -1.209  10.560
  343    H    CYS  47           H        CYS  47   2.142  -0.309   4.090
  344    HA   CYS  47           HA       CYS  47   5.079  -0.712   3.789
  345   1HB   CYS  47          1HB       CYS  47   3.126   1.563   3.449
  346   2HB   CYS  47          2HB       CYS  47   4.866   1.851   3.461
  347    H    GLU  48           H        GLU  48   6.556   0.421   5.233
  348    HA   GLU  48           HA       GLU  48   5.340   1.173   7.875
  349   1HB   GLU  48          1HB       GLU  48   7.908  -0.346   7.310
  350   2HB   GLU  48          2HB       GLU  48   7.260   0.032   8.907
  351   1HG   GLU  48          1HG       GLU  48   5.651  -1.585   8.787
  352   2HG   GLU  48          2HG       GLU  48   5.408  -1.364   7.054
  353    H    GLY  49           H        GLY  49   5.748   3.251   6.212
  354   1HA   GLY  49          1HA       GLY  49   7.631   4.900   7.538
  355   2HA   GLY  49          2HA       GLY  49   8.413   4.285   6.086
  356    H    LEU  50           H        LEU  50   4.950   4.884   6.155
  357    HA   LEU  50           HA       LEU  50   5.074   6.596   3.847
  358   1HB   LEU  50          1HB       LEU  50   2.871   6.260   5.904
  359   2HB   LEU  50          2HB       LEU  50   2.677   6.789   4.238
  360    HG   LEU  50           HG       LEU  50   2.170   4.598   3.884
  361   1HD1  LEU  50          1HD1      LEU  50   4.589   5.064   2.964
  362   2HD1  LEU  50          2HD1      LEU  50   5.067   3.901   4.200
  363   3HD1  LEU  50          3HD1      LEU  50   3.936   3.428   2.932
  364   1HD2  LEU  50          1HD2      LEU  50   3.073   4.385   6.576
  365   2HD2  LEU  50          2HD2      LEU  50   2.047   3.264   5.681
  366   3HD2  LEU  50          3HD2      LEU  50   3.799   3.064   5.658
  367    HA   PRO  51           HA       PRO  51   6.421  10.187   6.248
  368   1HB   PRO  51          1HB       PRO  51   5.884  11.732   3.856
  369   2HB   PRO  51          2HB       PRO  51   7.446  11.322   4.572
  370   1HG   PRO  51          1HG       PRO  51   6.287  10.247   2.188
  371   2HG   PRO  51          2HG       PRO  51   7.819   9.796   2.940
  372   1HD   PRO  51          1HD       PRO  51   5.397   8.248   2.809
  373   2HD   PRO  51          2HD       PRO  51   6.929   7.809   3.601
  374    H    ASP  52           H        ASP  52   5.310  12.182   6.920
  375    HA   ASP  52           HA       ASP  52   2.521  11.895   7.380
  376   1HB   ASP  52          1HB       ASP  52   3.992  13.241   8.765
  377   2HB   ASP  52          2HB       ASP  52   4.381  14.290   7.401
  378    H    SER  53           H        SER  53   4.144  12.863   4.519
  379    HA   SER  53           HA       SER  53   1.890  14.528   3.536
  380   1HB   SER  53          1HB       SER  53   4.731  14.103   2.981
  381   2HB   SER  53          2HB       SER  53   3.763  14.174   1.510
  382    HG   SER  53           HG       SER  53   4.186  16.101   3.496
  383    H    THR  54           H        THR  54   2.463  11.268   3.750
  384    HA   THR  54           HA       THR  54   1.416  10.623   1.033
  385    HB   THR  54           HB       THR  54   1.904   8.362   2.759
  386    HG1  THR  54           HG1      THR  54   3.321   9.448   3.950
  387   1HG2  THR  54          1HG2      THR  54   2.097   8.821   0.159
  388   2HG2  THR  54          2HG2      THR  54   3.759   9.235   0.578
  389   3HG2  THR  54          3HG2      THR  54   3.133   7.626   0.941
  390    H    GLN  55           H        GLN  55  -0.405   9.095   0.880
  391    HA   GLN  55           HA       GLN  55  -2.425   9.562   3.031
  392   1HB   GLN  55          1HB       GLN  55  -3.021  10.228   0.773
  393   2HB   GLN  55          2HB       GLN  55  -2.551   8.651   0.138
  394   1HG   GLN  55          1HG       GLN  55  -4.936   8.611   0.318
  395   2HG   GLN  55          2HG       GLN  55  -4.329   7.647   1.663
  396   1HE2  GLN  55          2HE2      GLN  55  -4.936  11.167   1.072
  397   2HE2  GLN  55          1HE2      GLN  55  -5.728  11.423   2.551
  398    H    THR  56           H        THR  56  -3.821   7.645   3.631
  399    HA   THR  56           HA       THR  56  -2.484   5.015   3.170
  400    HB   THR  56           HB       THR  56  -3.159   4.866   5.789
  401    HG1  THR  56           HG1      THR  56  -3.799   6.905   6.116
  402   1HG2  THR  56          1HG2      THR  56  -0.903   4.609   4.483
  403   2HG2  THR  56          2HG2      THR  56  -0.602   6.252   5.049
  404   3HG2  THR  56          3HG2      THR  56  -0.862   4.952   6.212
  405    H    TRP  57           H        TRP  57  -3.913   3.312   3.014
  406    HA   TRP  57           HA       TRP  57  -6.732   3.767   2.623
  407   1HB   TRP  57          1HB       TRP  57  -5.192   1.976   1.658
  408   2HB   TRP  57          2HB       TRP  57  -5.244   1.191   3.226
  409    HD1  TRP  57           HD1      TRP  57  -7.605   2.249   0.372
  410    HE1  TRP  57           HE1      TRP  57  -9.649   0.679   0.394
  411    HE3  TRP  57           HE3      TRP  57  -6.580  -0.484   4.566
  412    HZ2  TRP  57           HZ2      TRP  57 -10.706  -1.455   1.973
  413    HZ3  TRP  57           HZ3      TRP  57  -8.117  -2.283   5.301
  414    HH2  TRP  57           HH2      TRP  57 -10.178  -2.772   4.011
  415    HA   PRO  58           HA       PRO  58  -8.578   2.845   2.782
  416   1HB   PRO  58          1HB       PRO  58 -10.867   3.820   4.102
  417   2HB   PRO  58          2HB       PRO  58 -10.535   2.134   3.687
  418   1HG   PRO  58          1HG       PRO  58 -10.567   3.375   6.308
  419   2HG   PRO  58          2HG       PRO  58 -10.396   1.664   5.901
  420   1HD   PRO  58          1HD       PRO  58  -8.344   3.497   6.804
  421   2HD   PRO  58          2HD       PRO  58  -8.183   1.760   6.441
  422    H    LEU  59           H        LEU  59  -9.961   4.737   1.833
  423    HA   LEU  59           HA       LEU  59  -8.495   7.262   2.288
  424   1HB   LEU  59          1HB       LEU  59 -10.409   6.096   0.280
  425   2HB   LEU  59          2HB       LEU  59 -10.106   7.832   0.282
  426    HG   LEU  59           HG       LEU  59  -7.824   5.864   0.308
  427   1HD1  LEU  59          1HD1      LEU  59  -9.726   6.335  -1.839
  428   2HD1  LEU  59          2HD1      LEU  59  -8.094   6.814  -2.310
  429   3HD1  LEU  59          3HD1      LEU  59  -8.406   5.172  -1.748
  430   1HD2  LEU  59          1HD2      LEU  59  -7.883   8.561   0.620
  431   2HD2  LEU  59          2HD2      LEU  59  -6.523   7.700  -0.099
  432   3HD2  LEU  59          3HD2      LEU  59  -7.737   8.456  -1.133
  433    HA   PRO  60           HA       PRO  60 -11.505   9.504   4.589
  434   1HB   PRO  60          1HB       PRO  60 -12.013  11.476   2.514
  435   2HB   PRO  60          2HB       PRO  60 -11.122  11.665   4.028
  436   1HG   PRO  60          1HG       PRO  60 -10.024  11.567   1.419
  437   2HG   PRO  60          2HG       PRO  60  -9.134  11.544   2.944
  438   1HD   PRO  60          1HD       PRO  60  -9.500   9.380   1.049
  439   2HD   PRO  60          2HD       PRO  60  -8.525   9.385   2.536
  440    H    ASN  61           H        ASN  61 -13.731  10.950   3.718
  441    HA   ASN  61           HA       ASN  61 -15.786   9.087   3.477
  442   1HB   ASN  61          1HB       ASN  61 -15.403  11.959   2.694
  443   2HB   ASN  61          2HB       ASN  61 -16.903  11.154   2.238
  444   1HD2  ASN  61          2HD2      ASN  61 -18.256  12.267   3.763
  445   2HD2  ASN  61          1HD2      ASN  61 -18.105  12.057   5.440
  446    H    LYS  62           H        LYS  62 -13.750  10.448   0.957
  447    HA   LYS  62           HA       LYS  62 -15.325   9.278  -1.235
  448   1HB   LYS  62          1HB       LYS  62 -14.099  11.413  -1.430
  449   2HB   LYS  62          2HB       LYS  62 -12.580  10.572  -1.112
  450   1HG   LYS  62          1HG       LYS  62 -12.768   9.294  -3.144
  451   2HG   LYS  62          2HG       LYS  62 -14.416   9.862  -3.413
  452   1HD   LYS  62          1HD       LYS  62 -13.328  11.348  -4.788
  453   2HD   LYS  62          2HD       LYS  62 -13.177  12.246  -3.278
  454   1HE   LYS  62          1HE       LYS  62 -10.961  12.212  -4.124
  455   2HE   LYS  62          2HE       LYS  62 -10.968  10.869  -2.964
  456   1HZ   LYS  62          1HZ       LYS  62 -11.793  10.452  -5.767
  457   2HZ   LYS  62          2HZ       LYS  62 -10.152  10.405  -5.344
  458   3HZ   LYS  62          3HZ       LYS  62 -11.241   9.308  -4.639
  459    H    THR  63           H        THR  63 -15.002   7.081   0.081
  460    HA   THR  63           HA       THR  63 -12.410   5.764  -0.252
  461    HB   THR  63           HB       THR  63 -13.850   5.258   1.631
  462    HG1  THR  63           HG1      THR  63 -14.153   2.974   1.224
  463   1HG2  THR  63          1HG2      THR  63 -15.884   4.893  -0.540
  464   2HG2  THR  63          2HG2      THR  63 -16.060   3.980   0.958
  465   3HG2  THR  63          3HG2      THR  63 -16.033   5.743   0.998
  466    H    CYS  64           H        CYS  64 -13.042   3.255  -1.128
  467    HA   CYS  64           HA       CYS  64 -13.264   3.620  -4.017
  468   1HB   CYS  64          1HB       CYS  64 -11.760   1.995  -2.844
  469   2HB   CYS  64          2HB       CYS  64 -13.187   1.111  -2.305
  Start of MODEL   11
    1   1H    LYS   1          1H        LYS   1   7.043   4.811   9.770
    2   2H    LYS   1          2H        LYS   1   7.231   6.423   9.276
    3   3H    LYS   1          3H        LYS   1   7.009   6.062  10.921
    4    HA   LYS   1           HA       LYS   1   4.778   5.864  10.734
    5   1HB   LYS   1          1HB       LYS   1   5.934   7.903   9.313
    6   2HB   LYS   1          2HB       LYS   1   4.897   7.178   8.083
    7   1HG   LYS   1          1HG       LYS   1   3.347   7.259  10.439
    8   2HG   LYS   1          2HG       LYS   1   4.154   8.824  10.343
    9   1HD   LYS   1          1HD       LYS   1   2.028   8.910   9.128
   10   2HD   LYS   1          2HD       LYS   1   3.373   9.060   7.995
   11   1HE   LYS   1          1HE       LYS   1   1.916   7.465   6.981
   12   2HE   LYS   1          2HE       LYS   1   3.177   6.476   7.744
   13   1HZ   LYS   1          1HZ       LYS   1   0.932   7.276   9.423
   14   2HZ   LYS   1          2HZ       LYS   1   0.602   6.107   8.235
   15   3HZ   LYS   1          3HZ       LYS   1   1.803   5.821   9.404
   16    H    ASP   2           H        ASP   2   3.414   4.203  10.174
   17    HA   ASP   2           HA       ASP   2   3.927   2.766   7.600
   18   1HB   ASP   2          1HB       ASP   2   2.318   1.880  10.009
   19   2HB   ASP   2          2HB       ASP   2   2.978   0.865   8.726
   20    H    GLY   3           H        GLY   3   2.108   2.226   6.260
   21   1HA   GLY   3          1HA       GLY   3  -0.557   3.219   6.946
   22   2HA   GLY   3          2HA       GLY   3   0.236   4.141   5.667
   23    H    TYR   4           H        TYR   4  -1.855   3.120   4.647
   24    HA   TYR   4           HA       TYR   4  -1.069   0.531   3.347
   25   1HB   TYR   4          1HB       TYR   4  -3.506   1.486   4.734
   26   2HB   TYR   4          2HB       TYR   4  -3.799   0.631   3.222
   27    HD1  TYR   4           HD1      TYR   4  -2.358  -1.589   2.909
   28    HD2  TYR   4           HD2      TYR   4  -3.304   0.232   6.682
   29    HE1  TYR   4           HE1      TYR   4  -1.976  -3.758   4.051
   30    HE2  TYR   4           HE2      TYR   4  -2.924  -1.937   7.826
   31    HH   TYR   4           HH       TYR   4  -2.982  -4.384   7.191
   32    H    LEU   5           H        LEU   5  -0.179   1.760   1.505
   33    HA   LEU   5           HA       LEU   5  -1.405   3.860   0.108
   34   1HB   LEU   5          1HB       LEU   5   0.450   1.620  -0.492
   35   2HB   LEU   5          2HB       LEU   5  -0.294   2.395  -1.892
   36    HG   LEU   5           HG       LEU   5   0.765   4.202   0.221
   37   1HD1  LEU   5          1HD1      LEU   5   2.533   2.602  -1.656
   38   2HD1  LEU   5          2HD1      LEU   5   3.061   4.032  -0.769
   39   3HD1  LEU   5          3HD1      LEU   5   2.576   2.582   0.108
   40   1HD2  LEU   5          1HD2      LEU   5   0.661   4.135  -2.806
   41   2HD2  LEU   5          2HD2      LEU   5  -0.219   5.207  -1.719
   42   3HD2  LEU   5          3HD2      LEU   5   1.524   5.389  -1.914
   43    H    VAL   6           H        VAL   6  -3.082   3.984  -1.381
   44    HA   VAL   6           HA       VAL   6  -4.901   1.640  -1.531
   45    HB   VAL   6           HB       VAL   6  -6.505   3.322  -2.265
   46   1HG1  VAL   6          1HG1      VAL   6  -4.689   4.170   0.001
   47   2HG1  VAL   6          2HG1      VAL   6  -6.198   5.008  -0.365
   48   3HG1  VAL   6          3HG1      VAL   6  -6.226   3.309   0.107
   49   1HG2  VAL   6          1HG2      VAL   6  -4.032   4.737  -2.973
   50   2HG2  VAL   6          2HG2      VAL   6  -5.658   4.928  -3.628
   51   3HG2  VAL   6          3HG2      VAL   6  -5.201   5.763  -2.143
   52    H    GLU   7           H        GLU   7  -6.183   2.098  -3.905
   53    HA   GLU   7           HA       GLU   7  -4.083   1.399  -5.910
   54   1HB   GLU   7          1HB       GLU   7  -5.938  -0.186  -5.365
   55   2HB   GLU   7          2HB       GLU   7  -7.096   1.025  -5.920
   56   1HG   GLU   7          1HG       GLU   7  -6.650   0.627  -8.115
   57   2HG   GLU   7          2HG       GLU   7  -4.917   0.456  -7.828
   58    H    LYS   8           H        LYS   8  -4.487   2.232  -8.158
   59    HA   LYS   8           HA       LYS   8  -4.545   5.000  -8.400
   60   1HB   LYS   8          1HB       LYS   8  -5.065   2.649 -10.145
   61   2HB   LYS   8          2HB       LYS   8  -5.572   4.214 -10.782
   62   1HG   LYS   8          1HG       LYS   8  -3.388   4.257 -11.499
   63   2HG   LYS   8          2HG       LYS   8  -3.140   4.910  -9.880
   64   1HD   LYS   8          1HD       LYS   8  -1.707   3.201  -9.537
   65   2HD   LYS   8          2HD       LYS   8  -3.122   2.148  -9.499
   66   1HE   LYS   8          1HE       LYS   8  -1.778   1.161 -11.180
   67   2HE   LYS   8          2HE       LYS   8  -2.889   2.177 -12.120
   68   1HZ   LYS   8          1HZ       LYS   8  -0.900   3.881 -11.326
   69   2HZ   LYS   8          2HZ       LYS   8  -0.066   2.462 -11.741
   70   3HZ   LYS   8          3HZ       LYS   8  -1.083   3.215 -12.875
   71    H    THR   9           H        THR   9  -7.306   2.831  -8.077
   72    HA   THR   9           HA       THR   9  -9.225   4.980  -8.768
   73    HB   THR   9           HB       THR   9 -10.805   3.187  -8.755
   74    HG1  THR   9           HG1      THR   9  -8.817   1.749  -7.340
   75   1HG2  THR   9          1HG2      THR   9  -8.437   3.054 -10.231
   76   2HG2  THR   9          2HG2      THR   9  -8.680   1.413  -9.631
   77   3HG2  THR   9          3HG2      THR   9  -9.940   2.200 -10.583
   78    H    GLY  10           H        GLY  10  -7.538   3.988  -6.030
   79   1HA   GLY  10          1HA       GLY  10  -7.821   5.141  -3.907
   80   2HA   GLY  10          2HA       GLY  10  -9.535   5.333  -4.279
   81    H    CYS  11           H        CYS  11  -9.199   2.328  -5.237
   82    HA   CYS  11           HA       CYS  11 -10.350   1.164  -2.853
   83   1HB   CYS  11          1HB       CYS  11  -9.442   0.289  -5.571
   84   2HB   CYS  11          2HB       CYS  11  -9.762  -0.954  -4.362
   85    H    LYS  12           H        LYS  12  -9.255  -1.075  -2.116
   86    HA   LYS  12           HA       LYS  12  -6.672  -0.352  -0.949
   87   1HB   LYS  12          1HB       LYS  12  -6.974  -2.646   0.072
   88   2HB   LYS  12          2HB       LYS  12  -8.331  -1.555   0.340
   89   1HG   LYS  12          1HG       LYS  12  -9.712  -3.012  -0.672
   90   2HG   LYS  12          2HG       LYS  12  -8.750  -2.907  -2.147
   91   1HD   LYS  12          1HD       LYS  12  -7.153  -4.575  -1.105
   92   2HD   LYS  12          2HD       LYS  12  -8.339  -4.797   0.181
   93   1HE   LYS  12          1HE       LYS  12  -8.890  -6.515  -1.349
   94   2HE   LYS  12          2HE       LYS  12 -10.017  -5.221  -1.801
   95   1HZ   LYS  12          1HZ       LYS  12  -8.050  -4.421  -3.248
   96   2HZ   LYS  12          2HZ       LYS  12  -7.499  -6.022  -3.108
   97   3HZ   LYS  12          3HZ       LYS  12  -9.011  -5.706  -3.810
   98    H    LYS  13           H        LYS  13  -5.233  -2.639  -0.903
   99    HA   LYS  13           HA       LYS  13  -4.823  -3.565  -3.707
  100   1HB   LYS  13          1HB       LYS  13  -3.303  -1.570  -2.309
  101   2HB   LYS  13          2HB       LYS  13  -2.283  -2.994  -2.524
  102   1HG   LYS  13          1HG       LYS  13  -3.922  -2.078  -4.850
  103   2HG   LYS  13          2HG       LYS  13  -2.482  -1.148  -4.433
  104   1HD   LYS  13          1HD       LYS  13  -1.693  -3.844  -4.278
  105   2HD   LYS  13          2HD       LYS  13  -2.668  -3.726  -5.744
  106   1HE   LYS  13          1HE       LYS  13  -1.232  -2.153  -6.732
  107   2HE   LYS  13          2HE       LYS  13  -0.552  -1.654  -5.170
  108   1HZ   LYS  13          1HZ       LYS  13  -0.245  -4.348  -6.389
  109   2HZ   LYS  13          2HZ       LYS  13   0.956  -3.145  -6.370
  110   3HZ   LYS  13          3HZ       LYS  13   0.422  -3.839  -4.915
  111    H    THR  14           H        THR  14  -5.744  -5.513  -2.553
  112    HA   THR  14           HA       THR  14  -4.134  -6.778  -0.458
  113    HB   THR  14           HB       THR  14  -6.568  -7.497  -2.100
  114    HG1  THR  14           HG1      THR  14  -6.259  -7.139   0.685
  115   1HG2  THR  14          1HG2      THR  14  -5.225  -9.542  -1.560
  116   2HG2  THR  14          2HG2      THR  14  -5.356  -9.122   0.149
  117   3HG2  THR  14          3HG2      THR  14  -6.805  -9.513  -0.776
  118    H    CYS  15           H        CYS  15  -3.096  -8.862  -0.712
  119    HA   CYS  15           HA       CYS  15  -2.364  -9.566  -3.536
  120   1HB   CYS  15          1HB       CYS  15  -0.079  -9.931  -2.720
  121   2HB   CYS  15          2HB       CYS  15  -0.595  -8.298  -2.303
  122    H    TYR  16           H        TYR  16  -1.271 -11.903  -3.431
  123    HA   TYR  16           HA       TYR  16  -3.158 -13.612  -1.882
  124   1HB   TYR  16          1HB       TYR  16  -1.367 -13.972  -4.291
  125   2HB   TYR  16          2HB       TYR  16  -2.142 -15.347  -3.504
  126    HD1  TYR  16           HD1      TYR  16  -4.760 -14.603  -2.793
  127    HD2  TYR  16           HD2      TYR  16  -2.504 -13.302  -6.210
  128    HE1  TYR  16           HE1      TYR  16  -6.870 -14.103  -3.996
  129    HE2  TYR  16           HE2      TYR  16  -4.615 -12.799  -7.411
  130    HH   TYR  16           HH       TYR  16  -7.419 -13.967  -6.771
  131    H    LYS  17           H        LYS  17   0.306 -13.814  -2.814
  132    HA   LYS  17           HA       LYS  17   0.907 -15.500  -0.498
  133   1HB   LYS  17          1HB       LYS  17   3.193 -15.369  -1.447
  134   2HB   LYS  17          2HB       LYS  17   2.006 -15.724  -2.704
  135   1HG   LYS  17          1HG       LYS  17   2.190 -12.885  -2.454
  136   2HG   LYS  17          2HG       LYS  17   3.830 -13.526  -2.572
  137   1HD   LYS  17          1HD       LYS  17   2.229 -14.955  -4.439
  138   2HD   LYS  17          2HD       LYS  17   1.874 -13.240  -4.649
  139   1HE   LYS  17          1HE       LYS  17   4.516 -12.998  -4.496
  140   2HE   LYS  17          2HE       LYS  17   4.473 -14.689  -5.031
  141   1HZ   LYS  17          1HZ       LYS  17   2.540 -13.270  -6.474
  142   2HZ   LYS  17          2HZ       LYS  17   3.980 -12.379  -6.552
  143   3HZ   LYS  17          3HZ       LYS  17   3.957 -13.999  -7.061
  144    H    LEU  18           H        LEU  18   1.585 -14.760   1.488
  145    HA   LEU  18           HA       LEU  18   1.830 -11.846   1.912
  146   1HB   LEU  18          1HB       LEU  18   1.904 -14.270   3.736
  147   2HB   LEU  18          2HB       LEU  18   1.909 -12.599   4.301
  148    HG   LEU  18           HG       LEU  18  -0.252 -13.784   2.538
  149   1HD1  LEU  18          1HD1      LEU  18  -0.114 -13.369   5.535
  150   2HD1  LEU  18          2HD1      LEU  18  -1.625 -13.626   4.663
  151   3HD1  LEU  18          3HD1      LEU  18  -0.389 -14.884   4.675
  152   1HD2  LEU  18          1HD2      LEU  18   0.106 -11.313   2.408
  153   2HD2  LEU  18          2HD2      LEU  18  -1.462 -11.737   3.096
  154   3HD2  LEU  18          3HD2      LEU  18  -0.147 -11.216   4.150
  155    H    GLY  19           H        GLY  19   3.671 -11.606   3.893
  156   1HA   GLY  19          1HA       GLY  19   5.978 -11.749   4.443
  157   2HA   GLY  19          2HA       GLY  19   6.176 -12.957   3.173
  158    H    GLU  20           H        GLU  20   8.163 -11.460   2.865
  159    HA   GLU  20           HA       GLU  20   8.030  -8.831   1.855
  160   1HB   GLU  20          1HB       GLU  20  10.102  -9.942   2.440
  161   2HB   GLU  20          2HB       GLU  20   9.835 -11.183   1.215
  162   1HG   GLU  20          1HG       GLU  20  11.351  -9.714   0.172
  163   2HG   GLU  20          2HG       GLU  20   9.788  -9.203  -0.466
  164    H    ASN  21           H        ASN  21   6.027  -8.855   0.518
  165    HA   ASN  21           HA       ASN  21   6.011 -10.414  -1.970
  166   1HB   ASN  21          1HB       ASN  21   4.074  -9.534  -0.400
  167   2HB   ASN  21          2HB       ASN  21   4.230  -8.069  -1.371
  168   1HD2  ASN  21          2HD2      ASN  21   2.052 -10.256  -1.308
  169   2HD2  ASN  21          1HD2      ASN  21   1.890 -10.716  -2.934
  170    H    ASP  22           H        ASP  22   7.907  -9.647  -3.083
  171    HA   ASP  22           HA       ASP  22   8.847  -7.075  -3.480
  172   1HB   ASP  22          1HB       ASP  22   9.944  -9.012  -4.392
  173   2HB   ASP  22          2HB       ASP  22   8.546  -9.400  -5.398
  174    H    PHE  23           H        PHE  23   6.148  -8.628  -5.234
  175    HA   PHE  23           HA       PHE  23   5.508  -6.837  -7.215
  176   1HB   PHE  23          1HB       PHE  23   4.280  -8.916  -6.320
  177   2HB   PHE  23          2HB       PHE  23   3.465  -7.813  -5.210
  178    HD1  PHE  23           HD1      PHE  23   2.406  -5.664  -6.306
  179    HD2  PHE  23           HD2      PHE  23   3.376  -9.258  -8.449
  180    HE1  PHE  23           HE1      PHE  23   0.823  -5.020  -8.103
  181    HE2  PHE  23           HE2      PHE  23   1.796  -8.614 -10.247
  182    HZ   PHE  23           HZ       PHE  23   0.518  -6.495 -10.073
  183    H    CYS  24           H        CYS  24   4.080  -6.488  -3.947
  184    HA   CYS  24           HA       CYS  24   3.259  -3.761  -4.359
  185   1HB   CYS  24          1HB       CYS  24   2.343  -5.424  -2.713
  186   2HB   CYS  24          2HB       CYS  24   3.832  -5.264  -1.784
  187    H    ASN  25           H        ASN  25   6.026  -5.199  -2.606
  188    HA   ASN  25           HA       ASN  25   7.261  -2.913  -1.590
  189   1HB   ASN  25          1HB       ASN  25   8.255  -4.948  -1.047
  190   2HB   ASN  25          2HB       ASN  25   8.151  -5.552  -2.698
  191   1HD2  ASN  25          2HD2      ASN  25   9.840  -2.953  -0.842
  192   2HD2  ASN  25          1HD2      ASN  25  11.287  -3.067  -1.724
  193    H    ARG  26           H        ARG  26   8.027  -4.360  -4.796
  194    HA   ARG  26           HA       ARG  26   9.677  -2.332  -5.800
  195   1HB   ARG  26          1HB       ARG  26   8.202  -4.589  -6.744
  196   2HB   ARG  26          2HB       ARG  26   7.928  -3.261  -7.874
  197   1HG   ARG  26          1HG       ARG  26  10.313  -2.936  -8.164
  198   2HG   ARG  26          2HG       ARG  26  10.669  -4.101  -6.891
  199   1HD   ARG  26          1HD       ARG  26  10.390  -5.874  -8.289
  200   2HD   ARG  26          2HD       ARG  26   8.938  -5.179  -9.026
  201    HE   ARG  26           HE       ARG  26  11.596  -5.058 -10.110
  202   1HH1  ARG  26          1HH1      ARG  26   8.865  -3.018  -9.517
  203   2HH1  ARG  26          2HH1      ARG  26   9.383  -1.801 -10.632
  204   1HH2  ARG  26          1HH2      ARG  26  12.260  -3.487 -11.567
  205   2HH2  ARG  26          2HH2      ARG  26  11.297  -2.065 -11.790
  206    H    GLU  27           H        GLU  27   6.100  -2.511  -5.997
  207    HA   GLU  27           HA       GLU  27   5.784  -0.008  -7.388
  208   1HB   GLU  27          1HB       GLU  27   4.199  -2.071  -6.912
  209   2HB   GLU  27          2HB       GLU  27   3.748  -1.134  -5.488
  210   1HG   GLU  27          1HG       GLU  27   2.973   0.689  -6.798
  211   2HG   GLU  27          2HG       GLU  27   3.770   0.086  -8.251
  212    H    CYS  28           H        CYS  28   5.621  -0.889  -3.924
  213    HA   CYS  28           HA       CYS  28   5.122   1.842  -3.041
  214   1HB   CYS  28          1HB       CYS  28   4.434  -0.219  -1.831
  215   2HB   CYS  28          2HB       CYS  28   6.131  -0.624  -1.581
  216    H    LYS  29           H        LYS  29   7.828   0.416  -4.363
  217    HA   LYS  29           HA       LYS  29   9.798   1.834  -2.641
  218   1HB   LYS  29          1HB       LYS  29  10.068  -0.553  -3.409
  219   2HB   LYS  29          2HB       LYS  29  10.165   0.042  -5.066
  220   1HG   LYS  29          1HG       LYS  29  12.082   1.524  -4.304
  221   2HG   LYS  29          2HG       LYS  29  12.066   0.628  -2.785
  222   1HD   LYS  29          1HD       LYS  29  13.688  -0.476  -4.126
  223   2HD   LYS  29          2HD       LYS  29  12.251  -1.494  -4.219
  224   1HE   LYS  29          1HE       LYS  29  11.696   0.022  -6.326
  225   2HE   LYS  29          2HE       LYS  29  13.454   0.271  -6.326
  226   1HZ   LYS  29          1HZ       LYS  29  12.127  -2.383  -6.150
  227   2HZ   LYS  29          2HZ       LYS  29  12.776  -1.729  -7.577
  228   3HZ   LYS  29          3HZ       LYS  29  13.793  -2.092  -6.267
  229    H    TRP  30           H        TRP  30   8.116   3.597  -4.025
  230    HA   TRP  30           HA       TRP  30   9.232   4.380  -6.599
  231   1HB   TRP  30          1HB       TRP  30   7.220   5.383  -4.614
  232   2HB   TRP  30          2HB       TRP  30   7.757   6.470  -5.892
  233    HD1  TRP  30           HD1      TRP  30   5.072   4.245  -5.283
  234    HE1  TRP  30           HE1      TRP  30   4.101   3.233  -7.446
  235    HE3  TRP  30           HE3      TRP  30   8.859   5.318  -8.528
  236    HZ2  TRP  30           HZ2      TRP  30   4.838   2.923 -10.195
  237    HZ3  TRP  30           HZ3      TRP  30   8.701   4.656 -10.910
  238    HH2  TRP  30           HH2      TRP  30   6.697   3.461 -11.749
  239    H    LYS  31           H        LYS  31   9.492   7.121  -6.416
  240    HA   LYS  31           HA       LYS  31  11.787   7.493  -4.517
  241   1HB   LYS  31          1HB       LYS  31  12.401   7.153  -6.917
  242   2HB   LYS  31          2HB       LYS  31  11.426   8.564  -7.335
  243   1HG   LYS  31          1HG       LYS  31  13.115   9.942  -6.787
  244   2HG   LYS  31          2HG       LYS  31  13.199   9.241  -5.171
  245   1HD   LYS  31          1HD       LYS  31  15.345   8.982  -6.367
  246   2HD   LYS  31          2HD       LYS  31  14.611   7.413  -6.027
  247   1HE   LYS  31          1HE       LYS  31  15.148   7.144  -8.285
  248   2HE   LYS  31          2HE       LYS  31  13.511   7.817  -8.435
  249   1HZ   LYS  31          1HZ       LYS  31  14.695  10.066  -8.272
  250   2HZ   LYS  31          2HZ       LYS  31  16.104   9.212  -8.674
  251   3HZ   LYS  31          3HZ       LYS  31  14.787   9.228  -9.749
  252    H    HIS  32           H        HIS  32   8.732   8.341  -4.760
  253    HA   HIS  32           HA       HIS  32   9.223  11.131  -3.818
  254   1HB   HIS  32          1HB       HIS  32   8.308  10.442  -6.367
  255   2HB   HIS  32          2HB       HIS  32   6.838  10.849  -5.483
  256    HD1  HIS  32           HD1      HIS  32   6.296  13.229  -5.967
  257    HD2  HIS  32           HD2      HIS  32  10.393  12.679  -5.415
  258    HE1  HIS  32           HE1      HIS  32   7.353  15.527  -6.107
  259    H    ILE  33           H        ILE  33   8.031   8.200  -3.062
  260    HA   ILE  33           HA       ILE  33   5.680   9.319  -1.569
  261    HB   ILE  33           HB       ILE  33   5.983   6.401  -2.197
  262   1HG1  ILE  33          1HG1      ILE  33   6.502   7.620  -4.336
  263   2HG1  ILE  33          2HG1      ILE  33   5.012   6.680  -4.415
  264   1HG2  ILE  33          1HG2      ILE  33   3.963   8.215  -1.247
  265   2HG2  ILE  33          2HG2      ILE  33   3.402   7.445  -2.731
  266   3HG2  ILE  33          3HG2      ILE  33   3.901   6.456  -1.358
  267   1HD1  ILE  33          1HD1      ILE  33   4.247   9.193  -3.415
  268   2HD1  ILE  33          2HD1      ILE  33   5.380   9.538  -4.722
  269   3HD1  ILE  33          3HD1      ILE  33   3.944   8.562  -5.033
  270    H    GLY  34           H        GLY  34   8.664   7.524  -1.416
  271   1HA   GLY  34          1HA       GLY  34   9.792   7.582   0.833
  272   2HA   GLY  34          2HA       GLY  34   8.235   7.118   1.518
  273    H    GLY  35           H        GLY  35  10.825   5.991  -0.621
  274   1HA   GLY  35          1HA       GLY  35   9.790   3.228  -0.489
  275   2HA   GLY  35          2HA       GLY  35  11.169   3.770  -1.441
  276    H    SER  36           H        SER  36  10.164   3.303   1.942
  277    HA   SER  36           HA       SER  36  13.029   2.754   2.630
  278   1HB   SER  36          1HB       SER  36  11.676   3.052   4.991
  279   2HB   SER  36          2HB       SER  36  12.436   4.384   4.123
  280    HG   SER  36           HG       SER  36  10.372   5.017   4.369
  281    H    TYR  37           H        TYR  37   9.687   1.620   3.162
  282    HA   TYR  37           HA       TYR  37  10.591  -1.179   3.203
  283   1HB   TYR  37          1HB       TYR  37  10.618   0.282   5.561
  284   2HB   TYR  37          2HB       TYR  37   9.049  -0.521   5.618
  285    HD1  TYR  37           HD1      TYR  37   9.873  -2.964   3.936
  286    HD2  TYR  37           HD2      TYR  37  11.697  -1.003   7.295
  287    HE1  TYR  37           HE1      TYR  37  10.986  -5.089   4.574
  288    HE2  TYR  37           HE2      TYR  37  12.807  -3.127   7.934
  289    HH   TYR  37           HH       TYR  37  12.929  -5.834   5.852
  290    H    GLY  38           H        GLY  38   9.022  -2.033   1.864
  291   1HA   GLY  38          1HA       GLY  38   6.193  -1.520   2.570
  292   2HA   GLY  38          2HA       GLY  38   6.696  -1.121   0.930
  293    H    TYR  39           H        TYR  39   5.043  -3.367   2.456
  294    HA   TYR  39           HA       TYR  39   5.579  -5.418   0.434
  295   1HB   TYR  39          1HB       TYR  39   6.281  -7.128   2.007
  296   2HB   TYR  39          2HB       TYR  39   7.320  -5.725   2.245
  297    HD1  TYR  39           HD1      TYR  39   6.284  -3.929   3.978
  298    HD2  TYR  39           HD2      TYR  39   5.409  -8.133   3.901
  299    HE1  TYR  39           HE1      TYR  39   5.596  -3.827   6.359
  300    HE2  TYR  39           HE2      TYR  39   4.720  -8.033   6.281
  301    HH   TYR  39           HH       TYR  39   3.853  -5.479   7.838
  302    H    CYS  40           H        CYS  40   4.194  -7.537   1.706
  303    HA   CYS  40           HA       CYS  40   1.484  -6.297   1.932
  304   1HB   CYS  40          1HB       CYS  40   2.509  -8.333   0.373
  305   2HB   CYS  40          2HB       CYS  40   1.711  -9.217   1.674
  306    H    TYR  41           H        TYR  41   0.410  -6.375   3.842
  307    HA   TYR  41           HA       TYR  41   1.276  -8.360   5.912
  308   1HB   TYR  41          1HB       TYR  41   2.245  -6.100   6.297
  309   2HB   TYR  41          2HB       TYR  41   0.618  -5.419   6.292
  310    HD1  TYR  41           HD1      TYR  41   1.606  -8.702   7.719
  311    HD2  TYR  41           HD2      TYR  41   0.479  -4.642   8.554
  312    HE1  TYR  41           HE1      TYR  41   1.359  -9.265  10.120
  313    HE2  TYR  41           HE2      TYR  41   0.235  -5.206  10.959
  314    HH   TYR  41           HH       TYR  41  -0.004  -6.988  12.410
  315    H    GLY  42           H        GLY  42  -0.513  -9.623   6.302
  316   1HA   GLY  42          1HA       GLY  42  -2.748 -10.199   6.746
  317   2HA   GLY  42          2HA       GLY  42  -3.020  -8.498   7.138
  318    H    PHE  43           H        PHE  43  -1.973 -10.007   4.083
  319    HA   PHE  43           HA       PHE  43  -2.877  -9.814   1.909
  320   1HB   PHE  43          1HB       PHE  43  -5.304  -9.774   3.716
  321   2HB   PHE  43          2HB       PHE  43  -5.434  -9.853   1.961
  322    HD1  PHE  43           HD1      PHE  43  -3.922 -11.575   4.914
  323    HD2  PHE  43           HD2      PHE  43  -5.169 -11.899   0.816
  324    HE1  PHE  43           HE1      PHE  43  -3.536 -14.024   4.990
  325    HE2  PHE  43           HE2      PHE  43  -4.787 -14.348   0.892
  326    HZ   PHE  43           HZ       PHE  43  -3.970 -15.409   2.979
  327    H    GLY  44           H        GLY  44  -1.770  -7.550   2.075
  328   1HA   GLY  44          1HA       GLY  44  -3.374  -5.588   0.855
  329   2HA   GLY  44          2HA       GLY  44  -3.380  -5.221   2.581
  330    H    CYS  45           H        CYS  45  -2.160  -3.670   0.395
  331    HA   CYS  45           HA       CYS  45   0.734  -4.024   0.572
  332   1HB   CYS  45          1HB       CYS  45  -1.268  -2.310  -0.773
  333   2HB   CYS  45          2HB       CYS  45   0.286  -1.533  -0.470
  334    H    TYR  46           H        TYR  46   1.541  -3.666   2.655
  335    HA   TYR  46           HA       TYR  46   0.757  -1.102   4.000
  336   1HB   TYR  46          1HB       TYR  46   0.328  -3.503   4.965
  337   2HB   TYR  46          2HB       TYR  46   2.053  -3.470   5.331
  338    HD1  TYR  46           HD1      TYR  46  -0.637  -0.857   5.422
  339    HD2  TYR  46           HD2      TYR  46   2.383  -3.004   7.596
  340    HE1  TYR  46           HE1      TYR  46  -1.096   0.526   7.425
  341    HE2  TYR  46           HE2      TYR  46   1.924  -1.616   9.600
  342    HH   TYR  46           HH       TYR  46  -0.451  -0.185  10.337
  343    H    CYS  47           H        CYS  47   2.378   0.417   4.052
  344    HA   CYS  47           HA       CYS  47   5.212  -0.564   3.817
  345   1HB   CYS  47          1HB       CYS  47   3.778   1.852   2.688
  346   2HB   CYS  47          2HB       CYS  47   5.534   1.710   2.691
  347    H    GLU  48           H        GLU  48   6.816   0.790   4.921
  348    HA   GLU  48           HA       GLU  48   5.669   2.287   7.255
  349   1HB   GLU  48          1HB       GLU  48   8.036   0.439   6.914
  350   2HB   GLU  48          2HB       GLU  48   7.883   1.502   8.314
  351   1HG   GLU  48          1HG       GLU  48   6.751  -0.280   9.193
  352   2HG   GLU  48          2HG       GLU  48   5.403   0.406   8.286
  353    H    GLY  49           H        GLY  49   6.020   3.827   5.058
  354   1HA   GLY  49          1HA       GLY  49   8.128   5.660   5.867
  355   2HA   GLY  49          2HA       GLY  49   8.479   4.869   4.329
  356    H    LEU  50           H        LEU  50   5.208   5.561   5.356
  357    HA   LEU  50           HA       LEU  50   4.878   7.326   2.988
  358   1HB   LEU  50          1HB       LEU  50   2.731   6.341   4.869
  359   2HB   LEU  50          2HB       LEU  50   2.591   6.726   3.155
  360    HG   LEU  50           HG       LEU  50   4.214   4.420   4.271
  361   1HD1  LEU  50          1HD1      LEU  50   1.396   4.649   3.261
  362   2HD1  LEU  50          2HD1      LEU  50   2.302   3.167   2.952
  363   3HD1  LEU  50          3HD1      LEU  50   2.024   3.702   4.610
  364   1HD2  LEU  50          1HD2      LEU  50   4.038   5.729   1.679
  365   2HD2  LEU  50          2HD2      LEU  50   5.155   4.475   2.219
  366   3HD2  LEU  50          3HD2      LEU  50   3.578   4.030   1.568
  367    HA   PRO  51           HA       PRO  51   5.319  10.815   5.828
  368   1HB   PRO  51          1HB       PRO  51   4.033  12.336   3.683
  369   2HB   PRO  51          2HB       PRO  51   5.674  12.483   4.322
  370   1HG   PRO  51          1HG       PRO  51   4.929  11.357   1.835
  371   2HG   PRO  51          2HG       PRO  51   6.529  11.305   2.581
  372   1HD   PRO  51          1HD       PRO  51   4.672   9.119   2.194
  373   2HD   PRO  51          2HD       PRO  51   6.299   9.062   2.916
  374    H    ASP  52           H        ASP  52   3.780  12.045   7.062
  375    HA   ASP  52           HA       ASP  52   1.220  10.870   7.483
  376   1HB   ASP  52          1HB       ASP  52   2.824  12.481   8.858
  377   2HB   ASP  52          2HB       ASP  52   1.803  13.734   8.153
  378    H    SER  53           H        SER  53   2.114  13.879   5.765
  379    HA   SER  53           HA       SER  53  -0.505  14.742   5.089
  380   1HB   SER  53          1HB       SER  53   2.237  15.061   3.871
  381   2HB   SER  53          2HB       SER  53   0.830  15.869   3.186
  382    HG   SER  53           HG       SER  53   0.553  16.971   5.074
  383    H    THR  54           H        THR  54   1.400  12.131   3.768
  384    HA   THR  54           HA       THR  54   0.174  12.012   1.161
  385    HB   THR  54           HB       THR  54   1.133   9.558   2.565
  386    HG1  THR  54           HG1      THR  54   2.606  11.922   2.173
  387   1HG2  THR  54          1HG2      THR  54   0.589   9.868   0.059
  388   2HG2  THR  54          2HG2      THR  54   2.092  10.786  -0.016
  389   3HG2  THR  54          3HG2      THR  54   2.118   9.091   0.467
  390    H    GLN  55           H        GLN  55  -1.389  10.361   0.451
  391    HA   GLN  55           HA       GLN  55  -3.574  10.006   2.414
  392   1HB   GLN  55          1HB       GLN  55  -3.639  10.806  -0.080
  393   2HB   GLN  55          2HB       GLN  55  -3.545   9.086  -0.455
  394   1HG   GLN  55          1HG       GLN  55  -5.854   9.420  -0.347
  395   2HG   GLN  55          2HG       GLN  55  -5.497   8.882   1.293
  396   1HE2  GLN  55          2HE2      GLN  55  -6.817  10.120   2.644
  397   2HE2  GLN  55          1HE2      GLN  55  -6.970  11.809   2.563
  398    H    THR  56           H        THR  56  -4.634   7.818   2.558
  399    HA   THR  56           HA       THR  56  -3.126   5.464   1.713
  400    HB   THR  56           HB       THR  56  -1.803   6.463   3.603
  401    HG1  THR  56           HG1      THR  56  -2.024   4.143   3.122
  402   1HG2  THR  56          1HG2      THR  56  -4.381   6.744   4.723
  403   2HG2  THR  56          2HG2      THR  56  -3.542   5.555   5.717
  404   3HG2  THR  56          3HG2      THR  56  -2.840   7.154   5.474
  405    H    TRP  57           H        TRP  57  -4.223   3.488   2.289
  406    HA   TRP  57           HA       TRP  57  -7.113   3.702   2.472
  407   1HB   TRP  57          1HB       TRP  57  -5.418   1.990   1.354
  408   2HB   TRP  57          2HB       TRP  57  -5.532   1.190   2.917
  409    HD1  TRP  57           HD1      TRP  57  -7.563   2.033  -0.182
  410    HE1  TRP  57           HE1      TRP  57  -9.757   0.681  -0.137
  411    HE3  TRP  57           HE3      TRP  57  -7.281   0.053   4.517
  412    HZ2  TRP  57           HZ2      TRP  57 -11.202  -1.016   1.657
  413    HZ3  TRP  57           HZ3      TRP  57  -9.078  -1.427   5.368
  414    HH2  TRP  57           HH2      TRP  57 -11.036  -1.963   3.944
  415    HA   PRO  58           HA       PRO  58  -8.745   2.623   3.024
  416   1HB   PRO  58          1HB       PRO  58 -10.821   3.350   4.778
  417   2HB   PRO  58          2HB       PRO  58 -10.366   1.704   4.325
  418   1HG   PRO  58          1HG       PRO  58 -10.030   3.025   6.883
  419   2HG   PRO  58          2HG       PRO  58  -9.725   1.336   6.467
  420   1HD   PRO  58          1HD       PRO  58  -7.785   3.451   6.903
  421   2HD   PRO  58          2HD       PRO  58  -7.478   1.731   6.557
  422    H    LEU  59           H        LEU  59 -10.586   4.324   2.486
  423    HA   LEU  59           HA       LEU  59  -9.341   7.011   2.585
  424   1HB   LEU  59          1HB       LEU  59 -11.069   5.439   0.862
  425   2HB   LEU  59          2HB       LEU  59 -11.780   7.023   1.168
  426    HG   LEU  59           HG       LEU  59  -9.277   7.827   0.699
  427   1HD1  LEU  59          1HD1      LEU  59  -8.582   5.388   0.403
  428   2HD1  LEU  59          2HD1      LEU  59  -9.524   5.396  -1.088
  429   3HD1  LEU  59          3HD1      LEU  59  -8.138   6.472  -0.916
  430   1HD2  LEU  59          1HD2      LEU  59 -11.685   7.879  -0.659
  431   2HD2  LEU  59          2HD2      LEU  59 -10.220   8.725  -1.162
  432   3HD2  LEU  59          3HD2      LEU  59 -10.599   7.141  -1.836
  433    HA   PRO  60           HA       PRO  60 -12.063   8.942   5.447
  434   1HB   PRO  60          1HB       PRO  60 -13.382  10.708   3.575
  435   2HB   PRO  60          2HB       PRO  60 -12.113  11.095   4.740
  436   1HG   PRO  60          1HG       PRO  60 -11.870  10.917   1.895
  437   2HG   PRO  60          2HG       PRO  60 -10.593  11.245   3.071
  438   1HD   PRO  60          1HD       PRO  60 -10.979   8.851   1.510
  439   2HD   PRO  60          2HD       PRO  60  -9.707   9.177   2.713
  440    H    ASN  61           H        ASN  61 -14.641   9.878   5.277
  441    HA   ASN  61           HA       ASN  61 -16.303   7.648   5.423
  442   1HB   ASN  61          1HB       ASN  61 -16.516  10.535   5.229
  443   2HB   ASN  61          2HB       ASN  61 -17.860   9.761   4.390
  444   1HD2  ASN  61          2HD2      ASN  61 -18.138   7.423   6.014
  445   2HD2  ASN  61          1HD2      ASN  61 -18.644   7.902   7.562
  446    H    LYS  62           H        LYS  62 -15.127   9.317   2.598
  447    HA   LYS  62           HA       LYS  62 -17.026   8.004   0.758
  448   1HB   LYS  62          1HB       LYS  62 -14.549   9.719   0.363
  449   2HB   LYS  62          2HB       LYS  62 -15.659   9.245  -0.923
  450   1HG   LYS  62          1HG       LYS  62 -17.474  10.458   0.079
  451   2HG   LYS  62          2HG       LYS  62 -16.549  10.739   1.554
  452   1HD   LYS  62          1HD       LYS  62 -16.129  12.753   0.543
  453   2HD   LYS  62          2HD       LYS  62 -14.850  11.825  -0.241
  454   1HE   LYS  62          1HE       LYS  62 -16.242  11.434  -2.192
  455   2HE   LYS  62          2HE       LYS  62 -17.640  12.180  -1.391
  456   1HZ   LYS  62          1HZ       LYS  62 -15.192  13.745  -1.398
  457   2HZ   LYS  62          2HZ       LYS  62 -15.930  13.549  -2.913
  458   3HZ   LYS  62          3HZ       LYS  62 -16.802  14.242  -1.630
  459    H    THR  63           H        THR  63 -16.499   5.752   1.176
  460    HA   THR  63           HA       THR  63 -13.766   4.775   0.858
  461    HB   THR  63           HB       THR  63 -16.215   3.059   0.727
  462    HG1  THR  63           HG1      THR  63 -15.502   4.833   2.765
  463   1HG2  THR  63          1HG2      THR  63 -13.451   2.751   1.313
  464   2HG2  THR  63          2HG2      THR  63 -14.340   2.438   2.805
  465   3HG2  THR  63          3HG2      THR  63 -14.707   1.514   1.348
  466    H    CYS  64           H        CYS  64 -13.094   3.317  -0.853
  467    HA   CYS  64           HA       CYS  64 -13.759   4.143  -3.512
  468   1HB   CYS  64          1HB       CYS  64 -11.634   3.095  -2.645
  469   2HB   CYS  64          2HB       CYS  64 -12.491   1.557  -2.556
  Start of MODEL   12
    1   1H    LYS   1          1H        LYS   1   7.180   7.466   6.872
    2   2H    LYS   1          2H        LYS   1   6.972   8.983   7.608
    3   3H    LYS   1          3H        LYS   1   7.663   7.705   8.482
    4    HA   LYS   1           HA       LYS   1   5.620   7.314   9.285
    5   1HB   LYS   1          1HB       LYS   1   4.984   9.558   8.613
    6   2HB   LYS   1          2HB       LYS   1   4.781   9.043   6.937
    7   1HG   LYS   1          1HG       LYS   1   3.000   7.445   7.721
    8   2HG   LYS   1          2HG       LYS   1   3.122   8.180   9.321
    9   1HD   LYS   1          1HD       LYS   1   1.374   9.397   8.345
   10   2HD   LYS   1          2HD       LYS   1   2.771  10.429   8.039
   11   1HE   LYS   1          1HE       LYS   1   2.947   8.995   5.812
   12   2HE   LYS   1          2HE       LYS   1   1.217   8.737   6.109
   13   1HZ   LYS   1          1HZ       LYS   1   1.844  11.421   6.670
   14   2HZ   LYS   1          2HZ       LYS   1   2.460  11.051   5.134
   15   3HZ   LYS   1          3HZ       LYS   1   0.812  10.812   5.466
   16    H    ASP   2           H        ASP   2   4.550   5.383   9.087
   17    HA   ASP   2           HA       ASP   2   4.655   3.984   6.471
   18   1HB   ASP   2          1HB       ASP   2   3.714   2.973   9.166
   19   2HB   ASP   2          2HB       ASP   2   4.328   2.024   7.812
   20    H    GLY   3           H        GLY   3   2.802   3.411   5.336
   21   1HA   GLY   3          1HA       GLY   3   0.160   3.991   6.581
   22   2HA   GLY   3          2HA       GLY   3   0.543   4.705   5.013
   23    H    TYR   4           H        TYR   4  -1.558   3.244   4.720
   24    HA   TYR   4           HA       TYR   4  -0.664   0.505   3.884
   25   1HB   TYR   4          1HB       TYR   4  -2.850   1.534   5.456
   26   2HB   TYR   4          2HB       TYR   4  -3.493   0.723   4.027
   27    HD1  TYR   4           HD1      TYR   4  -1.873  -1.477   3.437
   28    HD2  TYR   4           HD2      TYR   4  -2.764   0.139   7.314
   29    HE1  TYR   4           HE1      TYR   4  -1.394  -3.682   4.465
   30    HE2  TYR   4           HE2      TYR   4  -2.286  -2.065   8.344
   31    HH   TYR   4           HH       TYR   4  -2.385  -4.687   7.185
   32    H    LEU   5           H        LEU   5  -0.747   0.114   1.706
   33    HA   LEU   5           HA       LEU   5  -1.244   2.080  -0.250
   34   1HB   LEU   5          1HB       LEU   5  -0.910  -0.851  -0.069
   35   2HB   LEU   5          2HB       LEU   5  -1.714  -0.287  -1.535
   36    HG   LEU   5           HG       LEU   5   0.734   1.172  -0.643
   37   1HD1  LEU   5          1HD1      LEU   5   0.667  -1.612  -1.814
   38   2HD1  LEU   5          2HD1      LEU   5   2.045  -0.539  -2.053
   39   3HD1  LEU   5          3HD1      LEU   5   1.586  -1.034  -0.424
   40   1HD2  LEU   5          1HD2      LEU   5  -0.429   0.326  -3.315
   41   2HD2  LEU   5          2HD2      LEU   5  -0.522   1.935  -2.601
   42   3HD2  LEU   5          3HD2      LEU   5   1.035   1.288  -3.119
   43    H    VAL   6           H        VAL   6  -3.007   2.074  -1.902
   44    HA   VAL   6           HA       VAL   6  -5.652   1.186  -0.797
   45    HB   VAL   6           HB       VAL   6  -6.552   3.344  -1.595
   46   1HG1  VAL   6          1HG1      VAL   6  -4.112   3.527   0.191
   47   2HG1  VAL   6          2HG1      VAL   6  -5.282   4.832  -0.009
   48   3HG1  VAL   6          3HG1      VAL   6  -5.787   3.296   0.695
   49   1HG2  VAL   6          1HG2      VAL   6  -4.706   3.490  -3.410
   50   2HG2  VAL   6          2HG2      VAL   6  -5.206   4.991  -2.631
   51   3HG2  VAL   6          3HG2      VAL   6  -3.707   4.200  -2.141
   52    H    GLU   7           H        GLU   7  -7.241   1.944  -2.895
   53    HA   GLU   7           HA       GLU   7  -6.029   0.801  -5.370
   54   1HB   GLU   7          1HB       GLU   7  -7.403  -0.739  -3.594
   55   2HB   GLU   7          2HB       GLU   7  -8.727  -0.171  -4.613
   56   1HG   GLU   7          1HG       GLU   7  -7.084  -0.816  -6.575
   57   2HG   GLU   7          2HG       GLU   7  -6.363  -1.858  -5.348
   58    H    LYS   8           H        LYS   8  -7.695   1.019  -7.233
   59    HA   LYS   8           HA       LYS   8  -8.471   3.691  -7.632
   60   1HB   LYS   8          1HB       LYS   8  -9.748   1.165  -8.737
   61   2HB   LYS   8          2HB       LYS   8  -9.785   2.760  -9.490
   62   1HG   LYS   8          1HG       LYS   8  -7.699   2.524 -10.339
   63   2HG   LYS   8          2HG       LYS   8  -7.069   1.881  -8.823
   64   1HD   LYS   8          1HD       LYS   8  -7.086  -0.191  -9.694
   65   2HD   LYS   8          2HD       LYS   8  -8.829  -0.075  -9.931
   66   1HE   LYS   8          1HE       LYS   8  -8.572   0.165 -12.172
   67   2HE   LYS   8          2HE       LYS   8  -7.378   1.460 -11.950
   68   1HZ   LYS   8          1HZ       LYS   8  -6.679  -1.341 -11.341
   69   2HZ   LYS   8          2HZ       LYS   8  -6.593  -0.772 -12.939
   70   3HZ   LYS   8          3HZ       LYS   8  -5.652  -0.044 -11.731
   71    H    THR   9           H        THR   9 -10.151   1.115  -5.937
   72    HA   THR   9           HA       THR   9 -12.651   2.701  -5.748
   73    HB   THR   9           HB       THR   9 -13.502   0.617  -4.806
   74    HG1  THR   9           HG1      THR   9 -11.724   0.069  -3.547
   75   1HG2  THR   9          1HG2      THR   9 -13.076   0.813  -7.301
   76   2HG2  THR   9          2HG2      THR   9 -11.590  -0.099  -7.037
   77   3HG2  THR   9          3HG2      THR   9 -13.151  -0.838  -6.684
   78    H    GLY  10           H        GLY  10  -9.723   2.346  -4.072
   79   1HA   GLY  10          1HA       GLY  10  -9.155   3.597  -2.100
   80   2HA   GLY  10          2HA       GLY  10 -10.869   3.698  -1.697
   81    H    CYS  11           H        CYS  11  -9.775   0.595  -2.681
   82    HA   CYS  11           HA       CYS  11 -10.089  -0.387   0.115
   83   1HB   CYS  11          1HB       CYS  11 -10.356  -1.458  -2.664
   84   2HB   CYS  11          2HB       CYS  11  -9.941  -2.601  -1.389
   85    H    LYS  12           H        LYS  12  -8.524  -2.092   0.840
   86    HA   LYS  12           HA       LYS  12  -5.761  -1.287   0.332
   87   1HB   LYS  12          1HB       LYS  12  -6.879  -3.665   1.850
   88   2HB   LYS  12          2HB       LYS  12  -5.311  -2.900   2.089
   89   1HG   LYS  12          1HG       LYS  12  -6.269  -0.966   3.047
   90   2HG   LYS  12          2HG       LYS  12  -7.875  -1.349   2.422
   91   1HD   LYS  12          1HD       LYS  12  -7.983  -1.946   4.714
   92   2HD   LYS  12          2HD       LYS  12  -7.734  -3.474   3.874
   93   1HE   LYS  12          1HE       LYS  12  -5.148  -2.754   4.253
   94   2HE   LYS  12          2HE       LYS  12  -5.888  -1.994   5.675
   95   1HZ   LYS  12          1HZ       LYS  12  -6.868  -4.644   5.023
   96   2HZ   LYS  12          2HZ       LYS  12  -5.254  -4.589   5.550
   97   3HZ   LYS  12          3HZ       LYS  12  -6.488  -3.969   6.534
   98    H    LYS  13           H        LYS  13  -4.273  -3.508   0.221
   99    HA   LYS  13           HA       LYS  13  -5.273  -5.035  -2.161
  100   1HB   LYS  13          1HB       LYS  13  -3.318  -3.211  -2.236
  101   2HB   LYS  13          2HB       LYS  13  -2.360  -4.578  -1.663
  102   1HG   LYS  13          1HG       LYS  13  -2.188  -4.947  -3.934
  103   2HG   LYS  13          2HG       LYS  13  -3.679  -5.835  -3.619
  104   1HD   LYS  13          1HD       LYS  13  -4.889  -3.604  -4.087
  105   2HD   LYS  13          2HD       LYS  13  -3.360  -3.072  -4.787
  106   1HE   LYS  13          1HE       LYS  13  -3.939  -5.697  -5.800
  107   2HE   LYS  13          2HE       LYS  13  -5.365  -4.666  -6.035
  108   1HZ   LYS  13          1HZ       LYS  13  -3.513  -2.926  -6.651
  109   2HZ   LYS  13          2HZ       LYS  13  -2.641  -4.323  -7.056
  110   3HZ   LYS  13          3HZ       LYS  13  -4.128  -4.003  -7.814
  111    H    THR  14           H        THR  14  -5.885  -6.169   0.210
  112    HA   THR  14           HA       THR  14  -4.227  -7.622   1.816
  113    HB   THR  14           HB       THR  14  -6.723  -8.408   0.302
  114    HG1  THR  14           HG1      THR  14  -7.559  -7.391   1.911
  115   1HG2  THR  14          1HG2      THR  14  -4.911 -10.152   1.761
  116   2HG2  THR  14          2HG2      THR  14  -6.502 -10.101   2.517
  117   3HG2  THR  14          3HG2      THR  14  -6.346 -10.568   0.824
  118    H    CYS  15           H        CYS  15  -2.819  -9.397   1.617
  119    HA   CYS  15           HA       CYS  15  -2.431 -10.480  -1.156
  120   1HB   CYS  15          1HB       CYS  15  -0.030 -10.406  -0.675
  121   2HB   CYS  15          2HB       CYS  15  -0.733  -8.811  -0.404
  122    H    TYR  16           H        TYR  16  -1.635 -12.667  -1.241
  123    HA   TYR  16           HA       TYR  16  -2.377 -14.287   1.150
  124   1HB   TYR  16          1HB       TYR  16  -1.787 -15.168  -1.690
  125   2HB   TYR  16          2HB       TYR  16  -2.704 -16.043  -0.463
  126    HD1  TYR  16           HD1      TYR  16  -4.715 -14.572   0.593
  127    HD2  TYR  16           HD2      TYR  16  -3.017 -14.050  -3.318
  128    HE1  TYR  16           HE1      TYR  16  -6.790 -13.435  -0.156
  129    HE2  TYR  16           HE2      TYR  16  -5.093 -12.916  -4.069
  130    HH   TYR  16           HH       TYR  16  -7.778 -12.318  -1.804
  131    H    LYS  17           H        LYS  17   0.341 -12.909  -0.169
  132    HA   LYS  17           HA       LYS  17   2.116 -15.149   0.755
  133   1HB   LYS  17          1HB       LYS  17   2.057 -13.366  -1.606
  134   2HB   LYS  17          2HB       LYS  17   3.650 -13.557  -0.872
  135   1HG   LYS  17          1HG       LYS  17   3.730 -15.428  -2.179
  136   2HG   LYS  17          2HG       LYS  17   2.804 -16.137  -0.855
  137   1HD   LYS  17          1HD       LYS  17   1.372 -16.664  -2.574
  138   2HD   LYS  17          2HD       LYS  17   0.776 -15.038  -2.237
  139   1HE   LYS  17          1HE       LYS  17   1.152 -14.782  -4.504
  140   2HE   LYS  17          2HE       LYS  17   2.801 -14.438  -3.948
  141   1HZ   LYS  17          1HZ       LYS  17   2.761 -17.121  -3.934
  142   2HZ   LYS  17          2HZ       LYS  17   1.757 -16.797  -5.265
  143   3HZ   LYS  17          3HZ       LYS  17   3.343 -16.190  -5.226
  144    H    LEU  18           H        LEU  18   2.217 -14.331   2.928
  145    HA   LEU  18           HA       LEU  18   2.718 -11.602   3.639
  146   1HB   LEU  18          1HB       LEU  18   3.207 -14.277   4.973
  147   2HB   LEU  18          2HB       LEU  18   3.441 -12.739   5.803
  148    HG   LEU  18           HG       LEU  18   0.869 -13.815   4.622
  149   1HD1  LEU  18          1HD1      LEU  18   1.961 -13.320   7.373
  150   2HD1  LEU  18          2HD1      LEU  18   0.224 -13.162   7.103
  151   3HD1  LEU  18          3HD1      LEU  18   1.033 -14.693   6.769
  152   1HD2  LEU  18          1HD2      LEU  18   1.729 -11.046   5.340
  153   2HD2  LEU  18          2HD2      LEU  18   0.580 -11.580   4.112
  154   3HD2  LEU  18          3HD2      LEU  18   0.102 -11.536   5.808
  155    H    GLY  19           H        GLY  19   4.762 -10.775   4.603
  156   1HA   GLY  19          1HA       GLY  19   7.154 -10.755   4.832
  157   2HA   GLY  19          2HA       GLY  19   7.242 -12.149   3.762
  158    H    GLU  20           H        GLU  20   8.951 -10.849   2.729
  159    HA   GLU  20           HA       GLU  20   8.617  -8.362   1.443
  160   1HB   GLU  20          1HB       GLU  20  10.511 -10.388   1.666
  161   2HB   GLU  20          2HB       GLU  20  10.171 -10.331  -0.064
  162   1HG   GLU  20          1HG       GLU  20  10.698  -7.817   1.521
  163   2HG   GLU  20          2HG       GLU  20  12.014  -8.760   0.821
  164    H    ASN  21           H        ASN  21   6.299  -8.571   0.640
  165    HA   ASN  21           HA       ASN  21   5.678 -10.394  -1.533
  166   1HB   ASN  21          1HB       ASN  21   4.188  -9.023   0.158
  167   2HB   ASN  21          2HB       ASN  21   4.313  -7.756  -1.065
  168   1HD2  ASN  21          2HD2      ASN  21   2.434 -10.402  -0.167
  169   2HD2  ASN  21          1HD2      ASN  21   1.715 -10.732  -1.668
  170    H    ASP  22           H        ASP  22   7.543 -10.011  -2.951
  171    HA   ASP  22           HA       ASP  22   8.559  -7.686  -4.008
  172   1HB   ASP  22          1HB       ASP  22   7.926 -10.400  -5.109
  173   2HB   ASP  22          2HB       ASP  22   8.567  -9.172  -6.202
  174    H    PHE  23           H        PHE  23   5.726  -9.377  -5.445
  175    HA   PHE  23           HA       PHE  23   5.038  -7.661  -7.479
  176   1HB   PHE  23          1HB       PHE  23   3.832  -9.699  -6.043
  177   2HB   PHE  23          2HB       PHE  23   2.734  -8.338  -5.797
  178    HD1  PHE  23           HD1      PHE  23   3.141  -6.820  -8.311
  179    HD2  PHE  23           HD2      PHE  23   2.706 -11.041  -7.654
  180    HE1  PHE  23           HE1      PHE  23   2.278  -7.087 -10.619
  181    HE2  PHE  23           HE2      PHE  23   1.843 -11.310  -9.965
  182    HZ   PHE  23           HZ       PHE  23   1.629  -9.332 -11.447
  183    H    CYS  24           H        CYS  24   3.626  -7.214  -4.191
  184    HA   CYS  24           HA       CYS  24   2.693  -4.562  -4.778
  185   1HB   CYS  24          1HB       CYS  24   2.161  -6.350  -2.885
  186   2HB   CYS  24          2HB       CYS  24   3.383  -5.433  -1.998
  187    H    ASN  25           H        ASN  25   5.753  -5.794  -3.496
  188    HA   ASN  25           HA       ASN  25   6.943  -3.571  -2.331
  189   1HB   ASN  25          1HB       ASN  25   7.778  -5.986  -3.070
  190   2HB   ASN  25          2HB       ASN  25   8.432  -5.094  -4.444
  191   1HD2  ASN  25          2HD2      ASN  25   9.300  -6.181  -1.428
  192   2HD2  ASN  25          1HD2      ASN  25  10.476  -5.021  -1.037
  193    H    ARG  26           H        ARG  26   7.400  -4.303  -5.802
  194    HA   ARG  26           HA       ARG  26   8.249  -1.654  -6.495
  195   1HB   ARG  26          1HB       ARG  26   8.161  -4.153  -7.638
  196   2HB   ARG  26          2HB       ARG  26   6.935  -3.292  -8.570
  197   1HG   ARG  26          1HG       ARG  26   8.794  -2.679  -9.787
  198   2HG   ARG  26          2HG       ARG  26   8.823  -1.399  -8.577
  199   1HD   ARG  26          1HD       ARG  26  10.727  -2.196  -7.620
  200   2HD   ARG  26          2HD       ARG  26  10.179  -3.878  -7.715
  201    HE   ARG  26           HE       ARG  26  11.938  -2.569  -9.574
  202   1HH1  ARG  26          1HH1      ARG  26   9.142  -4.609  -9.531
  203   2HH1  ARG  26          2HH1      ARG  26   9.359  -5.138 -11.164
  204   1HH2  ARG  26          1HH2      ARG  26  12.232  -3.274 -11.681
  205   2HH2  ARG  26          2HH2      ARG  26  11.113  -4.401 -12.372
  206    H    GLU  27           H        GLU  27   5.070  -3.276  -6.688
  207    HA   GLU  27           HA       GLU  27   3.546  -1.380  -8.061
  208   1HB   GLU  27          1HB       GLU  27   2.860  -3.610  -7.106
  209   2HB   GLU  27          2HB       GLU  27   2.769  -2.844  -5.520
  210   1HG   GLU  27          1HG       GLU  27   1.253  -1.104  -6.879
  211   2HG   GLU  27          2HG       GLU  27   0.974  -2.529  -7.882
  212    H    CYS  28           H        CYS  28   4.524  -1.327  -4.626
  213    HA   CYS  28           HA       CYS  28   3.088   1.115  -3.992
  214   1HB   CYS  28          1HB       CYS  28   3.866  -0.734  -2.426
  215   2HB   CYS  28          2HB       CYS  28   5.502  -0.103  -2.617
  216    H    LYS  29           H        LYS  29   6.443   0.355  -4.920
  217    HA   LYS  29           HA       LYS  29   7.722   2.804  -4.514
  218   1HB   LYS  29          1HB       LYS  29   7.875   0.613  -6.561
  219   2HB   LYS  29          2HB       LYS  29   8.889   2.042  -6.767
  220   1HG   LYS  29          1HG       LYS  29   9.160   1.393  -4.063
  221   2HG   LYS  29          2HG       LYS  29   9.181  -0.166  -4.888
  222   1HD   LYS  29          1HD       LYS  29  11.399   0.338  -5.155
  223   2HD   LYS  29          2HD       LYS  29  10.792   1.241  -6.543
  224   1HE   LYS  29          1HE       LYS  29  10.598   2.793  -4.069
  225   2HE   LYS  29          2HE       LYS  29  12.268   2.325  -4.445
  226   1HZ   LYS  29          1HZ       LYS  29  10.393   3.414  -6.470
  227   2HZ   LYS  29          2HZ       LYS  29  11.467   4.393  -5.591
  228   3HZ   LYS  29          3HZ       LYS  29  12.071   3.190  -6.623
  229    H    TRP  30           H        TRP  30   6.995   2.097  -7.888
  230    HA   TRP  30           HA       TRP  30   6.172   3.499  -9.603
  231   1HB   TRP  30          1HB       TRP  30   4.433   3.663  -7.243
  232   2HB   TRP  30          2HB       TRP  30   4.291   5.067  -8.303
  233    HD1  TRP  30           HD1      TRP  30   2.402   2.231  -7.863
  234    HE1  TRP  30           HE1      TRP  30   1.502   1.189 -10.046
  235    HE3  TRP  30           HE3      TRP  30   5.526   4.438 -11.248
  236    HZ2  TRP  30           HZ2      TRP  30   2.042   1.276 -12.853
  237    HZ3  TRP  30           HZ3      TRP  30   5.312   3.939 -13.666
  238    HH2  TRP  30           HH2      TRP  30   3.576   2.363 -14.472
  239    H    LYS  31           H        LYS  31   7.699   4.986 -10.248
  240    HA   LYS  31           HA       LYS  31   9.078   6.881  -8.734
  241   1HB   LYS  31          1HB       LYS  31   8.256   6.555 -11.583
  242   2HB   LYS  31          2HB       LYS  31   8.932   8.116 -11.114
  243   1HG   LYS  31          1HG       LYS  31  10.346   5.654 -10.185
  244   2HG   LYS  31          2HG       LYS  31  10.507   6.105 -11.884
  245   1HD   LYS  31          1HD       LYS  31  10.799   8.345  -9.981
  246   2HD   LYS  31          2HD       LYS  31  12.065   7.121  -9.880
  247   1HE   LYS  31          1HE       LYS  31  12.027   7.343 -12.535
  248   2HE   LYS  31          2HE       LYS  31  11.383   8.951 -12.152
  249   1HZ   LYS  31          1HZ       LYS  31  13.389   8.521 -10.321
  250   2HZ   LYS  31          2HZ       LYS  31  14.029   7.948 -11.785
  251   3HZ   LYS  31          3HZ       LYS  31  13.462   9.543 -11.678
  252    H    HIS  32           H        HIS  32   8.819   9.265  -8.683
  253    HA   HIS  32           HA       HIS  32   7.584  11.242  -8.312
  254   1HB   HIS  32          1HB       HIS  32   6.320   9.769 -10.417
  255   2HB   HIS  32          2HB       HIS  32   5.062  10.494  -9.415
  256    HD1  HIS  32           HD1      HIS  32   5.015  13.095  -9.239
  257    HD2  HIS  32           HD2      HIS  32   7.946  11.631 -11.815
  258    HE1  HIS  32           HE1      HIS  32   5.857  15.081 -10.567
  259    H    ILE  33           H        ILE  33   7.494   8.927  -6.406
  260    HA   ILE  33           HA       ILE  33   5.002   9.749  -4.967
  261    HB   ILE  33           HB       ILE  33   6.023   6.979  -5.630
  262   1HG1  ILE  33          1HG1      ILE  33   3.441   8.508  -6.026
  263   2HG1  ILE  33          2HG1      ILE  33   4.490   7.813  -7.262
  264   1HG2  ILE  33          1HG2      ILE  33   4.926   7.810  -3.137
  265   2HG2  ILE  33          2HG2      ILE  33   3.664   6.918  -3.981
  266   3HG2  ILE  33          3HG2      ILE  33   5.229   6.162  -3.685
  267   1HD1  ILE  33          1HD1      ILE  33   3.860   5.635  -5.657
  268   2HD1  ILE  33          2HD1      ILE  33   2.353   6.549  -5.715
  269   3HD1  ILE  33          3HD1      ILE  33   3.118   6.014  -7.212
  270    H    GLY  34           H        GLY  34   8.103   7.971  -4.713
  271   1HA   GLY  34          1HA       GLY  34   9.811   8.530  -3.101
  272   2HA   GLY  34          2HA       GLY  34   8.593   9.366  -2.142
  273    H    GLY  35           H        GLY  35   9.040   6.061  -3.411
  274   1HA   GLY  35          1HA       GLY  35   8.032   5.030  -0.804
  275   2HA   GLY  35          2HA       GLY  35   8.098   4.104  -2.304
  276    H    SER  36           H        SER  36   9.490   4.188   0.619
  277    HA   SER  36           HA       SER  36  12.296   3.801  -0.273
  278   1HB   SER  36          1HB       SER  36  12.768   4.429   1.864
  279   2HB   SER  36          2HB       SER  36  11.082   4.933   1.925
  280    HG   SER  36           HG       SER  36  12.341   2.898   3.203
  281    H    TYR  37           H        TYR  37   9.937   2.005   1.751
  282    HA   TYR  37           HA       TYR  37  10.791  -0.542   0.490
  283   1HB   TYR  37          1HB       TYR  37  11.986   0.442   2.808
  284   2HB   TYR  37          2HB       TYR  37  10.776  -0.688   3.416
  285    HD1  TYR  37           HD1      TYR  37  10.628  -2.829   1.547
  286    HD2  TYR  37           HD2      TYR  37  14.081  -0.562   2.720
  287    HE1  TYR  37           HE1      TYR  37  12.090  -4.733   0.920
  288    HE2  TYR  37           HE2      TYR  37  15.545  -2.463   2.096
  289    HH   TYR  37           HH       TYR  37  15.290  -4.497   0.396
  290    H    GLY  38           H        GLY  38   8.888  -1.632   0.117
  291   1HA   GLY  38          1HA       GLY  38   6.736  -1.386   2.166
  292   2HA   GLY  38          2HA       GLY  38   6.355  -1.148   0.463
  293    H    TYR  39           H        TYR  39   5.412  -3.211   2.374
  294    HA   TYR  39           HA       TYR  39   5.635  -5.506   0.584
  295   1HB   TYR  39          1HB       TYR  39   6.544  -6.918   2.590
  296   2HB   TYR  39          2HB       TYR  39   7.687  -5.944   1.668
  297    HD1  TYR  39           HD1      TYR  39   5.374  -5.640   4.611
  298    HD2  TYR  39           HD2      TYR  39   9.115  -4.523   2.822
  299    HE1  TYR  39           HE1      TYR  39   5.983  -4.388   6.665
  300    HE2  TYR  39           HE2      TYR  39   9.727  -3.273   4.877
  301    HH   TYR  39           HH       TYR  39   8.822  -2.336   6.794
  302    H    CYS  40           H        CYS  40   4.773  -7.470   2.447
  303    HA   CYS  40           HA       CYS  40   2.118  -6.313   3.190
  304   1HB   CYS  40          1HB       CYS  40   2.952  -8.523   1.675
  305   2HB   CYS  40          2HB       CYS  40   2.320  -9.205   3.175
  306    H    TYR  41           H        TYR  41   1.430  -6.401   5.284
  307    HA   TYR  41           HA       TYR  41   2.853  -8.152   7.236
  308   1HB   TYR  41          1HB       TYR  41   3.861  -5.823   7.119
  309   2HB   TYR  41          2HB       TYR  41   2.302  -5.198   7.660
  310    HD1  TYR  41           HD1      TYR  41   1.333  -6.099   9.850
  311    HD2  TYR  41           HD2      TYR  41   5.424  -6.679   8.679
  312    HE1  TYR  41           HE1      TYR  41   1.931  -6.616  12.199
  313    HE2  TYR  41           HE2      TYR  41   6.024  -7.197  11.030
  314    HH   TYR  41           HH       TYR  41   5.219  -6.877  13.247
  315    H    GLY  42           H        GLY  42   0.968  -9.406   7.552
  316   1HA   GLY  42          1HA       GLY  42  -0.971  -9.752   8.960
  317   2HA   GLY  42          2HA       GLY  42  -1.266  -8.009   8.930
  318    H    PHE  43           H        PHE  43  -0.463  -9.796   6.049
  319    HA   PHE  43           HA       PHE  43  -1.686 -10.260   4.096
  320   1HB   PHE  43          1HB       PHE  43  -4.004 -10.113   6.054
  321   2HB   PHE  43          2HB       PHE  43  -4.047 -10.855   4.455
  322    HD1  PHE  43           HD1      PHE  43  -2.665 -12.869   3.960
  323    HD2  PHE  43           HD2      PHE  43  -2.968 -11.229   7.919
  324    HE1  PHE  43           HE1      PHE  43  -1.764 -14.978   4.902
  325    HE2  PHE  43           HE2      PHE  43  -2.063 -13.337   8.861
  326    HZ   PHE  43           HZ       PHE  43  -1.462 -15.213   7.353
  327    H    GLY  44           H        GLY  44  -0.880  -7.766   4.102
  328   1HA   GLY  44          1HA       GLY  44  -2.899  -6.318   2.647
  329   2HA   GLY  44          2HA       GLY  44  -2.661  -5.607   4.246
  330    H    CYS  45           H        CYS  45  -1.916  -4.567   1.514
  331    HA   CYS  45           HA       CYS  45   0.997  -4.689   1.373
  332   1HB   CYS  45          1HB       CYS  45  -1.278  -3.359  -0.039
  333   2HB   CYS  45          2HB       CYS  45   0.342  -2.702  -0.278
  334    H    TYR  46           H        TYR  46   2.086  -3.711   3.057
  335    HA   TYR  46           HA       TYR  46   1.182  -1.003   3.952
  336   1HB   TYR  46          1HB       TYR  46   1.544  -3.181   5.421
  337   2HB   TYR  46          2HB       TYR  46   3.237  -2.696   5.334
  338    HD1  TYR  46           HD1      TYR  46  -0.142  -1.183   5.951
  339    HD2  TYR  46           HD2      TYR  46   4.034  -1.213   6.951
  340    HE1  TYR  46           HE1      TYR  46  -0.548   0.530   7.697
  341    HE2  TYR  46           HE2      TYR  46   3.629   0.501   8.697
  342    HH   TYR  46           HH       TYR  46   2.129   1.995   9.487
  343    H    CYS  47           H        CYS  47   2.687   0.726   3.862
  344    HA   CYS  47           HA       CYS  47   5.369   0.110   2.668
  345   1HB   CYS  47          1HB       CYS  47   3.251   2.109   1.851
  346   2HB   CYS  47          2HB       CYS  47   4.929   2.266   1.336
  347    H    GLU  48           H        GLU  48   7.042   1.313   3.539
  348    HA   GLU  48           HA       GLU  48   6.317   3.301   5.665
  349   1HB   GLU  48          1HB       GLU  48   8.789   1.571   5.318
  350   2HB   GLU  48          2HB       GLU  48   8.411   2.575   6.719
  351   1HG   GLU  48          1HG       GLU  48   6.127   1.075   6.496
  352   2HG   GLU  48          2HG       GLU  48   7.355  -0.076   5.968
  353    H    GLY  49           H        GLY  49   6.952   5.386   5.260
  354   1HA   GLY  49          1HA       GLY  49   8.905   6.851   4.648
  355   2HA   GLY  49          2HA       GLY  49   9.113   5.817   3.234
  356    H    LEU  50           H        LEU  50   5.844   6.338   4.044
  357    HA   LEU  50           HA       LEU  50   5.361   7.816   1.582
  358   1HB   LEU  50          1HB       LEU  50   3.512   7.274   3.919
  359   2HB   LEU  50          2HB       LEU  50   3.053   7.549   2.239
  360    HG   LEU  50           HG       LEU  50   4.507   5.163   3.395
  361   1HD1  LEU  50          1HD1      LEU  50   1.876   5.520   3.212
  362   2HD1  LEU  50          2HD1      LEU  50   2.164   5.057   1.535
  363   3HD1  LEU  50          3HD1      LEU  50   2.606   3.958   2.841
  364   1HD2  LEU  50          1HD2      LEU  50   4.293   6.159   0.558
  365   2HD2  LEU  50          2HD2      LEU  50   5.709   5.539   1.403
  366   3HD2  LEU  50          3HD2      LEU  50   4.434   4.434   0.893
  367    HA   PRO  51           HA       PRO  51   6.164  11.744   3.678
  368   1HB   PRO  51          1HB       PRO  51   5.373  13.104   1.290
  369   2HB   PRO  51          2HB       PRO  51   7.017  12.807   1.865
  370   1HG   PRO  51          1HG       PRO  51   5.663  11.582  -0.365
  371   2HG   PRO  51          2HG       PRO  51   7.328  11.336   0.172
  372   1HD   PRO  51          1HD       PRO  51   5.111   9.511   0.413
  373   2HD   PRO  51          2HD       PRO  51   6.782   9.277   0.982
  374    H    ASP  52           H        ASP  52   4.759  13.522   4.344
  375    HA   ASP  52           HA       ASP  52   2.055  12.885   4.866
  376   1HB   ASP  52          1HB       ASP  52   3.872  15.204   4.973
  377   2HB   ASP  52          2HB       ASP  52   2.167  15.638   4.841
  378    H    SER  53           H        SER  53   3.547  14.504   2.105
  379    HA   SER  53           HA       SER  53   1.193  15.575   0.890
  380   1HB   SER  53          1HB       SER  53   3.356  16.285   0.179
  381   2HB   SER  53          2HB       SER  53   3.889  14.629  -0.100
  382    HG   SER  53           HG       SER  53   2.163  16.255  -1.607
  383    H    THR  54           H        THR  54   2.322  12.300   1.171
  384    HA   THR  54           HA       THR  54   0.646  11.392  -1.110
  385    HB   THR  54           HB       THR  54   2.616  10.072   0.775
  386    HG1  THR  54           HG1      THR  54   3.561   9.753  -1.441
  387   1HG2  THR  54          1HG2      THR  54   0.674   8.588   0.074
  388   2HG2  THR  54          2HG2      THR  54   1.237   8.784  -1.586
  389   3HG2  THR  54          3HG2      THR  54   2.276   8.012  -0.388
  390    H    GLN  55           H        GLN  55  -1.365  10.542  -0.785
  391    HA   GLN  55           HA       GLN  55  -2.319  10.170   2.019
  392   1HB   GLN  55          1HB       GLN  55  -3.337  11.347  -0.336
  393   2HB   GLN  55          2HB       GLN  55  -4.301   9.894  -0.078
  394   1HG   GLN  55          1HG       GLN  55  -3.733  11.871   2.139
  395   2HG   GLN  55          2HG       GLN  55  -5.140  12.014   1.084
  396   1HE2  GLN  55          1HE2      GLN  55  -6.893  10.517   1.395
  397   2HE2  GLN  55          2HE2      GLN  55  -6.912   9.378   2.654
  398    H    THR  56           H        THR  56  -2.881   8.121   2.756
  399    HA   THR  56           HA       THR  56  -2.930   5.911   0.731
  400    HB   THR  56           HB       THR  56  -1.968   4.870   3.155
  401    HG1  THR  56           HG1      THR  56  -0.290   6.999   2.593
  402   1HG2  THR  56          1HG2      THR  56  -0.602   5.751   0.602
  403   2HG2  THR  56          2HG2      THR  56   0.206   4.804   1.853
  404   3HG2  THR  56          3HG2      THR  56  -1.188   4.136   1.003
  405    H    TRP  57           H        TRP  57  -3.680   3.815   2.171
  406    HA   TRP  57           HA       TRP  57  -6.472   4.236   2.757
  407   1HB   TRP  57          1HB       TRP  57  -4.945   2.200   1.944
  408   2HB   TRP  57          2HB       TRP  57  -4.906   1.853   3.669
  409    HD1  TRP  57           HD1      TRP  57  -7.329   2.137   0.722
  410    HE1  TRP  57           HE1      TRP  57  -9.521   0.925   1.337
  411    HE3  TRP  57           HE3      TRP  57  -6.389   1.040   5.621
  412    HZ2  TRP  57           HZ2      TRP  57 -10.718  -0.339   3.606
  413    HZ3  TRP  57           HZ3      TRP  57  -8.071  -0.165   6.984
  414    HH2  TRP  57           HH2      TRP  57 -10.232  -0.855   5.985
  415    HA   PRO  58           HA       PRO  58  -7.979   3.398   3.767
  416   1HB   PRO  58          1HB       PRO  58  -9.844   4.290   5.639
  417   2HB   PRO  58          2HB       PRO  58  -9.261   2.629   5.487
  418   1HG   PRO  58          1HG       PRO  58  -8.744   4.542   7.614
  419   2HG   PRO  58          2HG       PRO  58  -8.329   2.826   7.548
  420   1HD   PRO  58          1HD       PRO  58  -6.575   5.117   7.176
  421   2HD   PRO  58          2HD       PRO  58  -6.141   3.388   7.221
  422    H    LEU  59           H        LEU  59  -9.875   4.820   3.029
  423    HA   LEU  59           HA       LEU  59  -8.944   7.505   2.400
  424   1HB   LEU  59          1HB       LEU  59 -10.990   5.597   1.634
  425   2HB   LEU  59          2HB       LEU  59 -11.688   7.208   1.810
  426    HG   LEU  59           HG       LEU  59  -9.884   8.115   0.352
  427   1HD1  LEU  59          1HD1      LEU  59  -9.167   5.182   0.092
  428   2HD1  LEU  59          2HD1      LEU  59  -8.528   6.462  -0.941
  429   3HD1  LEU  59          3HD1      LEU  59  -8.158   6.453   0.783
  430   1HD2  LEU  59          1HD2      LEU  59 -12.176   6.965  -0.411
  431   2HD2  LEU  59          2HD2      LEU  59 -11.014   7.576  -1.589
  432   3HD2  LEU  59          3HD2      LEU  59 -11.060   5.855  -1.209
  433    HA   PRO  60           HA       PRO  60 -10.855  10.123   5.384
  434   1HB   PRO  60          1HB       PRO  60 -13.007  11.088   3.680
  435   2HB   PRO  60          2HB       PRO  60 -11.572  11.947   4.246
  436   1HG   PRO  60          1HG       PRO  60 -12.067  11.004   1.615
  437   2HG   PRO  60          2HG       PRO  60 -10.566  11.701   2.230
  438   1HD   PRO  60          1HD       PRO  60 -11.077   8.954   1.491
  439   2HD   PRO  60          2HD       PRO  60  -9.556   9.663   2.084
  440    H    ASN  61           H        ASN  61 -13.516  10.854   5.778
  441    HA   ASN  61           HA       ASN  61 -14.665   8.811   7.279
  442   1HB   ASN  61          1HB       ASN  61 -16.807  10.112   6.827
  443   2HB   ASN  61          2HB       ASN  61 -15.443  11.096   7.360
  444   1HD2  ASN  61          2HD2      ASN  61 -15.571  13.031   6.193
  445   2HD2  ASN  61          1HD2      ASN  61 -15.807  13.134   4.515
  446    H    LYS  62           H        LYS  62 -14.750   9.294   3.818
  447    HA   LYS  62           HA       LYS  62 -16.825   7.241   3.370
  448   1HB   LYS  62          1HB       LYS  62 -16.455   9.412   2.069
  449   2HB   LYS  62          2HB       LYS  62 -15.018   8.652   1.384
  450   1HG   LYS  62          1HG       LYS  62 -17.101   6.757   1.134
  451   2HG   LYS  62          2HG       LYS  62 -17.782   8.304   0.629
  452   1HD   LYS  62          1HD       LYS  62 -15.107   7.308  -0.368
  453   2HD   LYS  62          2HD       LYS  62 -16.621   6.954  -1.201
  454   1HE   LYS  62          1HE       LYS  62 -16.836   9.670  -0.805
  455   2HE   LYS  62          2HE       LYS  62 -15.096   9.475  -1.096
  456   1HZ   LYS  62          1HZ       LYS  62 -16.092   7.782  -2.887
  457   2HZ   LYS  62          2HZ       LYS  62 -17.337   8.936  -2.869
  458   3HZ   LYS  62          3HZ       LYS  62 -15.751   9.407  -3.241
  459    H    THR  63           H        THR  63 -15.358   5.589   4.554
  460    HA   THR  63           HA       THR  63 -12.884   4.698   3.425
  461    HB   THR  63           HB       THR  63 -14.837   2.877   4.794
  462    HG1  THR  63           HG1      THR  63 -15.144   4.323   6.259
  463   1HG2  THR  63          1HG2      THR  63 -11.895   3.318   4.657
  464   2HG2  THR  63          2HG2      THR  63 -12.547   2.723   6.183
  465   3HG2  THR  63          3HG2      THR  63 -12.803   1.806   4.697
  466    H    CYS  64           H        CYS  64 -12.702   2.404   2.421
  467    HA   CYS  64           HA       CYS  64 -14.097   2.322  -0.076
  468   1HB   CYS  64          1HB       CYS  64 -11.830   1.320   0.809
  469   2HB   CYS  64          2HB       CYS  64 -12.828  -0.072   1.224
  Start of MODEL   13
    1   1H    LYS   1          1H        LYS   1   5.618   6.677   8.917
    2   2H    LYS   1          2H        LYS   1   5.018   8.094   8.203
    3   3H    LYS   1          3H        LYS   1   5.340   8.054   9.871
    4    HA   LYS   1           HA       LYS   1   3.463   6.845  10.367
    5   1HB   LYS   1          1HB       LYS   1   2.764   8.996   9.608
    6   2HB   LYS   1          2HB       LYS   1   3.057   8.577   7.919
    7   1HG   LYS   1          1HG       LYS   1   1.196   7.035   7.906
    8   2HG   LYS   1          2HG       LYS   1   0.971   7.216   9.645
    9   1HD   LYS   1          1HD       LYS   1   0.001   9.304   9.444
   10   2HD   LYS   1          2HD       LYS   1   0.884   9.687   7.966
   11   1HE   LYS   1          1HE       LYS   1  -0.654   8.612   6.605
   12   2HE   LYS   1          2HE       LYS   1  -1.095   7.438   7.861
   13   1HZ   LYS   1          1HZ       LYS   1  -2.084   9.291   9.126
   14   2HZ   LYS   1          2HZ       LYS   1  -1.778  10.331   7.819
   15   3HZ   LYS   1          3HZ       LYS   1  -2.862   9.034   7.640
   16    H    ASP   2           H        ASP   2   3.328   4.629  10.103
   17    HA   ASP   2           HA       ASP   2   3.611   3.277   7.563
   18   1HB   ASP   2          1HB       ASP   2   2.304   2.324  10.131
   19   2HB   ASP   2          2HB       ASP   2   3.059   1.323   8.891
   20    H    GLY   3           H        GLY   3   1.976   2.565   6.147
   21   1HA   GLY   3          1HA       GLY   3  -0.842   2.797   6.947
   22   2HA   GLY   3          2HA       GLY   3  -0.338   3.928   5.694
   23    H    TYR   4           H        TYR   4  -2.062   2.632   4.531
   24    HA   TYR   4           HA       TYR   4  -0.812   0.276   3.156
   25   1HB   TYR   4          1HB       TYR   4  -3.299   0.604   4.684
   26   2HB   TYR   4          2HB       TYR   4  -3.565  -0.089   3.085
   27    HD1  TYR   4           HD1      TYR   4  -1.296  -1.733   2.525
   28    HD2  TYR   4           HD2      TYR   4  -3.249  -1.069   6.294
   29    HE1  TYR   4           HE1      TYR   4  -0.472  -3.927   3.342
   30    HE2  TYR   4           HE2      TYR   4  -2.424  -3.258   7.109
   31    HH   TYR   4           HH       TYR   4  -1.399  -5.638   5.257
   32    H    LEU   5           H        LEU   5  -0.363   1.231   1.137
   33    HA   LEU   5           HA       LEU   5  -1.693   3.366  -0.109
   34   1HB   LEU   5          1HB       LEU   5   0.107   1.172  -0.804
   35   2HB   LEU   5          2HB       LEU   5  -0.922   1.641  -2.159
   36    HG   LEU   5           HG       LEU   5  -0.011   4.016  -0.832
   37   1HD1  LEU   5          1HD1      LEU   5   1.835   2.349  -0.143
   38   2HD1  LEU   5          2HD1      LEU   5   2.275   2.327  -1.853
   39   3HD1  LEU   5          3HD1      LEU   5   2.349   3.837  -0.942
   40   1HD2  LEU   5          1HD2      LEU   5  -0.742   3.661  -3.232
   41   2HD2  LEU   5          2HD2      LEU   5   0.752   4.580  -3.048
   42   3HD2  LEU   5          3HD2      LEU   5   0.815   2.881  -3.518
   43    H    VAL   6           H        VAL   6  -3.509   3.510  -1.474
   44    HA   VAL   6           HA       VAL   6  -5.417   1.226  -1.324
   45    HB   VAL   6           HB       VAL   6  -7.049   2.968  -1.968
   46   1HG1  VAL   6          1HG1      VAL   6  -6.148   2.682   0.432
   47   2HG1  VAL   6          2HG1      VAL   6  -5.234   4.159   0.128
   48   3HG1  VAL   6          3HG1      VAL   6  -6.997   4.183   0.060
   49   1HG2  VAL   6          1HG2      VAL   6  -4.822   4.187  -3.116
   50   2HG2  VAL   6          2HG2      VAL   6  -6.428   4.898  -2.966
   51   3HG2  VAL   6          3HG2      VAL   6  -5.204   5.220  -1.738
   52    H    GLU   7           H        GLU   7  -6.932   1.353  -3.455
   53    HA   GLU   7           HA       GLU   7  -5.089   0.938  -5.771
   54   1HB   GLU   7          1HB       GLU   7  -7.290  -0.466  -4.599
   55   2HB   GLU   7          2HB       GLU   7  -7.780   0.047  -6.214
   56   1HG   GLU   7          1HG       GLU   7  -5.538  -0.870  -7.032
   57   2HG   GLU   7          2HG       GLU   7  -5.386  -1.633  -5.450
   58    H    LYS   8           H        LYS   8  -5.901   1.715  -7.909
   59    HA   LYS   8           HA       LYS   8  -6.599   4.419  -8.027
   60   1HB   LYS   8          1HB       LYS   8  -6.013   2.415  -9.782
   61   2HB   LYS   8          2HB       LYS   8  -7.722   2.669 -10.141
   62   1HG   LYS   8          1HG       LYS   8  -6.503   4.162 -11.570
   63   2HG   LYS   8          2HG       LYS   8  -7.202   5.154 -10.289
   64   1HD   LYS   8          1HD       LYS   8  -5.060   5.053  -9.053
   65   2HD   LYS   8          2HD       LYS   8  -4.361   4.095 -10.358
   66   1HE   LYS   8          1HE       LYS   8  -3.954   5.954 -11.591
   67   2HE   LYS   8          2HE       LYS   8  -5.621   6.525 -11.378
   68   1HZ   LYS   8          1HZ       LYS   8  -5.055   7.247  -9.143
   69   2HZ   LYS   8          2HZ       LYS   8  -3.453   6.718  -9.353
   70   3HZ   LYS   8          3HZ       LYS   8  -4.046   8.008 -10.279
   71    H    THR   9           H        THR   9  -8.719   1.629  -7.621
   72    HA   THR   9           HA       THR   9 -11.166   3.251  -7.974
   73    HB   THR   9           HB       THR   9 -12.173   0.966  -7.395
   74    HG1  THR   9           HG1      THR   9  -9.670  -0.117  -7.898
   75   1HG2  THR   9          1HG2      THR   9 -11.196   1.967  -9.743
   76   2HG2  THR   9          2HG2      THR   9 -10.319   0.442  -9.626
   77   3HG2  THR   9          3HG2      THR   9 -12.082   0.449  -9.605
   78    H    GLY  10           H        GLY  10  -8.989   3.130  -5.580
   79   1HA   GLY  10          1HA       GLY  10  -9.211   3.922  -3.355
   80   2HA   GLY  10          2HA       GLY  10 -10.964   3.827  -3.527
   81    H    CYS  11           H        CYS  11  -9.615   0.954  -4.602
   82    HA   CYS  11           HA       CYS  11 -10.510  -0.461  -2.165
   83   1HB   CYS  11          1HB       CYS  11  -9.318  -1.581  -4.717
   84   2HB   CYS  11          2HB       CYS  11 -10.397  -2.395  -3.585
   85    H    LYS  12           H        LYS  12  -8.923  -2.516  -1.739
   86    HA   LYS  12           HA       LYS  12  -6.276  -1.307  -1.118
   87   1HB   LYS  12          1HB       LYS  12  -6.165  -3.250   0.445
   88   2HB   LYS  12          2HB       LYS  12  -7.583  -2.246   0.715
   89   1HG   LYS  12          1HG       LYS  12  -8.314  -4.167  -1.238
   90   2HG   LYS  12          2HG       LYS  12  -7.459  -5.039   0.032
   91   1HD   LYS  12          1HD       LYS  12  -9.124  -4.721   1.531
   92   2HD   LYS  12          2HD       LYS  12  -9.327  -3.030   1.072
   93   1HE   LYS  12          1HE       LYS  12 -10.539  -3.819  -1.006
   94   2HE   LYS  12          2HE       LYS  12 -10.497  -5.458  -0.327
   95   1HZ   LYS  12          1HZ       LYS  12 -11.328  -3.344   1.485
   96   2HZ   LYS  12          2HZ       LYS  12 -12.421  -3.706   0.236
   97   3HZ   LYS  12          3HZ       LYS  12 -11.927  -4.922   1.316
   98    H    LYS  13           H        LYS  13  -4.658  -3.431  -0.927
   99    HA   LYS  13           HA       LYS  13  -4.801  -4.948  -3.498
  100   1HB   LYS  13          1HB       LYS  13  -3.344  -2.643  -3.189
  101   2HB   LYS  13          2HB       LYS  13  -2.154  -3.867  -2.743
  102   1HG   LYS  13          1HG       LYS  13  -3.832  -4.212  -5.217
  103   2HG   LYS  13          2HG       LYS  13  -2.379  -3.212  -5.258
  104   1HD   LYS  13          1HD       LYS  13  -1.605  -5.537  -3.897
  105   2HD   LYS  13          2HD       LYS  13  -2.608  -6.109  -5.231
  106   1HE   LYS  13          1HE       LYS  13  -0.671  -5.914  -6.444
  107   2HE   LYS  13          2HE       LYS  13  -1.087  -4.188  -6.481
  108   1HZ   LYS  13          1HZ       LYS  13   0.507  -5.525  -4.357
  109   2HZ   LYS  13          2HZ       LYS  13   1.148  -4.547  -5.587
  110   3HZ   LYS  13          3HZ       LYS  13   0.114  -3.872  -4.420
  111    H    THR  14           H        THR  14  -5.262  -6.766  -2.025
  112    HA   THR  14           HA       THR  14  -3.453  -7.514   0.104
  113    HB   THR  14           HB       THR  14  -5.485  -9.087  -1.514
  114    HG1  THR  14           HG1      THR  14  -6.773  -8.594   0.362
  115   1HG2  THR  14          1HG2      THR  14  -3.624  -9.890   0.523
  116   2HG2  THR  14          2HG2      THR  14  -5.264 -10.003   1.161
  117   3HG2  THR  14          3HG2      THR  14  -4.830 -10.868  -0.314
  118    H    CYS  15           H        CYS  15  -1.931  -9.258   0.092
  119    HA   CYS  15           HA       CYS  15  -0.929 -10.042  -2.627
  120   1HB   CYS  15          1HB       CYS  15   1.311 -10.160  -1.333
  121   2HB   CYS  15          2HB       CYS  15   0.665  -8.557  -1.673
  122    H    TYR  16           H        TYR  16   0.253 -12.202  -2.560
  123    HA   TYR  16           HA       TYR  16  -1.137 -14.037  -0.641
  124   1HB   TYR  16          1HB       TYR  16   0.148 -14.588  -3.334
  125   2HB   TYR  16          2HB       TYR  16  -0.883 -15.688  -2.418
  126    HD1  TYR  16           HD1      TYR  16  -0.840 -12.347  -4.082
  127    HD2  TYR  16           HD2      TYR  16  -3.233 -15.602  -2.625
  128    HE1  TYR  16           HE1      TYR  16  -2.848 -11.340  -5.133
  129    HE2  TYR  16           HE2      TYR  16  -5.241 -14.595  -3.675
  130    HH   TYR  16           HH       TYR  16  -6.031 -12.941  -4.914
  131    H    LYS  17           H        LYS  17   1.980 -12.881  -1.647
  132    HA   LYS  17           HA       LYS  17   3.347 -15.146  -0.260
  133   1HB   LYS  17          1HB       LYS  17   4.317 -12.922  -2.083
  134   2HB   LYS  17          2HB       LYS  17   5.340 -14.202  -1.430
  135   1HG   LYS  17          1HG       LYS  17   3.743 -15.868  -2.492
  136   2HG   LYS  17          2HG       LYS  17   3.004 -14.502  -3.329
  137   1HD   LYS  17          1HD       LYS  17   5.602 -14.014  -3.886
  138   2HD   LYS  17          2HD       LYS  17   5.658 -15.771  -3.751
  139   1HE   LYS  17          1HE       LYS  17   3.382 -15.416  -5.254
  140   2HE   LYS  17          2HE       LYS  17   4.420 -14.101  -5.841
  141   1HZ   LYS  17          1HZ       LYS  17   5.324 -16.906  -5.478
  142   2HZ   LYS  17          2HZ       LYS  17   4.844 -16.250  -6.969
  143   3HZ   LYS  17          3HZ       LYS  17   6.210 -15.636  -6.167
  144    H    LEU  18           H        LEU  18   2.921 -14.403   1.932
  145    HA   LEU  18           HA       LEU  18   3.399 -11.789   2.929
  146   1HB   LEU  18          1HB       LEU  18   3.377 -14.591   4.008
  147   2HB   LEU  18          2HB       LEU  18   3.887 -13.275   5.066
  148    HG   LEU  18           HG       LEU  18   1.278 -13.340   3.524
  149   1HD1  LEU  18          1HD1      LEU  18   2.043 -14.129   6.319
  150   2HD1  LEU  18          2HD1      LEU  18   0.450 -13.432   6.026
  151   3HD1  LEU  18          3HD1      LEU  18   0.926 -14.916   5.203
  152   1HD2  LEU  18          1HD2      LEU  18   2.686 -11.339   5.230
  153   2HD2  LEU  18          2HD2      LEU  18   1.604 -11.086   3.861
  154   3HD2  LEU  18          3HD2      LEU  18   0.941 -11.488   5.444
  155    H    GLY  19           H        GLY  19   5.284 -10.893   3.970
  156   1HA   GLY  19          1HA       GLY  19   7.617 -10.916   4.617
  157   2HA   GLY  19          2HA       GLY  19   7.835 -12.379   3.656
  158    H    GLU  20           H        GLU  20   9.735 -11.018   2.852
  159    HA   GLU  20           HA       GLU  20   9.551  -8.671   1.324
  160   1HB   GLU  20          1HB       GLU  20  11.210 -11.184   1.150
  161   2HB   GLU  20          2HB       GLU  20  11.451  -9.875  -0.008
  162   1HG   GLU  20          1HG       GLU  20  11.452  -9.403   2.979
  163   2HG   GLU  20          2HG       GLU  20  12.919  -9.807   2.088
  164    H    ASN  21           H        ASN  21   7.493  -8.697   0.235
  165    HA   ASN  21           HA       ASN  21   7.127 -10.704  -1.930
  166   1HB   ASN  21          1HB       ASN  21   5.349 -10.103  -0.241
  167   2HB   ASN  21          2HB       ASN  21   5.313  -8.485  -0.941
  168   1HD2  ASN  21          2HD2      ASN  21   3.336 -10.923  -0.965
  169   2HD2  ASN  21          1HD2      ASN  21   2.900 -11.040  -2.602
  170    H    ASP  22           H        ASP  22   8.607  -9.938  -3.515
  171    HA   ASP  22           HA       ASP  22   9.289  -7.446  -4.415
  172   1HB   ASP  22          1HB       ASP  22  10.123  -9.313  -5.583
  173   2HB   ASP  22          2HB       ASP  22   8.514  -9.989  -5.835
  174    H    PHE  23           H        PHE  23   6.145  -9.026  -4.958
  175    HA   PHE  23           HA       PHE  23   4.963  -7.206  -6.761
  176   1HB   PHE  23          1HB       PHE  23   4.188  -9.435  -5.490
  177   2HB   PHE  23          2HB       PHE  23   3.397  -8.264  -4.437
  178    HD1  PHE  23           HD1      PHE  23   3.338  -6.327  -7.112
  179    HD2  PHE  23           HD2      PHE  23   1.780 -10.174  -6.000
  180    HE1  PHE  23           HE1      PHE  23   1.518  -6.073  -8.778
  181    HE2  PHE  23           HE2      PHE  23  -0.040  -9.917  -7.665
  182    HZ   PHE  23           HZ       PHE  23  -0.169  -7.868  -9.055
  183    H    CYS  24           H        CYS  24   4.661  -7.128  -3.175
  184    HA   CYS  24           HA       CYS  24   3.528  -4.485  -3.092
  185   1HB   CYS  24          1HB       CYS  24   5.056  -6.165  -1.078
  186   2HB   CYS  24          2HB       CYS  24   4.176  -4.696  -0.669
  187    H    ASN  25           H        ASN  25   6.852  -5.724  -2.764
  188    HA   ASN  25           HA       ASN  25   8.225  -3.366  -2.062
  189   1HB   ASN  25          1HB       ASN  25   8.768  -5.988  -2.944
  190   2HB   ASN  25          2HB       ASN  25   9.610  -4.937  -4.083
  191   1HD2  ASN  25          2HD2      ASN  25   9.543  -6.049  -0.747
  192   2HD2  ASN  25          1HD2      ASN  25  10.947  -5.236  -0.251
  193    H    ARG  26           H        ARG  26   7.353  -4.562  -5.319
  194    HA   ARG  26           HA       ARG  26   8.478  -2.419  -6.829
  195   1HB   ARG  26          1HB       ARG  26   6.868  -4.750  -7.183
  196   2HB   ARG  26          2HB       ARG  26   6.045  -3.416  -7.995
  197   1HG   ARG  26          1HG       ARG  26   8.958  -3.469  -8.427
  198   2HG   ARG  26          2HG       ARG  26   8.108  -4.868  -9.086
  199   1HD   ARG  26          1HD       ARG  26   6.461  -2.761  -9.807
  200   2HD   ARG  26          2HD       ARG  26   8.084  -2.079 -10.007
  201    HE   ARG  26           HE       ARG  26   6.882  -4.048 -11.708
  202   1HH1  ARG  26          1HH1      ARG  26   9.856  -3.435 -10.043
  203   2HH1  ARG  26          2HH1      ARG  26  10.754  -4.570 -10.989
  204   1HH2  ARG  26          1HH2      ARG  26   8.058  -5.492 -12.954
  205   2HH2  ARG  26          2HH2      ARG  26   9.748  -5.713 -12.646
  206    H    GLU  27           H        GLU  27   5.178  -2.881  -5.538
  207    HA   GLU  27           HA       GLU  27   3.945  -0.538  -6.471
  208   1HB   GLU  27          1HB       GLU  27   2.596  -2.101  -5.362
  209   2HB   GLU  27          2HB       GLU  27   3.737  -2.286  -4.032
  210   1HG   GLU  27          1HG       GLU  27   3.006  -0.360  -2.955
  211   2HG   GLU  27          2HG       GLU  27   2.424   0.378  -4.447
  212    H    CYS  28           H        CYS  28   5.801  -0.978  -3.442
  213    HA   CYS  28           HA       CYS  28   5.706   1.876  -2.801
  214   1HB   CYS  28          1HB       CYS  28   6.117  -0.545  -1.480
  215   2HB   CYS  28          2HB       CYS  28   7.701   0.231  -1.435
  216    H    LYS  29           H        LYS  29   7.530   0.055  -4.973
  217    HA   LYS  29           HA       LYS  29  10.024   1.631  -4.626
  218   1HB   LYS  29          1HB       LYS  29  10.251  -0.738  -5.005
  219   2HB   LYS  29          2HB       LYS  29   9.151  -0.679  -6.381
  220   1HG   LYS  29          1HG       LYS  29  10.775   0.024  -7.798
  221   2HG   LYS  29          2HG       LYS  29  11.437   1.157  -6.620
  222   1HD   LYS  29          1HD       LYS  29  11.886  -1.843  -6.633
  223   2HD   LYS  29          2HD       LYS  29  13.066  -0.627  -7.120
  224   1HE   LYS  29          1HE       LYS  29  12.412   0.317  -4.650
  225   2HE   LYS  29          2HE       LYS  29  12.208  -1.427  -4.394
  226   1HZ   LYS  29          1HZ       LYS  29  14.428  -1.351  -5.894
  227   2HZ   LYS  29          2HZ       LYS  29  14.612   0.078  -4.994
  228   3HZ   LYS  29          3HZ       LYS  29  14.436  -1.414  -4.200
  229    H    TRP  30           H        TRP  30   7.120   2.218  -6.033
  230    HA   TRP  30           HA       TRP  30   8.026   3.194  -8.648
  231   1HB   TRP  30          1HB       TRP  30   5.643   3.866  -8.801
  232   2HB   TRP  30          2HB       TRP  30   5.841   2.189  -8.318
  233    HD1  TRP  30           HD1      TRP  30   3.193   3.062  -7.576
  234    HE1  TRP  30           HE1      TRP  30   2.419   3.632  -5.194
  235    HE3  TRP  30           HE3      TRP  30   7.718   4.113  -5.323
  236    HZ2  TRP  30           HZ2      TRP  30   3.519   4.417  -2.700
  237    HZ3  TRP  30           HZ3      TRP  30   7.785   4.764  -2.953
  238    HH2  TRP  30           HH2      TRP  30   5.697   4.919  -1.634
  239    H    LYS  31           H        LYS  31   6.047   5.547  -8.227
  240    HA   LYS  31           HA       LYS  31   7.774   7.699  -8.084
  241   1HB   LYS  31          1HB       LYS  31   5.342   7.773  -8.564
  242   2HB   LYS  31          2HB       LYS  31   5.003   7.477  -6.858
  243   1HG   LYS  31          1HG       LYS  31   5.954   9.569  -6.204
  244   2HG   LYS  31          2HG       LYS  31   6.682   9.814  -7.792
  245   1HD   LYS  31          1HD       LYS  31   4.698  10.476  -8.755
  246   2HD   LYS  31          2HD       LYS  31   3.721   9.470  -7.685
  247   1HE   LYS  31          1HE       LYS  31   3.535  11.118  -6.110
  248   2HE   LYS  31          2HE       LYS  31   5.215  11.644  -6.330
  249   1HZ   LYS  31          1HZ       LYS  31   3.581  12.029  -8.664
  250   2HZ   LYS  31          2HZ       LYS  31   3.039  12.923  -7.328
  251   3HZ   LYS  31          3HZ       LYS  31   4.631  13.115  -7.886
  252    H    HIS  32           H        HIS  32   9.296   8.168  -6.548
  253    HA   HIS  32           HA       HIS  32   9.391   7.090  -3.914
  254   1HB   HIS  32          1HB       HIS  32  10.613   9.476  -5.311
  255   2HB   HIS  32          2HB       HIS  32  11.020   9.083  -3.640
  256    HD1  HIS  32           HD1      HIS  32  10.847   5.915  -4.123
  257    HD2  HIS  32           HD2      HIS  32  13.115   8.620  -6.343
  258    HE1  HIS  32           HE1      HIS  32  12.713   4.576  -5.195
  259    H    ILE  33           H        ILE  33   7.972   7.544  -2.275
  260    HA   ILE  33           HA       ILE  33   6.770  10.292  -2.163
  261    HB   ILE  33           HB       ILE  33   5.773   7.555  -1.318
  262   1HG1  ILE  33          1HG1      ILE  33   4.812   9.586  -3.360
  263   2HG1  ILE  33          2HG1      ILE  33   5.583   8.041  -3.716
  264   1HG2  ILE  33          1HG2      ILE  33   5.226   9.775   0.107
  265   2HG2  ILE  33          2HG2      ILE  33   4.021   9.959  -1.167
  266   3HG2  ILE  33          3HG2      ILE  33   4.028   8.510  -0.164
  267   1HD1  ILE  33          1HD1      ILE  33   3.430   7.491  -1.953
  268   2HD1  ILE  33          2HD1      ILE  33   2.807   8.577  -3.196
  269   3HD1  ILE  33          3HD1      ILE  33   3.565   7.052  -3.656
  270    H    GLY  34           H        GLY  34   8.475   7.776  -0.410
  271   1HA   GLY  34          1HA       GLY  34   9.892   9.057   1.428
  272   2HA   GLY  34          2HA       GLY  34   8.289   9.322   2.119
  273    H    GLY  35           H        GLY  35   7.394   6.647   1.068
  274   1HA   GLY  35          1HA       GLY  35   7.697   5.086   3.366
  275   2HA   GLY  35          2HA       GLY  35   7.377   4.404   1.772
  276    H    SER  36           H        SER  36   9.434   4.073   4.251
  277    HA   SER  36           HA       SER  36  11.985   4.002   2.799
  278   1HB   SER  36          1HB       SER  36  12.697   4.163   4.938
  279   2HB   SER  36          2HB       SER  36  11.024   4.074   5.477
  280    HG   SER  36           HG       SER  36  11.327   2.062   6.028
  281    H    TYR  37           H        TYR  37   9.625   1.643   4.054
  282    HA   TYR  37           HA       TYR  37  10.859  -0.403   2.254
  283   1HB   TYR  37          1HB       TYR  37  11.290  -0.310   4.941
  284   2HB   TYR  37          2HB       TYR  37   9.833  -1.302   4.887
  285    HD1  TYR  37           HD1      TYR  37  13.305  -1.000   3.575
  286    HD2  TYR  37           HD2      TYR  37   9.896  -3.561   4.117
  287    HE1  TYR  37           HE1      TYR  37  14.659  -2.952   2.861
  288    HE2  TYR  37           HE2      TYR  37  11.252  -5.511   3.401
  289    HH   TYR  37           HH       TYR  37  13.543  -6.194   3.225
  290    H    GLY  38           H        GLY  38   9.358  -1.941   1.452
  291   1HA   GLY  38          1HA       GLY  38   6.523  -1.708   2.297
  292   2HA   GLY  38          2HA       GLY  38   6.895  -1.403   0.599
  293    H    TYR  39           H        TYR  39   5.708  -3.755   2.476
  294    HA   TYR  39           HA       TYR  39   6.597  -5.874   0.606
  295   1HB   TYR  39          1HB       TYR  39   7.248  -7.286   2.638
  296   2HB   TYR  39          2HB       TYR  39   8.340  -5.955   2.255
  297    HD1  TYR  39           HD1      TYR  39   7.888  -3.684   3.451
  298    HD2  TYR  39           HD2      TYR  39   6.302  -7.448   4.785
  299    HE1  TYR  39           HE1      TYR  39   7.509  -2.725   5.705
  300    HE2  TYR  39           HE2      TYR  39   5.924  -6.488   7.039
  301    HH   TYR  39           HH       TYR  39   6.406  -3.059   7.681
  302    H    CYS  40           H        CYS  40   5.426  -7.995   1.211
  303    HA   CYS  40           HA       CYS  40   2.591  -7.483   1.483
  304   1HB   CYS  40          1HB       CYS  40   3.572  -9.274   0.115
  305   2HB   CYS  40          2HB       CYS  40   4.256 -10.022   1.558
  306    H    TYR  41           H        TYR  41   2.068  -6.655   3.534
  307    HA   TYR  41           HA       TYR  41   2.843  -8.318   5.909
  308   1HB   TYR  41          1HB       TYR  41   3.524  -5.831   5.579
  309   2HB   TYR  41          2HB       TYR  41   1.832  -5.472   5.917
  310    HD1  TYR  41           HD1      TYR  41   4.442  -7.799   7.311
  311    HD2  TYR  41           HD2      TYR  41   1.408  -4.864   8.113
  312    HE1  TYR  41           HE1      TYR  41   4.878  -8.010   9.744
  313    HE2  TYR  41           HE2      TYR  41   1.847  -5.076  10.544
  314    HH   TYR  41           HH       TYR  41   4.332  -7.322  11.774
  315    H    GLY  42           H        GLY  42   1.141  -9.499   6.737
  316   1HA   GLY  42          1HA       GLY  42  -1.066 -10.161   7.199
  317   2HA   GLY  42          2HA       GLY  42  -1.419  -8.437   7.317
  318    H    PHE  43           H        PHE  43  -0.511 -10.611   4.616
  319    HA   PHE  43           HA       PHE  43  -1.434 -10.753   2.441
  320   1HB   PHE  43          1HB       PHE  43  -3.892 -10.333   4.177
  321   2HB   PHE  43          2HB       PHE  43  -3.912 -11.002   2.545
  322    HD1  PHE  43           HD1      PHE  43  -1.704 -12.822   2.406
  323    HD2  PHE  43           HD2      PHE  43  -4.301 -12.020   5.732
  324    HE1  PHE  43           HE1      PHE  43  -1.223 -15.073   3.326
  325    HE2  PHE  43           HE2      PHE  43  -3.818 -14.270   6.654
  326    HZ   PHE  43           HZ       PHE  43  -2.278 -15.798   5.451
  327    H    GLY  44           H        GLY  44  -0.415  -8.195   2.846
  328   1HA   GLY  44          1HA       GLY  44  -2.002  -6.616   1.025
  329   2HA   GLY  44          2HA       GLY  44  -2.153  -5.997   2.669
  330    H    CYS  45           H        CYS  45  -0.720  -4.998   0.124
  331    HA   CYS  45           HA       CYS  45   2.118  -5.005   0.736
  332   1HB   CYS  45          1HB       CYS  45   0.335  -3.281  -1.013
  333   2HB   CYS  45          2HB       CYS  45   2.094  -3.221  -1.039
  334    H    TYR  46           H        TYR  46   2.197  -4.278   2.967
  335    HA   TYR  46           HA       TYR  46   1.116  -1.625   3.676
  336   1HB   TYR  46          1HB       TYR  46   1.287  -3.802   5.075
  337   2HB   TYR  46          2HB       TYR  46   2.990  -3.393   5.260
  338    HD1  TYR  46           HD1      TYR  46  -0.178  -1.372   5.271
  339    HD2  TYR  46           HD2      TYR  46   3.406  -2.486   7.356
  340    HE1  TYR  46           HE1      TYR  46  -0.761   0.190   7.105
  341    HE2  TYR  46           HE2      TYR  46   2.824  -0.926   9.190
  342    HH   TYR  46           HH       TYR  46   0.925   1.481   9.027
  343    H    CYS  47           H        CYS  47   2.344   0.256   3.773
  344    HA   CYS  47           HA       CYS  47   5.295  -0.004   3.264
  345   1HB   CYS  47          1HB       CYS  47   3.147   1.747   2.094
  346   2HB   CYS  47          2HB       CYS  47   4.807   2.342   2.154
  347    H    GLU  48           H        GLU  48   6.617   1.347   4.529
  348    HA   GLU  48           HA       GLU  48   5.203   2.929   6.650
  349   1HB   GLU  48          1HB       GLU  48   7.930   1.600   6.689
  350   2HB   GLU  48          2HB       GLU  48   7.090   2.312   8.067
  351   1HG   GLU  48          1HG       GLU  48   5.181   0.635   7.457
  352   2HG   GLU  48          2HG       GLU  48   6.444  -0.215   6.566
  353    H    GLY  49           H        GLY  49   5.616   5.107   6.630
  354   1HA   GLY  49          1HA       GLY  49   7.379   6.873   6.620
  355   2HA   GLY  49          2HA       GLY  49   8.094   6.040   5.241
  356    H    LEU  50           H        LEU  50   4.626   6.536   5.644
  357    HA   LEU  50           HA       LEU  50   4.582   8.000   3.067
  358   1HB   LEU  50          1HB       LEU  50   2.244   7.164   4.790
  359   2HB   LEU  50          2HB       LEU  50   2.291   7.366   3.039
  360    HG   LEU  50           HG       LEU  50   4.290   5.468   3.651
  361   1HD1  LEU  50          1HD1      LEU  50   1.972   5.339   5.475
  362   2HD1  LEU  50          2HD1      LEU  50   2.336   3.827   4.643
  363   3HD1  LEU  50          3HD1      LEU  50   3.570   4.608   5.631
  364   1HD2  LEU  50          1HD2      LEU  50   2.710   5.686   1.661
  365   2HD2  LEU  50          2HD2      LEU  50   2.975   4.043   2.247
  366   3HD2  LEU  50          3HD2      LEU  50   1.489   4.898   2.661
  367    HA   PRO  51           HA       PRO  51   4.400  11.808   5.490
  368   1HB   PRO  51          1HB       PRO  51   3.839  13.230   3.058
  369   2HB   PRO  51          2HB       PRO  51   5.367  13.153   3.940
  370   1HG   PRO  51          1HG       PRO  51   4.727  11.932   1.425
  371   2HG   PRO  51          2HG       PRO  51   6.250  11.849   2.315
  372   1HD   PRO  51          1HD       PRO  51   4.289   9.757   1.955
  373   2HD   PRO  51          2HD       PRO  51   5.834   9.669   2.836
  374    H    ASP  52           H        ASP  52   2.678  13.582   5.665
  375    HA   ASP  52           HA       ASP  52   0.042  12.420   5.781
  376   1HB   ASP  52          1HB       ASP  52   1.327  14.422   7.022
  377   2HB   ASP  52          2HB       ASP  52   0.475  15.375   5.806
  378    H    SER  53           H        SER  53   1.777  14.021   3.250
  379    HA   SER  53           HA       SER  53  -0.566  15.044   1.830
  380   1HB   SER  53          1HB       SER  53   2.359  14.614   1.183
  381   2HB   SER  53          2HB       SER  53   1.228  15.301   0.022
  382    HG   SER  53           HG       SER  53   2.446  16.789   1.466
  383    H    THR  54           H        THR  54   0.678  11.943   2.299
  384    HA   THR  54           HA       THR  54  -0.081  10.945  -0.395
  385    HB   THR  54           HB       THR  54   0.859   9.289   1.935
  386    HG1  THR  54           HG1      THR  54   2.565  10.774   0.240
  387   1HG2  THR  54          1HG2      THR  54   0.244   8.309  -0.312
  388   2HG2  THR  54          2HG2      THR  54   1.591   9.217  -0.999
  389   3HG2  THR  54          3HG2      THR  54   1.894   7.971   0.211
  390    H    GLN  55           H        GLN  55  -1.909   9.691  -0.736
  391    HA   GLN  55           HA       GLN  55  -3.883   9.547   1.477
  392   1HB   GLN  55          1HB       GLN  55  -4.032  10.220  -1.163
  393   2HB   GLN  55          2HB       GLN  55  -4.496   8.519  -1.236
  394   1HG   GLN  55          1HG       GLN  55  -5.726  10.286   0.856
  395   2HG   GLN  55          2HG       GLN  55  -6.336  10.354  -0.798
  396   1HE2  GLN  55          2HE2      GLN  55  -6.375   8.503   2.135
  397   2HE2  GLN  55          1HE2      GLN  55  -7.271   7.189   1.542
  398    H    THR  56           H        THR  56  -4.177   7.631   2.578
  399    HA   THR  56           HA       THR  56  -3.289   5.103   1.236
  400    HB   THR  56           HB       THR  56  -2.714   4.615   3.800
  401    HG1  THR  56           HG1      THR  56  -3.382   6.552   4.620
  402   1HG2  THR  56          1HG2      THR  56  -1.202   5.916   1.592
  403   2HG2  THR  56          2HG2      THR  56  -0.443   5.915   3.184
  404   3HG2  THR  56          3HG2      THR  56  -0.891   4.390   2.421
  405    H    TRP  57           H        TRP  57  -4.155   3.155   2.571
  406    HA   TRP  57           HA       TRP  57  -7.068   3.453   2.871
  407   1HB   TRP  57          1HB       TRP  57  -5.444   1.588   1.824
  408   2HB   TRP  57          2HB       TRP  57  -5.556   0.949   3.460
  409    HD1  TRP  57           HD1      TRP  57  -8.059   2.355   0.849
  410    HE1  TRP  57           HE1      TRP  57 -10.155   0.849   0.861
  411    HE3  TRP  57           HE3      TRP  57  -6.728  -0.978   4.483
  412    HZ2  TRP  57           HZ2      TRP  57 -11.134  -1.459   2.237
  413    HZ3  TRP  57           HZ3      TRP  57  -8.259  -2.817   5.123
  414    HH2  TRP  57           HH2      TRP  57 -10.458  -3.063   4.006
  415    HA   PRO  58           HA       PRO  58  -8.720   2.441   3.871
  416   1HB   PRO  58          1HB       PRO  58 -10.386   3.866   5.667
  417   2HB   PRO  58          2HB       PRO  58 -10.231   2.113   5.532
  418   1HG   PRO  58          1HG       PRO  58  -9.298   3.842   7.660
  419   2HG   PRO  58          2HG       PRO  58  -9.284   2.078   7.589
  420   1HD   PRO  58          1HD       PRO  58  -7.044   3.874   7.322
  421   2HD   PRO  58          2HD       PRO  58  -7.034   2.095   7.234
  422    H    LEU  59           H        LEU  59  -9.976   3.965   2.595
  423    HA   LEU  59           HA       LEU  59  -8.778   6.687   2.525
  424   1HB   LEU  59          1HB       LEU  59  -8.936   6.427   0.264
  425   2HB   LEU  59          2HB       LEU  59  -9.126   4.726   0.656
  426    HG   LEU  59           HG       LEU  59 -11.418   6.681   0.313
  427   1HD1  LEU  59          1HD1      LEU  59  -9.795   5.326  -1.613
  428   2HD1  LEU  59          2HD1      LEU  59 -11.391   4.576  -1.617
  429   3HD1  LEU  59          3HD1      LEU  59 -11.231   6.310  -1.898
  430   1HD2  LEU  59          1HD2      LEU  59 -11.580   4.548   1.836
  431   2HD2  LEU  59          2HD2      LEU  59 -12.857   4.863   0.664
  432   3HD2  LEU  59          3HD2      LEU  59 -11.605   3.675   0.304
  433    HA   PRO  60           HA       PRO  60 -12.357   9.040   3.498
  434   1HB   PRO  60          1HB       PRO  60 -13.011   9.878   0.791
  435   2HB   PRO  60          2HB       PRO  60 -12.324  10.830   2.111
  436   1HG   PRO  60          1HG       PRO  60 -10.978   9.895  -0.215
  437   2HG   PRO  60          2HG       PRO  60 -10.264  10.726   1.170
  438   1HD   PRO  60          1HD       PRO  60  -9.941   7.967   0.406
  439   2HD   PRO  60          2HD       PRO  60  -9.229   8.797   1.808
  440    H    ASN  61           H        ASN  61 -14.736   9.536   2.209
  441    HA   ASN  61           HA       ASN  61 -16.263   7.185   2.609
  442   1HB   ASN  61          1HB       ASN  61 -16.783   9.700   0.995
  443   2HB   ASN  61          2HB       ASN  61 -18.031   8.543   1.458
  444   1HD2  ASN  61          2HD2      ASN  61 -17.140   7.931   4.105
  445   2HD2  ASN  61          1HD2      ASN  61 -17.285   9.327   5.058
  446    H    LYS  62           H        LYS  62 -14.532   8.292  -0.230
  447    HA   LYS  62           HA       LYS  62 -15.960   6.767  -2.213
  448   1HB   LYS  62          1HB       LYS  62 -13.830   8.575  -2.058
  449   2HB   LYS  62          2HB       LYS  62 -13.094   7.093  -2.670
  450   1HG   LYS  62          1HG       LYS  62 -13.835   8.158  -4.630
  451   2HG   LYS  62          2HG       LYS  62 -15.137   7.021  -4.283
  452   1HD   LYS  62          1HD       LYS  62 -15.930   9.181  -2.812
  453   2HD   LYS  62          2HD       LYS  62 -15.138   9.972  -4.176
  454   1HE   LYS  62          1HE       LYS  62 -16.519   8.314  -5.649
  455   2HE   LYS  62          2HE       LYS  62 -17.527   8.132  -4.199
  456   1HZ   LYS  62          1HZ       LYS  62 -16.703  10.815  -5.088
  457   2HZ   LYS  62          2HZ       LYS  62 -18.022  10.059  -5.838
  458   3HZ   LYS  62          3HZ       LYS  62 -18.055  10.360  -4.167
  459    H    THR  63           H        THR  63 -15.983   4.919  -0.330
  460    HA   THR  63           HA       THR  63 -13.642   3.226  -0.151
  461    HB   THR  63           HB       THR  63 -16.524   2.454   0.341
  462    HG1  THR  63           HG1      THR  63 -16.569   3.732   2.031
  463   1HG2  THR  63          1HG2      THR  63 -13.881   1.763   1.654
  464   2HG2  THR  63          2HG2      THR  63 -15.456   1.238   2.250
  465   3HG2  THR  63          3HG2      THR  63 -14.884   0.691   0.676
  466    H    CYS  64           H        CYS  64 -13.841   0.844  -0.839
  467    HA   CYS  64           HA       CYS  64 -14.303   0.730  -3.714
  468   1HB   CYS  64          1HB       CYS  64 -12.482  -0.380  -2.289
  469   2HB   CYS  64          2HB       CYS  64 -13.717  -1.536  -1.797
  Start of MODEL   14
    1   1H    LYS   1          1H        LYS   1   7.067   4.251  10.635
    2   2H    LYS   1          2H        LYS   1   7.607   5.257   9.376
    3   3H    LYS   1          3H        LYS   1   7.302   5.907  10.916
    4    HA   LYS   1           HA       LYS   1   4.974   5.634  10.698
    5   1HB   LYS   1          1HB       LYS   1   6.323   6.588   8.151
    6   2HB   LYS   1          2HB       LYS   1   4.659   6.966   8.599
    7   1HG   LYS   1          1HG       LYS   1   5.496   8.008  10.703
    8   2HG   LYS   1          2HG       LYS   1   7.149   7.708  10.165
    9   1HD   LYS   1          1HD       LYS   1   5.130   9.314   8.575
   10   2HD   LYS   1          2HD       LYS   1   6.316  10.035   9.664
   11   1HE   LYS   1          1HE       LYS   1   7.198   8.132   7.489
   12   2HE   LYS   1          2HE       LYS   1   6.961   9.859   7.152
   13   1HZ   LYS   1          1HZ       LYS   1   8.392   9.167   9.598
   14   2HZ   LYS   1          2HZ       LYS   1   9.225   8.917   8.138
   15   3HZ   LYS   1          3HZ       LYS   1   8.637  10.462   8.531
   16    H    ASP   2           H        ASP   2   3.156   4.888   9.268
   17    HA   ASP   2           HA       ASP   2   3.877   2.663   7.411
   18   1HB   ASP   2          1HB       ASP   2   1.921   2.477   9.725
   19   2HB   ASP   2          2HB       ASP   2   2.360   1.173   8.621
   20    H    GLY   3           H        GLY   3   2.000   2.007   6.069
   21   1HA   GLY   3          1HA       GLY   3  -0.435   3.612   6.106
   22   2HA   GLY   3          2HA       GLY   3   0.640   4.029   4.770
   23    H    TYR   4           H        TYR   4  -1.704   3.059   3.931
   24    HA   TYR   4           HA       TYR   4  -1.104   0.205   3.215
   25   1HB   TYR   4          1HB       TYR   4  -3.303   1.364   4.632
   26   2HB   TYR   4          2HB       TYR   4  -3.903   0.780   3.080
   27    HD1  TYR   4           HD1      TYR   4  -2.728  -1.587   2.372
   28    HD2  TYR   4           HD2      TYR   4  -3.383  -0.175   6.377
   29    HE1  TYR   4           HE1      TYR   4  -2.639  -3.920   3.210
   30    HE2  TYR   4           HE2      TYR   4  -3.294  -2.508   7.213
   31    HH   TYR   4           HH       TYR   4  -3.664  -5.135   5.373
   32    H    LEU   5           H        LEU   5  -0.620   0.175   1.065
   33    HA   LEU   5           HA       LEU   5  -0.937   2.164  -0.845
   34   1HB   LEU   5          1HB       LEU   5  -0.487  -0.705  -0.718
   35   2HB   LEU   5          2HB       LEU   5  -1.387  -0.273  -2.172
   36    HG   LEU   5           HG       LEU   5   1.154   1.121  -1.289
   37   1HD1  LEU   5          1HD1      LEU   5   0.660  -1.300  -2.981
   38   2HD1  LEU   5          2HD1      LEU   5   1.937  -0.186  -3.467
   39   3HD1  LEU   5          3HD1      LEU   5   1.996  -0.957  -1.882
   40   1HD2  LEU   5          1HD2      LEU   5  -0.876   1.709  -3.219
   41   2HD2  LEU   5          2HD2      LEU   5   0.627   2.583  -2.920
   42   3HD2  LEU   5          3HD2      LEU   5   0.591   1.263  -4.090
   43    H    VAL   6           H        VAL   6  -2.561   2.619  -2.439
   44    HA   VAL   6           HA       VAL   6  -5.293   1.561  -1.777
   45    HB   VAL   6           HB       VAL   6  -6.094   3.801  -2.403
   46   1HG1  VAL   6          1HG1      VAL   6  -4.464   3.181  -0.165
   47   2HG1  VAL   6          2HG1      VAL   6  -4.025   4.810  -0.677
   48   3HG1  VAL   6          3HG1      VAL   6  -5.701   4.432  -0.282
   49   1HG2  VAL   6          1HG2      VAL   6  -3.355   3.981  -3.460
   50   2HG2  VAL   6          2HG2      VAL   6  -4.803   4.871  -3.932
   51   3HG2  VAL   6          3HG2      VAL   6  -3.851   5.407  -2.548
   52    H    GLU   7           H        GLU   7  -6.735   2.340  -3.872
   53    HA   GLU   7           HA       GLU   7  -5.284   1.334  -6.299
   54   1HB   GLU   7          1HB       GLU   7  -8.084   0.799  -5.257
   55   2HB   GLU   7          2HB       GLU   7  -7.533   0.310  -6.861
   56   1HG   GLU   7          1HG       GLU   7  -5.696  -0.457  -4.694
   57   2HG   GLU   7          2HG       GLU   7  -7.282  -1.221  -4.586
   58    H    LYS   8           H        LYS   8  -7.063   1.863  -8.257
   59    HA   LYS   8           HA       LYS   8  -6.954   4.706  -8.587
   60   1HB   LYS   8          1HB       LYS   8  -8.012   4.235 -10.666
   61   2HB   LYS   8          2HB       LYS   8  -7.080   2.784 -10.301
   62   1HG   LYS   8          1HG       LYS   8  -9.061   1.656  -9.463
   63   2HG   LYS   8          2HG       LYS   8 -10.013   3.132  -9.630
   64   1HD   LYS   8          1HD       LYS   8  -9.478   3.089 -12.102
   65   2HD   LYS   8          2HD       LYS   8  -8.784   1.486 -11.855
   66   1HE   LYS   8          1HE       LYS   8 -11.164   1.096 -10.641
   67   2HE   LYS   8          2HE       LYS   8 -11.642   2.329 -11.824
   68   1HZ   LYS   8          1HZ       LYS   8  -9.909   0.077 -12.618
   69   2HZ   LYS   8          2HZ       LYS   8 -11.597  -0.117 -12.574
   70   3HZ   LYS   8          3HZ       LYS   8 -10.900   1.051 -13.591
   71    H    THR   9           H        THR   9  -9.528   2.537  -7.459
   72    HA   THR   9           HA       THR   9 -11.442   4.786  -7.244
   73    HB   THR   9           HB       THR   9 -13.001   2.978  -6.747
   74    HG1  THR   9           HG1      THR   9 -10.980   1.072  -6.924
   75   1HG2  THR   9          1HG2      THR   9 -12.069   3.336  -9.121
   76   2HG2  THR   9          2HG2      THR   9 -11.119   1.878  -8.829
   77   3HG2  THR   9          3HG2      THR   9 -12.880   1.803  -8.799
   78    H    GLY  10           H        GLY  10  -8.904   3.880  -5.413
   79   1HA   GLY  10          1HA       GLY  10  -8.435   4.647  -3.192
   80   2HA   GLY  10          2HA       GLY  10 -10.160   4.858  -2.918
   81    H    CYS  11           H        CYS  11 -10.397   2.019  -4.208
   82    HA   CYS  11           HA       CYS  11 -10.842   0.491  -1.903
   83   1HB   CYS  11          1HB       CYS  11 -10.159  -0.044  -4.769
   84   2HB   CYS  11          2HB       CYS  11 -10.127  -1.406  -3.653
   85    H    LYS  12           H        LYS  12  -9.502  -0.903  -0.639
   86    HA   LYS  12           HA       LYS  12  -6.706  -0.213  -0.425
   87   1HB   LYS  12          1HB       LYS  12  -6.723  -2.027   1.242
   88   2HB   LYS  12          2HB       LYS  12  -8.144  -1.006   1.430
   89   1HG   LYS  12          1HG       LYS  12  -9.573  -2.611   0.452
   90   2HG   LYS  12          2HG       LYS  12  -8.227  -3.487  -0.281
   91   1HD   LYS  12          1HD       LYS  12  -7.422  -4.013   2.064
   92   2HD   LYS  12          2HD       LYS  12  -8.945  -3.351   2.659
   93   1HE   LYS  12          1HE       LYS  12  -9.527  -5.190   0.526
   94   2HE   LYS  12          2HE       LYS  12  -8.477  -5.992   1.711
   95   1HZ   LYS  12          1HZ       LYS  12 -10.702  -4.283   2.614
   96   2HZ   LYS  12          2HZ       LYS  12 -11.004  -5.894   2.165
   97   3HZ   LYS  12          3HZ       LYS  12  -9.929  -5.550   3.435
   98    H    LYS  13           H        LYS  13  -5.412  -2.640  -0.143
   99    HA   LYS  13           HA       LYS  13  -5.672  -3.980  -2.808
  100   1HB   LYS  13          1HB       LYS  13  -3.348  -2.516  -1.583
  101   2HB   LYS  13          2HB       LYS  13  -3.047  -3.839  -2.711
  102   1HG   LYS  13          1HG       LYS  13  -5.111  -2.197  -3.814
  103   2HG   LYS  13          2HG       LYS  13  -3.785  -1.145  -3.315
  104   1HD   LYS  13          1HD       LYS  13  -2.367  -3.136  -4.468
  105   2HD   LYS  13          2HD       LYS  13  -3.849  -3.238  -5.421
  106   1HE   LYS  13          1HE       LYS  13  -2.136  -1.653  -6.391
  107   2HE   LYS  13          2HE       LYS  13  -3.680  -0.864  -6.009
  108   1HZ   LYS  13          1HZ       LYS  13  -1.794  -1.052  -3.815
  109   2HZ   LYS  13          2HZ       LYS  13  -1.320  -0.019  -5.074
  110   3HZ   LYS  13          3HZ       LYS  13  -2.797   0.239  -4.275
  111    H    THR  14           H        THR  14  -5.721  -6.162  -2.506
  112    HA   THR  14           HA       THR  14  -4.766  -7.300   0.074
  113    HB   THR  14           HB       THR  14  -6.408  -8.376  -2.244
  114    HG1  THR  14           HG1      THR  14  -6.944  -7.125   0.178
  115   1HG2  THR  14          1HG2      THR  14  -4.987  -9.789  -0.237
  116   2HG2  THR  14          2HG2      THR  14  -6.692  -9.851   0.205
  117   3HG2  THR  14          3HG2      THR  14  -6.170 -10.433  -1.375
  118    H    CYS  15           H        CYS  15  -3.207  -9.005   0.105
  119    HA   CYS  15           HA       CYS  15  -1.854  -9.634  -2.489
  120   1HB   CYS  15          1HB       CYS  15   0.315  -9.324  -1.204
  121   2HB   CYS  15          2HB       CYS  15  -0.597  -7.840  -1.478
  122    H    TYR  16           H        TYR  16  -1.649 -11.827  -2.676
  123    HA   TYR  16           HA       TYR  16  -2.235 -13.588  -0.411
  124   1HB   TYR  16          1HB       TYR  16  -1.955 -13.681  -3.325
  125   2HB   TYR  16          2HB       TYR  16  -1.269 -15.103  -2.539
  126    HD1  TYR  16           HD1      TYR  16  -2.905 -15.613  -0.247
  127    HD2  TYR  16           HD2      TYR  16  -4.098 -14.166  -4.112
  128    HE1  TYR  16           HE1      TYR  16  -5.185 -16.513   0.120
  129    HE2  TYR  16           HE2      TYR  16  -6.378 -15.068  -3.744
  130    HH   TYR  16           HH       TYR  16  -7.251 -17.206  -2.013
  131    H    LYS  17           H        LYS  17   0.613 -12.261  -1.911
  132    HA   LYS  17           HA       LYS  17   2.475 -14.305  -0.973
  133   1HB   LYS  17          1HB       LYS  17   2.496 -11.669  -2.350
  134   2HB   LYS  17          2HB       LYS  17   3.976 -12.109  -1.498
  135   1HG   LYS  17          1HG       LYS  17   3.496 -14.449  -2.734
  136   2HG   LYS  17          2HG       LYS  17   2.724 -13.363  -3.890
  137   1HD   LYS  17          1HD       LYS  17   4.749 -12.101  -4.181
  138   2HD   LYS  17          2HD       LYS  17   5.528 -12.933  -2.836
  139   1HE   LYS  17          1HE       LYS  17   6.024 -14.779  -4.100
  140   2HE   LYS  17          2HE       LYS  17   4.499 -14.688  -5.004
  141   1HZ   LYS  17          1HZ       LYS  17   6.760 -12.782  -5.303
  142   2HZ   LYS  17          2HZ       LYS  17   6.438 -14.066  -6.368
  143   3HZ   LYS  17          3HZ       LYS  17   5.325 -12.792  -6.208
  144    H    LEU  18           H        LEU  18   1.348 -14.066   1.319
  145    HA   LEU  18           HA       LEU  18   1.669 -11.875   3.029
  146   1HB   LEU  18          1HB       LEU  18   1.737 -14.867   3.372
  147   2HB   LEU  18          2HB       LEU  18   1.944 -13.812   4.770
  148    HG   LEU  18           HG       LEU  18  -0.419 -13.870   2.872
  149   1HD1  LEU  18          1HD1      LEU  18   0.156 -14.892   5.605
  150   2HD1  LEU  18          2HD1      LEU  18  -1.423 -14.144   5.366
  151   3HD1  LEU  18          3HD1      LEU  18  -0.941 -15.521   4.375
  152   1HD2  LEU  18          1HD2      LEU  18   0.526 -11.853   4.859
  153   2HD2  LEU  18          2HD2      LEU  18  -0.395 -11.620   3.373
  154   3HD2  LEU  18          3HD2      LEU  18  -1.201 -12.206   4.828
  155    H    GLY  19           H        GLY  19   3.398 -10.893   3.977
  156   1HA   GLY  19          1HA       GLY  19   5.608 -10.415   4.571
  157   2HA   GLY  19          2HA       GLY  19   5.809 -12.149   4.793
  158    H    GLU  20           H        GLU  20   7.869 -10.606   3.818
  159    HA   GLU  20           HA       GLU  20   9.307 -10.283   1.955
  160   1HB   GLU  20          1HB       GLU  20   8.658 -12.978   2.596
  161   2HB   GLU  20          2HB       GLU  20   8.818 -12.886   0.841
  162   1HG   GLU  20          1HG       GLU  20  10.938 -11.350   1.701
  163   2HG   GLU  20          2HG       GLU  20  10.876 -12.622   2.922
  164    H    ASN  21           H        ASN  21   6.855  -9.109   1.279
  165    HA   ASN  21           HA       ASN  21   6.058 -10.187  -1.366
  166   1HB   ASN  21          1HB       ASN  21   4.491  -9.310   0.446
  167   2HB   ASN  21          2HB       ASN  21   5.111  -7.699   0.080
  168   1HD2  ASN  21          2HD2      ASN  21   2.883 -10.150  -0.947
  169   2HD2  ASN  21          1HD2      ASN  21   2.378  -9.390  -2.378
  170    H    ASP  22           H        ASP  22   8.140  -9.728  -2.435
  171    HA   ASP  22           HA       ASP  22   9.378  -7.161  -2.547
  172   1HB   ASP  22          1HB       ASP  22   9.258  -9.407  -4.590
  173   2HB   ASP  22          2HB       ASP  22  10.481  -8.139  -4.530
  174    H    PHE  23           H        PHE  23   6.770  -8.606  -4.479
  175    HA   PHE  23           HA       PHE  23   6.528  -6.952  -6.666
  176   1HB   PHE  23          1HB       PHE  23   5.017  -8.829  -5.563
  177   2HB   PHE  23          2HB       PHE  23   4.111  -7.441  -4.960
  178    HD1  PHE  23           HD1      PHE  23   5.856  -8.294  -8.177
  179    HD2  PHE  23           HD2      PHE  23   2.262  -6.924  -6.266
  180    HE1  PHE  23           HE1      PHE  23   4.780  -8.026 -10.395
  181    HE2  PHE  23           HE2      PHE  23   1.184  -6.657  -8.484
  182    HZ   PHE  23           HZ       PHE  23   2.444  -7.207 -10.548
  183    H    CYS  24           H        CYS  24   4.817  -6.177  -3.605
  184    HA   CYS  24           HA       CYS  24   4.164  -3.500  -4.308
  185   1HB   CYS  24          1HB       CYS  24   3.894  -5.308  -2.142
  186   2HB   CYS  24          2HB       CYS  24   4.595  -3.833  -1.476
  187    H    ASN  25           H        ASN  25   7.009  -4.815  -2.593
  188    HA   ASN  25           HA       ASN  25   8.253  -2.495  -1.684
  189   1HB   ASN  25          1HB       ASN  25   8.955  -4.971  -1.596
  190   2HB   ASN  25          2HB       ASN  25   9.697  -4.696  -3.173
  191   1HD2  ASN  25          2HD2      ASN  25  11.151  -5.291  -0.670
  192   2HD2  ASN  25          1HD2      ASN  25  12.151  -3.954  -0.364
  193    H    ARG  26           H        ARG  26   8.339  -3.814  -5.004
  194    HA   ARG  26           HA       ARG  26  10.027  -1.677  -6.030
  195   1HB   ARG  26          1HB       ARG  26   9.891  -3.961  -6.974
  196   2HB   ARG  26          2HB       ARG  26   8.198  -3.686  -7.388
  197   1HG   ARG  26          1HG       ARG  26  10.123  -1.648  -8.362
  198   2HG   ARG  26          2HG       ARG  26  10.225  -3.236  -9.124
  199   1HD   ARG  26          1HD       ARG  26   7.493  -2.776  -9.022
  200   2HD   ARG  26          2HD       ARG  26   8.152  -1.176  -9.401
  201    HE   ARG  26           HE       ARG  26   8.051  -3.405 -11.197
  202   1HH1  ARG  26          1HH1      ARG  26  10.274  -0.993 -10.084
  203   2HH1  ARG  26          2HH1      ARG  26  11.347  -1.199 -11.424
  204   1HH2  ARG  26          1HH2      ARG  26   9.423  -3.644 -12.945
  205   2HH2  ARG  26          2HH2      ARG  26  10.864  -2.688 -13.045
  206    H    GLU  27           H        GLU  27   6.534  -2.293  -5.880
  207    HA   GLU  27           HA       GLU  27   5.779  -0.079  -7.596
  208   1HB   GLU  27          1HB       GLU  27   4.599  -2.255  -6.140
  209   2HB   GLU  27          2HB       GLU  27   3.722  -0.776  -5.749
  210   1HG   GLU  27          1HG       GLU  27   2.667  -1.672  -7.701
  211   2HG   GLU  27          2HG       GLU  27   3.644  -0.311  -8.253
  212    H    CYS  28           H        CYS  28   6.227  -0.484  -4.096
  213    HA   CYS  28           HA       CYS  28   5.176   2.164  -3.435
  214   1HB   CYS  28          1HB       CYS  28   5.724  -0.235  -2.142
  215   2HB   CYS  28          2HB       CYS  28   6.961   0.852  -1.515
  216    H    LYS  29           H        LYS  29   8.360   0.740  -4.041
  217    HA   LYS  29           HA       LYS  29   9.801   3.168  -3.211
  218   1HB   LYS  29          1HB       LYS  29  10.393   0.545  -3.246
  219   2HB   LYS  29          2HB       LYS  29  11.049   0.989  -4.822
  220   1HG   LYS  29          1HG       LYS  29  11.960   3.038  -3.225
  221   2HG   LYS  29          2HG       LYS  29  12.031   1.657  -2.130
  222   1HD   LYS  29          1HD       LYS  29  13.123   1.499  -4.941
  223   2HD   LYS  29          2HD       LYS  29  14.105   2.095  -3.602
  224   1HE   LYS  29          1HE       LYS  29  12.782  -0.339  -2.791
  225   2HE   LYS  29          2HE       LYS  29  13.662  -0.613  -4.308
  226   1HZ   LYS  29          1HZ       LYS  29  15.436   0.870  -3.104
  227   2HZ   LYS  29          2HZ       LYS  29  14.683   0.278  -1.705
  228   3HZ   LYS  29          3HZ       LYS  29  15.369  -0.804  -2.820
  229    H    TRP  30           H        TRP  30   7.838   2.836  -5.695
  230    HA   TRP  30           HA       TRP  30   9.314   3.256  -8.089
  231   1HB   TRP  30          1HB       TRP  30   6.594   3.596  -7.033
  232   2HB   TRP  30          2HB       TRP  30   6.979   4.728  -8.330
  233    HD1  TRP  30           HD1      TRP  30   5.158   1.858  -8.274
  234    HE1  TRP  30           HE1      TRP  30   5.565   0.258 -10.256
  235    HE3  TRP  30           HE3      TRP  30   9.663   3.615  -9.919
  236    HZ2  TRP  30           HZ2      TRP  30   7.538  -0.214 -12.268
  237    HZ3  TRP  30           HZ3      TRP  30  10.784   2.571 -11.868
  238    HH2  TRP  30           HH2      TRP  30   9.727   0.661 -13.045
  239    H    LYS  31           H        LYS  31   9.479   5.392  -9.269
  240    HA   LYS  31           HA       LYS  31  10.704   7.415  -7.548
  241   1HB   LYS  31          1HB       LYS  31  11.690   6.936  -9.682
  242   2HB   LYS  31          2HB       LYS  31  10.143   7.126 -10.509
  243   1HG   LYS  31          1HG       LYS  31  10.623   9.299 -10.837
  244   2HG   LYS  31          2HG       LYS  31  10.603   9.539  -9.089
  245   1HD   LYS  31          1HD       LYS  31  13.007   8.700  -9.066
  246   2HD   LYS  31          2HD       LYS  31  12.975   8.820 -10.826
  247   1HE   LYS  31          1HE       LYS  31  12.223  11.253 -10.514
  248   2HE   LYS  31          2HE       LYS  31  12.678  11.061  -8.809
  249   1HZ   LYS  31          1HZ       LYS  31  14.797   9.990  -9.892
  250   2HZ   LYS  31          2HZ       LYS  31  14.373  10.987 -11.200
  251   3HZ   LYS  31          3HZ       LYS  31  14.684  11.672  -9.680
  252    H    HIS  32           H        HIS  32   8.726   7.997  -6.293
  253    HA   HIS  32           HA       HIS  32   7.123  10.056  -7.744
  254   1HB   HIS  32          1HB       HIS  32   6.056   7.687  -7.537
  255   2HB   HIS  32          2HB       HIS  32   5.858   8.095  -5.832
  256    HD1  HIS  32           HD1      HIS  32   4.941   9.444  -9.270
  257    HD2  HIS  32           HD2      HIS  32   3.687   9.761  -5.306
  258    HE1  HIS  32           HE1      HIS  32   2.816  10.821  -9.298
  259    H    ILE  33           H        ILE  33   7.319   8.531  -4.500
  260    HA   ILE  33           HA       ILE  33   7.612  11.289  -3.348
  261    HB   ILE  33           HB       ILE  33   6.356   8.914  -1.964
  262   1HG1  ILE  33          1HG1      ILE  33   5.216   9.275  -4.160
  263   2HG1  ILE  33          2HG1      ILE  33   4.173   9.646  -2.787
  264   1HG2  ILE  33          1HG2      ILE  33   6.635  11.829  -1.524
  265   2HG2  ILE  33          2HG2      ILE  33   5.039  11.165  -1.172
  266   3HG2  ILE  33          3HG2      ILE  33   6.462  10.524  -0.350
  267   1HD1  ILE  33          1HD1      ILE  33   5.047  12.074  -3.053
  268   2HD1  ILE  33          2HD1      ILE  33   5.568  11.554  -4.655
  269   3HD1  ILE  33          3HD1      ILE  33   3.860  11.490  -4.220
  270    H    GLY  34           H        GLY  34   7.955   7.930  -2.135
  271   1HA   GLY  34          1HA       GLY  34  10.658   7.585  -1.983
  272   2HA   GLY  34          2HA       GLY  34  10.367   8.709  -0.656
  273    H    GLY  35           H        GLY  35   9.764   5.453  -1.829
  274   1HA   GLY  35          1HA       GLY  35   8.466   4.739   0.751
  275   2HA   GLY  35          2HA       GLY  35   8.516   3.715  -0.686
  276    H    SER  36           H        SER  36   9.630   3.710   2.321
  277    HA   SER  36           HA       SER  36  12.451   3.002   1.739
  278   1HB   SER  36          1HB       SER  36  11.973   2.575   4.419
  279   2HB   SER  36          2HB       SER  36  12.495   4.108   3.727
  280    HG   SER  36           HG       SER  36  10.448   3.953   5.080
  281    H    TYR  37           H        TYR  37   9.598   1.464   3.295
  282    HA   TYR  37           HA       TYR  37  10.649  -1.177   2.361
  283   1HB   TYR  37          1HB       TYR  37  11.157  -0.419   4.824
  284   2HB   TYR  37          2HB       TYR  37   9.459  -0.805   5.102
  285    HD1  TYR  37           HD1      TYR  37   8.617  -3.109   4.782
  286    HD2  TYR  37           HD2      TYR  37  12.783  -2.152   4.362
  287    HE1  TYR  37           HE1      TYR  37   9.183  -5.520   4.914
  288    HE2  TYR  37           HE2      TYR  37  13.350  -4.563   4.494
  289    HH   TYR  37           HH       TYR  37  11.219  -6.977   4.030
  290    H    GLY  38           H        GLY  38   8.947  -2.804   2.155
  291   1HA   GLY  38          1HA       GLY  38   6.186  -2.167   2.751
  292   2HA   GLY  38          2HA       GLY  38   6.536  -1.964   1.035
  293    H    TYR  39           H        TYR  39   5.432  -4.146   3.256
  294    HA   TYR  39           HA       TYR  39   6.087  -6.446   1.453
  295   1HB   TYR  39          1HB       TYR  39   6.590  -7.795   3.372
  296   2HB   TYR  39          2HB       TYR  39   7.454  -6.277   3.617
  297    HD1  TYR  39           HD1      TYR  39   6.281  -4.444   5.001
  298    HD2  TYR  39           HD2      TYR  39   5.034  -8.555   4.974
  299    HE1  TYR  39           HE1      TYR  39   5.066  -4.090   7.131
  300    HE2  TYR  39           HE2      TYR  39   3.815  -8.199   7.104
  301    HH   TYR  39           HH       TYR  39   4.110  -5.197   8.907
  302    H    CYS  40           H        CYS  40   4.479  -8.323   2.007
  303    HA   CYS  40           HA       CYS  40   1.758  -7.187   2.007
  304   1HB   CYS  40          1HB       CYS  40   2.342  -8.877   0.386
  305   2HB   CYS  40          2HB       CYS  40   2.950  -9.948   1.646
  306    H    TYR  41           H        TYR  41   0.356  -7.294   3.738
  307    HA   TYR  41           HA       TYR  41   1.009  -9.138   5.995
  308   1HB   TYR  41          1HB       TYR  41   1.992  -6.921   6.458
  309   2HB   TYR  41          2HB       TYR  41   0.423  -6.164   6.178
  310    HD1  TYR  41           HD1      TYR  41   1.140  -9.387   7.907
  311    HD2  TYR  41           HD2      TYR  41  -0.158  -5.312   8.318
  312    HE1  TYR  41           HE1      TYR  41   0.485  -9.833  10.256
  313    HE2  TYR  41           HE2      TYR  41  -0.810  -5.759  10.669
  314    HH   TYR  41           HH       TYR  41  -1.496  -8.331  11.925
  315    H    GLY  42           H        GLY  42  -0.842  -9.870   7.104
  316   1HA   GLY  42          1HA       GLY  42  -3.103 -10.552   7.154
  317   2HA   GLY  42          2HA       GLY  42  -3.377  -8.816   7.297
  318    H    PHE  43           H        PHE  43  -2.090 -10.595   4.501
  319    HA   PHE  43           HA       PHE  43  -2.904 -10.742   2.288
  320   1HB   PHE  43          1HB       PHE  43  -5.595 -10.234   3.577
  321   2HB   PHE  43          2HB       PHE  43  -5.250 -11.192   2.136
  322    HD1  PHE  43           HD1      PHE  43  -3.256 -13.033   2.661
  323    HD2  PHE  43           HD2      PHE  43  -6.129 -11.492   5.458
  324    HE1  PHE  43           HE1      PHE  43  -2.972 -15.055   4.066
  325    HE2  PHE  43           HE2      PHE  43  -5.843 -13.514   6.865
  326    HZ   PHE  43           HZ       PHE  43  -4.264 -15.296   6.170
  327    H    GLY  44           H        GLY  44  -1.965  -8.176   3.079
  328   1HA   GLY  44          1HA       GLY  44  -3.460  -6.513   1.182
  329   2HA   GLY  44          2HA       GLY  44  -3.498  -5.927   2.845
  330    H    CYS  45           H        CYS  45  -2.062  -5.078   0.197
  331    HA   CYS  45           HA       CYS  45   0.771  -5.271   0.710
  332   1HB   CYS  45          1HB       CYS  45  -1.079  -4.144  -1.197
  333   2HB   CYS  45          2HB       CYS  45   0.148  -2.944  -0.793
  334    H    TYR  46           H        TYR  46   1.787  -4.279   2.410
  335    HA   TYR  46           HA       TYR  46   0.690  -1.656   3.369
  336   1HB   TYR  46          1HB       TYR  46   0.527  -3.859   4.755
  337   2HB   TYR  46          2HB       TYR  46   2.254  -3.629   5.024
  338    HD1  TYR  46           HD1      TYR  46  -0.893  -1.575   5.046
  339    HD2  TYR  46           HD2      TYR  46   2.871  -2.441   6.926
  340    HE1  TYR  46           HE1      TYR  46  -1.392   0.093   6.811
  341    HE2  TYR  46           HE2      TYR  46   2.371  -0.772   8.693
  342    HH   TYR  46           HH       TYR  46  -0.258   1.444   8.436
  343    H    CYS  47           H        CYS  47   2.164   0.024   3.507
  344    HA   CYS  47           HA       CYS  47   5.048  -0.627   2.970
  345   1HB   CYS  47          1HB       CYS  47   3.173   1.543   2.046
  346   2HB   CYS  47          2HB       CYS  47   4.912   1.839   2.071
  347    H    GLU  48           H        GLU  48   6.591   0.526   4.238
  348    HA   GLU  48           HA       GLU  48   5.439   2.066   6.544
  349   1HB   GLU  48          1HB       GLU  48   7.762   0.122   6.364
  350   2HB   GLU  48          2HB       GLU  48   7.383   1.070   7.803
  351   1HG   GLU  48          1HG       GLU  48   5.776  -0.387   8.402
  352   2HG   GLU  48          2HG       GLU  48   4.998  -0.235   6.826
  353    H    GLY  49           H        GLY  49   6.100   4.172   6.499
  354   1HA   GLY  49          1HA       GLY  49   8.159   5.622   6.691
  355   2HA   GLY  49          2HA       GLY  49   8.761   4.771   5.268
  356    H    LEU  50           H        LEU  50   5.378   5.580   5.455
  357    HA   LEU  50           HA       LEU  50   5.668   7.313   3.088
  358   1HB   LEU  50          1HB       LEU  50   3.155   6.599   4.607
  359   2HB   LEU  50          2HB       LEU  50   3.311   7.004   2.902
  360    HG   LEU  50           HG       LEU  50   3.169   4.728   2.697
  361   1HD1  LEU  50          1HD1      LEU  50   5.690   5.631   2.310
  362   2HD1  LEU  50          2HD1      LEU  50   5.991   4.376   3.510
  363   3HD1  LEU  50          3HD1      LEU  50   5.197   3.969   1.990
  364   1HD2  LEU  50          1HD2      LEU  50   3.314   4.762   5.431
  365   2HD2  LEU  50          2HD2      LEU  50   3.177   3.301   4.451
  366   3HD2  LEU  50          3HD2      LEU  50   4.761   3.849   5.002
  367    HA   PRO  51           HA       PRO  51   5.838  10.812   5.965
  368   1HB   PRO  51          1HB       PRO  51   5.789  12.526   3.651
  369   2HB   PRO  51          2HB       PRO  51   7.158  12.159   4.706
  370   1HG   PRO  51          1HG       PRO  51   6.729  11.269   2.016
  371   2HG   PRO  51          2HG       PRO  51   8.081  10.881   3.082
  372   1HD   PRO  51          1HD       PRO  51   5.939   9.142   2.237
  373   2HD   PRO  51          2HD       PRO  51   7.303   8.753   3.312
  374    H    ASP  52           H        ASP  52   4.450  12.930   6.001
  375    HA   ASP  52           HA       ASP  52   1.656  12.212   5.842
  376   1HB   ASP  52          1HB       ASP  52   3.003  14.913   6.169
  377   2HB   ASP  52          2HB       ASP  52   1.365  14.495   6.671
  378    H    SER  53           H        SER  53   3.877  13.476   3.531
  379    HA   SER  53           HA       SER  53   1.849  14.913   1.947
  380   1HB   SER  53          1HB       SER  53   4.785  14.383   1.900
  381   2HB   SER  53          2HB       SER  53   4.018  14.787   0.367
  382    HG   SER  53           HG       SER  53   3.347  16.320   2.596
  383    H    THR  54           H        THR  54   2.776  11.672   2.326
  384    HA   THR  54           HA       THR  54   2.297  10.887  -0.484
  385    HB   THR  54           HB       THR  54   2.486   8.906   1.728
  386    HG1  THR  54           HG1      THR  54   4.603  10.648   1.003
  387   1HG2  THR  54          1HG2      THR  54   2.595   8.530  -0.831
  388   2HG2  THR  54          2HG2      THR  54   4.227   9.189  -0.715
  389   3HG2  THR  54          3HG2      THR  54   3.803   7.724   0.171
  390    H    GLN  55           H        GLN  55   0.595   9.282  -0.991
  391    HA   GLN  55           HA       GLN  55  -1.891   9.813   0.559
  392   1HB   GLN  55          1HB       GLN  55  -1.741  10.189  -1.906
  393   2HB   GLN  55          2HB       GLN  55  -1.409   8.470  -2.120
  394   1HG   GLN  55          1HG       GLN  55  -3.660   8.262  -2.312
  395   2HG   GLN  55          2HG       GLN  55  -3.666   8.415  -0.554
  396   1HE2  GLN  55          2HE2      GLN  55  -5.958   9.348  -1.346
  397   2HE2  GLN  55          1HE2      GLN  55  -6.001  11.030  -1.564
  398    H    THR  56           H        THR  56  -3.229   8.029   1.264
  399    HA   THR  56           HA       THR  56  -2.195   5.276   1.022
  400    HB   THR  56           HB       THR  56  -0.883   6.410   2.834
  401    HG1  THR  56           HG1      THR  56  -0.974   4.684   4.062
  402   1HG2  THR  56          1HG2      THR  56  -3.324   7.552   3.466
  403   2HG2  THR  56          2HG2      THR  56  -3.096   6.359   4.744
  404   3HG2  THR  56          3HG2      THR  56  -1.877   7.604   4.473
  405    H    TRP  57           H        TRP  57  -3.663   3.753   2.269
  406    HA   TRP  57           HA       TRP  57  -6.484   4.460   1.808
  407   1HB   TRP  57          1HB       TRP  57  -5.116   2.277   1.336
  408   2HB   TRP  57          2HB       TRP  57  -5.369   1.941   3.046
  409    HD1  TRP  57           HD1      TRP  57  -7.209   2.218  -0.270
  410    HE1  TRP  57           HE1      TRP  57  -9.574   1.227   0.001
  411    HE3  TRP  57           HE3      TRP  57  -7.286   1.488   4.783
  412    HZ2  TRP  57           HZ2      TRP  57 -11.273   0.256   2.086
  413    HZ3  TRP  57           HZ3      TRP  57  -9.289   0.531   5.885
  414    HH2  TRP  57           HH2      TRP  57 -11.282  -0.086   4.544
  415    HA   PRO  58           HA       PRO  58  -8.236   3.904   2.267
  416   1HB   PRO  58          1HB       PRO  58 -10.580   4.416   3.627
  417   2HB   PRO  58          2HB       PRO  58  -9.818   2.823   3.554
  418   1HG   PRO  58          1HG       PRO  58 -10.087   4.611   5.846
  419   2HG   PRO  58          2HG       PRO  58  -9.556   2.926   5.814
  420   1HD   PRO  58          1HD       PRO  58  -7.919   5.347   6.018
  421   2HD   PRO  58          2HD       PRO  58  -7.413   3.645   6.194
  422    H    LEU  59           H        LEU  59  -8.034   5.827   0.987
  423    HA   LEU  59           HA       LEU  59  -9.392   8.239   2.126
  424   1HB   LEU  59          1HB       LEU  59  -6.758   8.059   2.046
  425   2HB   LEU  59          2HB       LEU  59  -6.997   8.505   0.354
  426    HG   LEU  59           HG       LEU  59  -7.955  10.044   2.784
  427   1HD1  LEU  59          1HD1      LEU  59  -5.931  10.618   0.603
  428   2HD1  LEU  59          2HD1      LEU  59  -6.481  11.810   1.779
  429   3HD1  LEU  59          3HD1      LEU  59  -5.597  10.383   2.317
  430   1HD2  LEU  59          1HD2      LEU  59  -9.620  10.100   0.954
  431   2HD2  LEU  59          2HD2      LEU  59  -8.837  11.667   1.142
  432   3HD2  LEU  59          3HD2      LEU  59  -8.360  10.598  -0.176
  433    HA   PRO  60           HA       PRO  60 -10.679   7.491  -2.325
  434   1HB   PRO  60          1HB       PRO  60 -13.105   6.296  -1.834
  435   2HB   PRO  60          2HB       PRO  60 -11.612   5.399  -2.079
  436   1HG   PRO  60          1HG       PRO  60 -13.153   5.748   0.395
  437   2HG   PRO  60          2HG       PRO  60 -11.886   4.574   0.031
  438   1HD   PRO  60          1HD       PRO  60 -11.670   7.000   1.598
  439   2HD   PRO  60          2HD       PRO  60 -10.407   5.803   1.242
  440    H    ASN  61           H        ASN  61 -12.691   8.530  -3.361
  441    HA   ASN  61           HA       ASN  61 -13.447  11.013  -2.153
  442   1HB   ASN  61          1HB       ASN  61 -13.655  10.540  -4.552
  443   2HB   ASN  61          2HB       ASN  61 -14.795   9.234  -4.224
  444   1HD2  ASN  61          2HD2      ASN  61 -14.586  12.552  -4.965
  445   2HD2  ASN  61          1HD2      ASN  61 -16.176  12.988  -4.562
  446    H    LYS  62           H        LYS  62 -14.711   7.778  -2.050
  447    HA   LYS  62           HA       LYS  62 -16.344   8.353   0.348
  448   1HB   LYS  62          1HB       LYS  62 -17.357   8.000  -2.371
  449   2HB   LYS  62          2HB       LYS  62 -17.980   6.750  -1.293
  450   1HG   LYS  62          1HG       LYS  62 -18.414   8.755   0.341
  451   2HG   LYS  62          2HG       LYS  62 -18.323   9.730  -1.126
  452   1HD   LYS  62          1HD       LYS  62 -20.546   9.235  -1.285
  453   2HD   LYS  62          2HD       LYS  62 -19.951   7.724  -1.975
  454   1HE   LYS  62          1HE       LYS  62 -21.641   7.414  -0.104
  455   2HE   LYS  62          2HE       LYS  62 -20.082   6.622   0.199
  456   1HZ   LYS  62          1HZ       LYS  62 -20.146   9.394   0.972
  457   2HZ   LYS  62          2HZ       LYS  62 -21.237   8.435   1.847
  458   3HZ   LYS  62          3HZ       LYS  62 -19.585   8.041   1.833
  459    H    THR  63           H        THR  63 -17.149   5.981   1.136
  460    HA   THR  63           HA       THR  63 -14.854   4.327   1.347
  461    HB   THR  63           HB       THR  63 -17.599   3.191   1.393
  462    HG1  THR  63           HG1      THR  63 -16.687   4.858   3.461
  463   1HG2  THR  63          1HG2      THR  63 -15.048   2.927   2.918
  464   2HG2  THR  63          2HG2      THR  63 -16.559   2.530   3.737
  465   3HG2  THR  63          3HG2      THR  63 -16.097   1.666   2.270
  466    H    CYS  64           H        CYS  64 -14.121   2.628   0.108
  467    HA   CYS  64           HA       CYS  64 -15.172   2.381  -2.630
  468   1HB   CYS  64          1HB       CYS  64 -12.704   2.458  -1.650
  469   2HB   CYS  64          2HB       CYS  64 -12.959   0.725  -1.473
  Start of MODEL   15
    1   1H    LYS   1          1H        LYS   1   4.747   6.826   9.054
    2   2H    LYS   1          2H        LYS   1   4.433   7.933  10.299
    3   3H    LYS   1          3H        LYS   1   5.505   6.641  10.563
    4    HA   LYS   1           HA       LYS   1   3.666   5.758  11.561
    5   1HB   LYS   1          1HB       LYS   1   1.408   6.461  10.867
    6   2HB   LYS   1          2HB       LYS   1   2.440   7.871  11.106
    7   1HG   LYS   1          1HG       LYS   1   2.729   8.191   8.770
    8   2HG   LYS   1          2HG       LYS   1   2.112   6.582   8.395
    9   1HD   LYS   1          1HD       LYS   1   0.027   7.723   9.812
   10   2HD   LYS   1          2HD       LYS   1   0.643   9.074   8.863
   11   1HE   LYS   1          1HE       LYS   1   0.510   6.623   7.274
   12   2HE   LYS   1          2HE       LYS   1  -1.075   7.078   7.925
   13   1HZ   LYS   1          1HZ       LYS   1   0.239   9.420   7.135
   14   2HZ   LYS   1          2HZ       LYS   1   0.366   8.317   5.854
   15   3HZ   LYS   1          3HZ       LYS   1  -1.161   8.732   6.467
   16    H    ASP   2           H        ASP   2   1.625   4.360  10.515
   17    HA   ASP   2           HA       ASP   2   2.762   2.905   8.148
   18   1HB   ASP   2          1HB       ASP   2   1.264   1.701  10.491
   19   2HB   ASP   2          2HB       ASP   2   2.204   0.850   9.264
   20    H    GLY   3           H        GLY   3   1.222   2.279   6.595
   21   1HA   GLY   3          1HA       GLY   3  -1.630   2.316   7.163
   22   2HA   GLY   3          2HA       GLY   3  -1.121   3.704   6.201
   23    H    TYR   4           H        TYR   4  -2.832   2.165   4.914
   24    HA   TYR   4           HA       TYR   4  -1.265   0.255   3.228
   25   1HB   TYR   4          1HB       TYR   4  -4.186   0.636   3.902
   26   2HB   TYR   4          2HB       TYR   4  -3.673  -0.403   2.575
   27    HD1  TYR   4           HD1      TYR   4  -3.532   0.113   6.236
   28    HD2  TYR   4           HD2      TYR   4  -2.597  -2.522   2.976
   29    HE1  TYR   4           HE1      TYR   4  -3.067  -1.714   7.847
   30    HE2  TYR   4           HE2      TYR   4  -2.131  -4.349   4.586
   31    HH   TYR   4           HH       TYR   4  -1.827  -4.854   6.754
   32    H    LEU   5           H        LEU   5  -0.737   0.967   1.193
   33    HA   LEU   5           HA       LEU   5  -1.753   3.512   0.180
   34   1HB   LEU   5          1HB       LEU   5   0.198   1.387  -0.600
   35   2HB   LEU   5          2HB       LEU   5  -0.379   2.464  -1.871
   36    HG   LEU   5           HG       LEU   5   0.375   3.829   0.633
   37   1HD1  LEU   5          1HD1      LEU   5   2.428   2.385  -1.070
   38   2HD1  LEU   5          2HD1      LEU   5   2.820   3.659   0.084
   39   3HD1  LEU   5          3HD1      LEU   5   2.123   2.141   0.649
   40   1HD2  LEU   5          1HD2      LEU   5  -0.244   4.896  -1.577
   41   2HD2  LEU   5          2HD2      LEU   5   1.310   5.423  -0.930
   42   3HD2  LEU   5          3HD2      LEU   5   1.254   4.243  -2.240
   43    H    VAL   6           H        VAL   6  -3.344   3.782  -1.386
   44    HA   VAL   6           HA       VAL   6  -5.017   1.432  -2.027
   45    HB   VAL   6           HB       VAL   6  -6.550   3.160  -2.861
   46   1HG1  VAL   6          1HG1      VAL   6  -5.786   2.828  -0.271
   47   2HG1  VAL   6          2HG1      VAL   6  -5.503   4.556  -0.474
   48   3HG1  VAL   6          3HG1      VAL   6  -7.105   3.883  -0.775
   49   1HG2  VAL   6          1HG2      VAL   6  -4.359   4.518  -3.647
   50   2HG2  VAL   6          2HG2      VAL   6  -5.912   5.310  -3.384
   51   3HG2  VAL   6          3HG2      VAL   6  -4.674   5.358  -2.129
   52    H    GLU   7           H        GLU   7  -5.958   1.768  -4.472
   53    HA   GLU   7           HA       GLU   7  -3.579   1.424  -6.223
   54   1HB   GLU   7          1HB       GLU   7  -5.711  -0.113  -5.902
   55   2HB   GLU   7          2HB       GLU   7  -6.436   1.013  -7.051
   56   1HG   GLU   7          1HG       GLU   7  -3.734   0.086  -7.789
   57   2HG   GLU   7          2HG       GLU   7  -4.961  -1.181  -7.770
   58    H    LYS   8           H        LYS   8  -4.012   2.285  -8.570
   59    HA   LYS   8           HA       LYS   8  -4.055   5.102  -8.597
   60   1HB   LYS   8          1HB       LYS   8  -3.220   3.567 -10.373
   61   2HB   LYS   8          2HB       LYS   8  -4.888   3.150 -10.768
   62   1HG   LYS   8          1HG       LYS   8  -5.163   5.772 -10.970
   63   2HG   LYS   8          2HG       LYS   8  -3.419   5.721 -11.229
   64   1HD   LYS   8          1HD       LYS   8  -3.614   4.435 -13.180
   65   2HD   LYS   8          2HD       LYS   8  -5.227   3.862 -12.754
   66   1HE   LYS   8          1HE       LYS   8  -4.673   6.788 -13.315
   67   2HE   LYS   8          2HE       LYS   8  -5.143   5.650 -14.594
   68   1HZ   LYS   8          1HZ       LYS   8  -7.031   4.978 -13.165
   69   2HZ   LYS   8          2HZ       LYS   8  -6.631   6.229 -12.088
   70   3HZ   LYS   8          3HZ       LYS   8  -7.124   6.598 -13.668
   71    H    THR   9           H        THR   9  -6.723   2.787  -8.958
   72    HA   THR   9           HA       THR   9  -8.693   4.884  -9.540
   73    HB   THR   9           HB       THR   9 -10.197   2.771  -9.183
   74    HG1  THR   9           HG1      THR   9  -7.831   1.373  -9.622
   75   1HG2  THR   9          1HG2      THR   9  -8.392   3.580 -11.323
   76   2HG2  THR   9          2HG2      THR   9  -8.725   1.849 -11.364
   77   3HG2  THR   9          3HG2      THR   9 -10.056   3.004 -11.422
   78    H    GLY  10           H        GLY  10  -7.520   3.137  -6.726
   79   1HA   GLY  10          1HA       GLY  10  -7.865   4.413  -4.566
   80   2HA   GLY  10          2HA       GLY  10  -9.548   4.582  -5.065
   81    H    CYS  11           H        CYS  11  -7.869   1.593  -5.705
   82    HA   CYS  11           HA       CYS  11  -9.565   0.279  -3.610
   83   1HB   CYS  11          1HB       CYS  11  -8.338  -0.944  -6.097
   84   2HB   CYS  11          2HB       CYS  11  -9.655  -1.589  -5.118
   85    H    LYS  12           H        LYS  12  -8.544  -1.710  -2.636
   86    HA   LYS  12           HA       LYS  12  -5.843  -1.151  -1.724
   87   1HB   LYS  12          1HB       LYS  12  -7.947  -3.262  -1.349
   88   2HB   LYS  12          2HB       LYS  12  -6.316  -3.568  -0.755
   89   1HG   LYS  12          1HG       LYS  12  -6.386  -1.751   0.744
   90   2HG   LYS  12          2HG       LYS  12  -7.737  -0.992  -0.100
   91   1HD   LYS  12          1HD       LYS  12  -8.669  -1.966   1.875
   92   2HD   LYS  12          2HD       LYS  12  -9.118  -3.040   0.549
   93   1HE   LYS  12          1HE       LYS  12  -7.283  -4.564   1.104
   94   2HE   LYS  12          2HE       LYS  12  -6.722  -3.462   2.375
   95   1HZ   LYS  12          1HZ       LYS  12  -9.364  -3.709   2.909
   96   2HZ   LYS  12          2HZ       LYS  12  -8.962  -5.277   2.390
   97   3HZ   LYS  12          3HZ       LYS  12  -8.130  -4.577   3.691
   98    H    LYS  13           H        LYS  13  -4.458  -3.430  -1.655
   99    HA   LYS  13           HA       LYS  13  -4.273  -4.455  -4.467
  100   1HB   LYS  13          1HB       LYS  13  -1.965  -3.650  -2.663
  101   2HB   LYS  13          2HB       LYS  13  -1.868  -4.110  -4.362
  102   1HG   LYS  13          1HG       LYS  13  -3.764  -2.029  -4.252
  103   2HG   LYS  13          2HG       LYS  13  -2.435  -1.513  -3.215
  104   1HD   LYS  13          1HD       LYS  13  -1.612  -2.751  -5.771
  105   2HD   LYS  13          2HD       LYS  13  -2.454  -1.209  -5.927
  106   1HE   LYS  13          1HE       LYS  13  -0.497  -1.134  -3.761
  107   2HE   LYS  13          2HE       LYS  13   0.254  -1.523  -5.322
  108   1HZ   LYS  13          1HZ       LYS  13  -1.666   0.698  -4.845
  109   2HZ   LYS  13          2HZ       LYS  13   0.014   0.880  -5.028
  110   3HZ   LYS  13          3HZ       LYS  13  -0.929   0.321  -6.326
  111    H    THR  14           H        THR  14  -5.601  -5.962  -2.683
  112    HA   THR  14           HA       THR  14  -4.373  -7.586  -0.804
  113    HB   THR  14           HB       THR  14  -6.441  -8.124  -2.941
  114    HG1  THR  14           HG1      THR  14  -7.318  -6.829  -1.496
  115   1HG2  THR  14          1HG2      THR  14  -5.342 -10.257  -2.210
  116   2HG2  THR  14          2HG2      THR  14  -5.815  -9.879  -0.553
  117   3HG2  THR  14          3HG2      THR  14  -7.049 -10.160  -1.780
  118    H    CYS  15           H        CYS  15  -3.332  -9.653  -0.892
  119    HA   CYS  15           HA       CYS  15  -2.282 -10.575  -3.522
  120   1HB   CYS  15          1HB       CYS  15   0.003 -10.564  -2.622
  121   2HB   CYS  15          2HB       CYS  15  -0.682  -8.942  -2.543
  122    H    TYR  16           H        TYR  16  -2.544 -12.785  -3.583
  123    HA   TYR  16           HA       TYR  16  -3.414 -14.276  -1.261
  124   1HB   TYR  16          1HB       TYR  16  -3.050 -14.614  -4.125
  125   2HB   TYR  16          2HB       TYR  16  -2.516 -16.051  -3.251
  126    HD1  TYR  16           HD1      TYR  16  -5.170 -13.614  -2.290
  127    HD2  TYR  16           HD2      TYR  16  -4.275 -17.602  -3.609
  128    HE1  TYR  16           HE1      TYR  16  -7.533 -14.268  -1.916
  129    HE2  TYR  16           HE2      TYR  16  -6.637 -18.257  -3.233
  130    HH   TYR  16           HH       TYR  16  -8.834 -17.203  -3.086
  131    H    LYS  17           H        LYS  17  -0.342 -13.284  -2.320
  132    HA   LYS  17           HA       LYS  17   1.008 -15.526  -0.868
  133   1HB   LYS  17          1HB       LYS  17   1.432 -14.609  -3.361
  134   2HB   LYS  17          2HB       LYS  17   2.490 -13.501  -2.486
  135   1HG   LYS  17          1HG       LYS  17   3.920 -15.303  -2.924
  136   2HG   LYS  17          2HG       LYS  17   3.347 -15.669  -1.296
  137   1HD   LYS  17          1HD       LYS  17   1.593 -17.132  -2.250
  138   2HD   LYS  17          2HD       LYS  17   2.199 -16.788  -3.870
  139   1HE   LYS  17          1HE       LYS  17   4.344 -17.822  -3.346
  140   2HE   LYS  17          2HE       LYS  17   3.851 -18.059  -1.657
  141   1HZ   LYS  17          1HZ       LYS  17   1.771 -19.119  -2.887
  142   2HZ   LYS  17          2HZ       LYS  17   2.956 -19.449  -4.060
  143   3HZ   LYS  17          3HZ       LYS  17   3.143 -20.036  -2.480
  144    H    LEU  18           H        LEU  18   0.298 -14.385   1.176
  145    HA   LEU  18           HA       LEU  18   1.172 -11.753   1.877
  146   1HB   LEU  18          1HB       LEU  18   0.476 -14.270   3.407
  147   2HB   LEU  18          2HB       LEU  18   0.853 -12.754   4.226
  148    HG   LEU  18           HG       LEU  18  -1.234 -12.895   2.052
  149   1HD1  LEU  18          1HD1      LEU  18  -1.349 -13.889   4.827
  150   2HD1  LEU  18          2HD1      LEU  18  -2.645 -12.770   4.402
  151   3HD1  LEU  18          3HD1      LEU  18  -2.407 -14.242   3.461
  152   1HD2  LEU  18          1HD2      LEU  18  -0.101 -10.739   3.101
  153   2HD2  LEU  18          2HD2      LEU  18  -1.835 -10.772   2.783
  154   3HD2  LEU  18          3HD2      LEU  18  -1.233 -11.052   4.417
  155    H    GLY  19           H        GLY  19   2.804 -11.494   3.809
  156   1HA   GLY  19          1HA       GLY  19   4.906 -12.098   4.822
  157   2HA   GLY  19          2HA       GLY  19   5.100 -13.353   3.601
  158    H    GLU  20           H        GLU  20   7.296 -12.338   3.484
  159    HA   GLU  20           HA       GLU  20   7.879  -9.738   2.590
  160   1HB   GLU  20          1HB       GLU  20   9.093 -12.464   2.342
  161   2HB   GLU  20          2HB       GLU  20   9.814 -11.145   1.419
  162   1HG   GLU  20          1HG       GLU  20  10.073  -9.824   3.476
  163   2HG   GLU  20          2HG       GLU  20   9.316 -11.116   4.411
  164    H    ASN  21           H        ASN  21   6.033  -9.284   1.066
  165    HA   ASN  21           HA       ASN  21   6.092 -10.687  -1.535
  166   1HB   ASN  21          1HB       ASN  21   4.062  -9.773  -0.137
  167   2HB   ASN  21          2HB       ASN  21   4.487  -8.225  -0.868
  168   1HD2  ASN  21          2HD2      ASN  21   2.296 -10.573  -1.347
  169   2HD2  ASN  21          1HD2      ASN  21   2.243 -10.619  -3.043
  170    H    ASP  22           H        ASP  22   8.425  -9.901  -1.817
  171    HA   ASP  22           HA       ASP  22   9.465  -7.392  -2.036
  172   1HB   ASP  22          1HB       ASP  22   9.743  -9.948  -3.405
  173   2HB   ASP  22          2HB       ASP  22  10.156  -8.604  -4.469
  174    H    PHE  23           H        PHE  23   7.284  -8.837  -4.491
  175    HA   PHE  23           HA       PHE  23   7.244  -6.796  -6.396
  176   1HB   PHE  23          1HB       PHE  23   5.688  -9.049  -5.629
  177   2HB   PHE  23          2HB       PHE  23   4.564  -7.709  -5.868
  178    HD1  PHE  23           HD1      PHE  23   7.350  -9.598  -7.462
  179    HD2  PHE  23           HD2      PHE  23   4.073  -6.883  -8.043
  180    HE1  PHE  23           HE1      PHE  23   7.603  -9.819  -9.919
  181    HE2  PHE  23           HE2      PHE  23   4.325  -7.105 -10.501
  182    HZ   PHE  23           HZ       PHE  23   6.090  -8.573 -11.439
  183    H    CYS  24           H        CYS  24   5.065  -7.005  -3.537
  184    HA   CYS  24           HA       CYS  24   3.946  -4.382  -3.874
  185   1HB   CYS  24          1HB       CYS  24   2.971  -6.188  -2.493
  186   2HB   CYS  24          2HB       CYS  24   4.353  -6.102  -1.400
  187    H    ASN  25           H        ASN  25   6.778  -5.617  -2.126
  188    HA   ASN  25           HA       ASN  25   7.511  -3.242  -0.724
  189   1HB   ASN  25          1HB       ASN  25   8.398  -5.657  -0.584
  190   2HB   ASN  25          2HB       ASN  25   9.391  -5.258  -1.987
  191   1HD2  ASN  25          2HD2      ASN  25   9.514  -5.357   1.343
  192   2HD2  ASN  25          1HD2      ASN  25  10.711  -4.184   1.610
  193    H    ARG  26           H        ARG  26   8.179  -4.365  -4.031
  194    HA   ARG  26           HA       ARG  26  10.022  -2.342  -4.829
  195   1HB   ARG  26          1HB       ARG  26   9.259  -4.523  -5.973
  196   2HB   ARG  26          2HB       ARG  26   7.870  -3.601  -6.549
  197   1HG   ARG  26          1HG       ARG  26   9.162  -2.918  -8.267
  198   2HG   ARG  26          2HG       ARG  26  10.070  -1.964  -7.097
  199   1HD   ARG  26          1HD       ARG  26  11.848  -3.386  -7.151
  200   2HD   ARG  26          2HD       ARG  26  10.814  -4.824  -7.137
  201    HE   ARG  26           HE       ARG  26  11.994  -3.617  -9.465
  202   1HH1  ARG  26          1HH1      ARG  26   8.972  -4.889  -8.357
  203   2HH1  ARG  26          2HH1      ARG  26   8.336  -5.086  -9.954
  204   1HH2  ARG  26          1HH2      ARG  26  11.172  -3.886 -11.534
  205   2HH2  ARG  26          2HH2      ARG  26   9.577  -4.526 -11.746
  206    H    GLU  27           H        GLU  27   6.472  -2.497  -5.346
  207    HA   GLU  27           HA       GLU  27   6.016  -0.008  -6.504
  208   1HB   GLU  27          1HB       GLU  27   4.401  -1.314  -4.288
  209   2HB   GLU  27          2HB       GLU  27   3.785  -0.231  -5.537
  210   1HG   GLU  27          1HG       GLU  27   5.226  -2.362  -6.803
  211   2HG   GLU  27          2HG       GLU  27   4.067  -3.060  -5.672
  212    H    CYS  28           H        CYS  28   6.337  -0.737  -3.015
  213    HA   CYS  28           HA       CYS  28   6.035   1.994  -2.128
  214   1HB   CYS  28          1HB       CYS  28   6.102  -0.481  -0.988
  215   2HB   CYS  28          2HB       CYS  28   7.722   0.092  -0.589
  216    H    LYS  29           H        LYS  29   8.806  -0.039  -3.016
  217    HA   LYS  29           HA       LYS  29  10.753   2.106  -2.455
  218   1HB   LYS  29          1HB       LYS  29  11.407  -0.149  -1.969
  219   2HB   LYS  29          2HB       LYS  29  10.842  -0.721  -3.538
  220   1HG   LYS  29          1HG       LYS  29  12.698   0.063  -4.650
  221   2HG   LYS  29          2HG       LYS  29  12.928   1.410  -3.534
  222   1HD   LYS  29          1HD       LYS  29  14.721  -0.224  -3.228
  223   2HD   LYS  29          2HD       LYS  29  13.690  -0.201  -1.796
  224   1HE   LYS  29          1HE       LYS  29  12.468  -2.188  -2.647
  225   2HE   LYS  29          2HE       LYS  29  13.539  -2.225  -4.062
  226   1HZ   LYS  29          1HZ       LYS  29  15.034  -1.949  -1.659
  227   2HZ   LYS  29          2HZ       LYS  29  14.049  -3.328  -1.582
  228   3HZ   LYS  29          3HZ       LYS  29  15.150  -3.145  -2.861
  229    H    TRP  30           H        TRP  30   8.996   3.135  -4.220
  230    HA   TRP  30           HA       TRP  30  10.542   3.868  -6.498
  231   1HB   TRP  30          1HB       TRP  30  10.304   1.927  -7.664
  232   2HB   TRP  30          2HB       TRP  30   9.050   1.344  -6.581
  233    HD1  TRP  30           HD1      TRP  30   7.272   0.566  -8.247
  234    HE1  TRP  30           HE1      TRP  30   5.876   1.714 -10.084
  235    HE3  TRP  30           HE3      TRP  30   9.619   5.100  -8.441
  236    HZ2  TRP  30           HZ2      TRP  30   5.767   4.215 -11.453
  237    HZ3  TRP  30           HZ3      TRP  30   8.846   6.845 -10.022
  238    HH2  TRP  30           HH2      TRP  30   6.925   6.410 -11.527
  239    H    LYS  31           H        LYS  31   9.680   5.864  -5.690
  240    HA   LYS  31           HA       LYS  31   7.289   6.829  -6.954
  241   1HB   LYS  31          1HB       LYS  31   5.897   6.988  -4.887
  242   2HB   LYS  31          2HB       LYS  31   6.252   5.311  -5.307
  243   1HG   LYS  31          1HG       LYS  31   8.332   5.639  -3.742
  244   2HG   LYS  31          2HG       LYS  31   7.397   6.984  -3.088
  245   1HD   LYS  31          1HD       LYS  31   6.213   4.222  -3.390
  246   2HD   LYS  31          2HD       LYS  31   7.091   4.706  -1.938
  247   1HE   LYS  31          1HE       LYS  31   5.405   6.079  -1.220
  248   2HE   LYS  31          2HE       LYS  31   5.028   6.632  -2.863
  249   1HZ   LYS  31          1HZ       LYS  31   4.452   3.973  -2.928
  250   2HZ   LYS  31          2HZ       LYS  31   3.917   4.432  -1.386
  251   3HZ   LYS  31          3HZ       LYS  31   3.315   5.223  -2.763
  252    H    HIS  32           H        HIS  32   6.886   9.120  -6.307
  253    HA   HIS  32           HA       HIS  32   9.359  10.367  -5.218
  254   1HB   HIS  32          1HB       HIS  32   7.902  10.882  -7.421
  255   2HB   HIS  32          2HB       HIS  32   7.065  11.943  -6.287
  256    HD1  HIS  32           HD1      HIS  32  10.172  11.640  -8.251
  257    HD2  HIS  32           HD2      HIS  32   8.839  13.901  -5.012
  258    HE1  HIS  32           HE1      HIS  32  11.819  13.545  -7.980
  259    H    ILE  33           H        ILE  33   7.527   9.049  -3.363
  260    HA   ILE  33           HA       ILE  33   6.344  11.398  -1.922
  261    HB   ILE  33           HB       ILE  33   5.753   8.432  -2.009
  262   1HG1  ILE  33          1HG1      ILE  33   3.401   9.651  -2.365
  263   2HG1  ILE  33          2HG1      ILE  33   4.443  10.967  -2.903
  264   1HG2  ILE  33          1HG2      ILE  33   5.493  10.187   0.237
  265   2HG2  ILE  33          2HG2      ILE  33   3.877   9.835  -0.376
  266   3HG2  ILE  33          3HG2      ILE  33   4.951   8.515   0.091
  267   1HD1  ILE  33          1HD1      ILE  33   4.769   8.146  -3.936
  268   2HD1  ILE  33          2HD1      ILE  33   3.684   9.305  -4.705
  269   3HD1  ILE  33          3HD1      ILE  33   5.413   9.638  -4.622
  270    H    GLY  34           H        GLY  34   8.390   8.514  -1.560
  271   1HA   GLY  34          1HA       GLY  34  10.352   8.616  -0.083
  272   2HA   GLY  34          2HA       GLY  34   9.442   9.701   0.969
  273    H    GLY  35           H        GLY  35   9.919   6.360   0.033
  274   1HA   GLY  35          1HA       GLY  35   8.154   5.547   2.310
  275   2HA   GLY  35          2HA       GLY  35   8.385   4.558   0.868
  276    H    SER  36           H        SER  36   9.056   4.217   3.869
  277    HA   SER  36           HA       SER  36  11.995   3.868   3.776
  278   1HB   SER  36          1HB       SER  36  11.778   3.973   6.050
  279   2HB   SER  36          2HB       SER  36  10.161   4.571   5.692
  280    HG   SER  36           HG       SER  36  10.090   2.806   7.123
  281    H    TYR  37           H        TYR  37   9.160   1.792   4.500
  282    HA   TYR  37           HA       TYR  37  10.335  -0.442   2.975
  283   1HB   TYR  37          1HB       TYR  37  11.017  -0.076   5.646
  284   2HB   TYR  37          2HB       TYR  37   9.703  -1.248   5.726
  285    HD1  TYR  37           HD1      TYR  37  12.993  -0.547   4.115
  286    HD2  TYR  37           HD2      TYR  37  10.022  -3.502   5.061
  287    HE1  TYR  37           HE1      TYR  37  14.536  -2.338   3.367
  288    HE2  TYR  37           HE2      TYR  37  11.566  -5.293   4.314
  289    HH   TYR  37           HH       TYR  37  13.622  -5.773   3.620
  290    H    GLY  38           H        GLY  38   8.727  -2.173   2.684
  291   1HA   GLY  38          1HA       GLY  38   6.131  -1.984   3.966
  292   2HA   GLY  38          2HA       GLY  38   6.089  -1.373   2.315
  293    H    TYR  39           H        TYR  39   4.698  -3.684   3.303
  294    HA   TYR  39           HA       TYR  39   5.556  -5.631   1.283
  295   1HB   TYR  39          1HB       TYR  39   6.043  -7.401   2.859
  296   2HB   TYR  39          2HB       TYR  39   6.983  -5.995   3.358
  297    HD1  TYR  39           HD1      TYR  39   6.019  -4.470   5.170
  298    HD2  TYR  39           HD2      TYR  39   4.466  -8.384   4.322
  299    HE1  TYR  39           HE1      TYR  39   4.913  -4.512   7.391
  300    HE2  TYR  39           HE2      TYR  39   3.358  -8.425   6.541
  301    HH   TYR  39           HH       TYR  39   3.036  -5.641   8.486
  302    H    CYS  40           H        CYS  40   3.999  -7.779   1.974
  303    HA   CYS  40           HA       CYS  40   1.286  -6.619   1.826
  304   1HB   CYS  40          1HB       CYS  40   2.692  -8.906   0.861
  305   2HB   CYS  40          2HB       CYS  40   1.340  -9.483   1.838
  306    H    TYR  41           H        TYR  41  -0.180  -6.674   3.483
  307    HA   TYR  41           HA       TYR  41   0.201  -8.541   5.758
  308   1HB   TYR  41          1HB       TYR  41   1.517  -6.371   6.089
  309   2HB   TYR  41          2HB       TYR  41  -0.041  -5.547   6.157
  310    HD1  TYR  41           HD1      TYR  41   1.325  -8.766   7.532
  311    HD2  TYR  41           HD2      TYR  41  -0.713  -5.071   8.334
  312    HE1  TYR  41           HE1      TYR  41   1.085  -9.416   9.913
  313    HE2  TYR  41           HE2      TYR  41  -0.953  -5.720  10.715
  314    HH   TYR  41           HH       TYR  41  -1.012  -8.155  11.959
  315    H    GLY  42           H        GLY  42  -1.817  -9.365   6.146
  316   1HA   GLY  42          1HA       GLY  42  -4.149  -9.453   6.421
  317   2HA   GLY  42          2HA       GLY  42  -4.132  -7.690   6.510
  318    H    PHE  43           H        PHE  43  -2.991  -9.721   3.829
  319    HA   PHE  43           HA       PHE  43  -3.641  -9.738   1.558
  320   1HB   PHE  43          1HB       PHE  43  -6.205  -9.283   3.095
  321   2HB   PHE  43          2HB       PHE  43  -6.200  -9.488   1.342
  322    HD1  PHE  43           HD1      PHE  43  -4.044 -11.459   0.949
  323    HD2  PHE  43           HD2      PHE  43  -7.113 -11.284   3.950
  324    HE1  PHE  43           HE1      PHE  43  -3.900 -13.918   1.239
  325    HE2  PHE  43           HE2      PHE  43  -6.969 -13.743   4.242
  326    HZ   PHE  43           HZ       PHE  43  -5.361 -15.060   2.887
  327    H    GLY  44           H        GLY  44  -2.316  -7.600   1.584
  328   1HA   GLY  44          1HA       GLY  44  -3.448  -5.678  -0.085
  329   2HA   GLY  44          2HA       GLY  44  -3.759  -5.089   1.550
  330    H    CYS  45           H        CYS  45  -2.013  -3.818  -0.380
  331    HA   CYS  45           HA       CYS  45   0.755  -4.433   0.333
  332   1HB   CYS  45          1HB       CYS  45  -0.784  -2.708  -1.474
  333   2HB   CYS  45          2HB       CYS  45   0.665  -1.923  -0.848
  334    H    TYR  46           H        TYR  46   1.533  -3.875   2.330
  335    HA   TYR  46           HA       TYR  46   0.418  -1.447   3.678
  336   1HB   TYR  46          1HB       TYR  46   0.409  -3.842   4.657
  337   2HB   TYR  46          2HB       TYR  46   2.144  -3.616   4.881
  338    HD1  TYR  46           HD1      TYR  46  -0.816  -1.341   5.266
  339    HD2  TYR  46           HD2      TYR  46   2.618  -3.143   7.112
  340    HE1  TYR  46           HE1      TYR  46  -1.249  -0.045   7.336
  341    HE2  TYR  46           HE2      TYR  46   2.188  -1.847   9.181
  342    HH   TYR  46           HH       TYR  46   0.093  -0.764  10.267
  343    H    CYS  47           H        CYS  47   1.808   0.248   4.251
  344    HA   CYS  47           HA       CYS  47   4.741  -0.139   3.830
  345   1HB   CYS  47          1HB       CYS  47   2.822   1.598   2.337
  346   2HB   CYS  47          2HB       CYS  47   4.436   2.239   2.646
  347    H    GLU  48           H        GLU  48   5.985   1.104   5.241
  348    HA   GLU  48           HA       GLU  48   4.484   2.905   7.115
  349   1HB   GLU  48          1HB       GLU  48   7.182   1.679   7.661
  350   2HB   GLU  48          2HB       GLU  48   5.927   2.143   8.808
  351   1HG   GLU  48          1HG       GLU  48   4.520   0.281   8.072
  352   2HG   GLU  48          2HG       GLU  48   5.713  -0.163   6.850
  353    H    GLY  49           H        GLY  49   5.405   4.968   7.550
  354   1HA   GLY  49          1HA       GLY  49   7.268   6.555   7.424
  355   2HA   GLY  49          2HA       GLY  49   7.867   5.670   6.021
  356    H    LEU  50           H        LEU  50   4.465   6.388   6.345
  357    HA   LEU  50           HA       LEU  50   4.593   8.007   3.871
  358   1HB   LEU  50          1HB       LEU  50   2.150   7.267   5.483
  359   2HB   LEU  50          2HB       LEU  50   2.272   7.531   3.744
  360    HG   LEU  50           HG       LEU  50   3.303   5.184   5.345
  361   1HD1  LEU  50          1HD1      LEU  50   1.035   5.727   3.623
  362   2HD1  LEU  50          2HD1      LEU  50   2.005   4.404   2.976
  363   3HD1  LEU  50          3HD1      LEU  50   1.361   4.306   4.615
  364   1HD2  LEU  50          1HD2      LEU  50   3.946   5.993   2.493
  365   2HD2  LEU  50          2HD2      LEU  50   5.090   5.823   3.823
  366   3HD2  LEU  50          3HD2      LEU  50   4.281   4.399   3.170
  367    HA   PRO  51           HA       PRO  51   4.747  11.683   6.515
  368   1HB   PRO  51          1HB       PRO  51   4.166  13.172   4.085
  369   2HB   PRO  51          2HB       PRO  51   5.663  13.130   5.022
  370   1HG   PRO  51          1HG       PRO  51   5.194  11.935   2.482
  371   2HG   PRO  51          2HG       PRO  51   6.639  11.782   3.487
  372   1HD   PRO  51          1HD       PRO  51   4.646   9.766   2.920
  373   2HD   PRO  51          2HD       PRO  51   6.115   9.606   3.914
  374    H    ASP  52           H        ASP  52   3.146  13.538   6.842
  375    HA   ASP  52           HA       ASP  52   0.443  12.528   6.987
  376   1HB   ASP  52          1HB       ASP  52   1.852  15.146   7.492
  377   2HB   ASP  52          2HB       ASP  52   0.103  15.019   7.668
  378    H    SER  53           H        SER  53   2.197  14.305   4.567
  379    HA   SER  53           HA       SER  53  -0.107  15.565   3.307
  380   1HB   SER  53          1HB       SER  53   2.402  14.966   1.819
  381   2HB   SER  53          2HB       SER  53   1.513  16.480   1.949
  382    HG   SER  53           HG       SER  53   2.671  16.988   3.630
  383    H    THR  54           H        THR  54   1.173  12.365   3.287
  384    HA   THR  54           HA       THR  54   0.038  11.743   0.612
  385    HB   THR  54           HB       THR  54   1.238   9.728   2.471
  386    HG1  THR  54           HG1      THR  54   2.721  11.252   2.785
  387   1HG2  THR  54          1HG2      THR  54   0.430   9.459  -0.013
  388   2HG2  THR  54          2HG2      THR  54   1.970  10.228  -0.394
  389   3HG2  THR  54          3HG2      THR  54   1.940   8.707   0.499
  390    H    GLN  55           H        GLN  55  -1.765  10.389   0.340
  391    HA   GLN  55           HA       GLN  55  -3.416   9.940   2.781
  392   1HB   GLN  55          1HB       GLN  55  -3.927  10.053  -0.201
  393   2HB   GLN  55          2HB       GLN  55  -5.163   9.516   0.939
  394   1HG   GLN  55          1HG       GLN  55  -4.064  11.895   2.013
  395   2HG   GLN  55          2HG       GLN  55  -4.354  12.206   0.302
  396   1HE2  GLN  55          2HE2      GLN  55  -6.103  10.369   2.879
  397   2HE2  GLN  55          1HE2      GLN  55  -7.618  11.057   2.540
  398    H    THR  56           H        THR  56  -4.723   7.819   2.705
  399    HA   THR  56           HA       THR  56  -3.375   5.577   1.318
  400    HB   THR  56           HB       THR  56  -3.493   4.703   3.946
  401    HG1  THR  56           HG1      THR  56  -3.884   6.934   4.503
  402   1HG2  THR  56          1HG2      THR  56  -1.401   5.630   2.060
  403   2HG2  THR  56          2HG2      THR  56  -0.917   5.497   3.750
  404   3HG2  THR  56          3HG2      THR  56  -1.554   4.088   2.902
  405    H    TRP  57           H        TRP  57  -4.540   3.437   2.151
  406    HA   TRP  57           HA       TRP  57  -7.380   3.751   1.674
  407   1HB   TRP  57          1HB       TRP  57  -5.617   1.810   1.245
  408   2HB   TRP  57          2HB       TRP  57  -6.109   1.302   2.855
  409    HD1  TRP  57           HD1      TRP  57  -7.553   1.933  -0.644
  410    HE1  TRP  57           HE1      TRP  57  -9.754   0.616  -0.874
  411    HE3  TRP  57           HE3      TRP  57  -8.033   0.175   4.128
  412    HZ2  TRP  57           HZ2      TRP  57 -11.490  -0.977   0.749
  413    HZ3  TRP  57           HZ3      TRP  57  -9.969  -1.240   4.756
  414    HH2  TRP  57           HH2      TRP  57 -11.696  -1.818   3.074
  415    HA   PRO  58           HA       PRO  58  -9.208   2.876   2.046
  416   1HB   PRO  58          1HB       PRO  58 -11.454   4.166   3.169
  417   2HB   PRO  58          2HB       PRO  58 -11.168   2.425   3.109
  418   1HG   PRO  58          1HG       PRO  58 -11.110   4.187   5.415
  419   2HG   PRO  58          2HG       PRO  58 -11.004   2.424   5.370
  420   1HD   PRO  58          1HD       PRO  58  -8.878   4.317   5.864
  421   2HD   PRO  58          2HD       PRO  58  -8.772   2.539   5.824
  422    H    LEU  59           H        LEU  59 -10.678   4.597   0.827
  423    HA   LEU  59           HA       LEU  59  -9.174   7.174   0.795
  424   1HB   LEU  59          1HB       LEU  59 -10.908   5.586  -1.094
  425   2HB   LEU  59          2HB       LEU  59 -10.607   7.293  -1.409
  426    HG   LEU  59           HG       LEU  59  -8.134   5.968  -0.710
  427   1HD1  LEU  59          1HD1      LEU  59  -9.327   3.966  -1.606
  428   2HD1  LEU  59          2HD1      LEU  59  -9.610   4.842  -3.110
  429   3HD1  LEU  59          3HD1      LEU  59  -7.964   4.447  -2.616
  430   1HD2  LEU  59          1HD2      LEU  59  -9.286   7.605  -2.936
  431   2HD2  LEU  59          2HD2      LEU  59  -7.868   7.918  -1.934
  432   3HD2  LEU  59          3HD2      LEU  59  -7.781   6.737  -3.241
  433    HA   PRO  60           HA       PRO  60 -12.412   9.693   2.395
  434   1HB   PRO  60          1HB       PRO  60 -12.904  11.129  -0.090
  435   2HB   PRO  60          2HB       PRO  60 -12.124  11.707   1.386
  436   1HG   PRO  60          1HG       PRO  60 -10.865  11.079  -1.090
  437   2HG   PRO  60          2HG       PRO  60 -10.080  11.528   0.425
  438   1HD   PRO  60          1HD       PRO  60 -10.077   8.951  -0.861
  439   2HD   PRO  60          2HD       PRO  60  -9.310   9.396   0.682
  440    H    ASN  61           H        ASN  61 -14.744  10.656   1.322
  441    HA   ASN  61           HA       ASN  61 -16.544   8.534   1.240
  442   1HB   ASN  61          1HB       ASN  61 -16.582  11.209  -0.200
  443   2HB   ASN  61          2HB       ASN  61 -18.004  10.187   0.012
  444   1HD2  ASN  61          2HD2      ASN  61 -19.200  10.622   1.869
  445   2HD2  ASN  61          1HD2      ASN  61 -18.597  11.382   3.262
  446    H    LYS  62           H        LYS  62 -14.418   9.693  -1.269
  447    HA   LYS  62           HA       LYS  62 -15.732   8.163  -3.423
  448   1HB   LYS  62          1HB       LYS  62 -14.116  10.407  -3.214
  449   2HB   LYS  62          2HB       LYS  62 -13.007   9.183  -3.833
  450   1HG   LYS  62          1HG       LYS  62 -15.655  10.024  -5.042
  451   2HG   LYS  62          2HG       LYS  62 -14.047  10.256  -5.730
  452   1HD   LYS  62          1HD       LYS  62 -14.061   8.194  -6.631
  453   2HD   LYS  62          2HD       LYS  62 -14.477   7.467  -5.078
  454   1HE   LYS  62          1HE       LYS  62 -16.865   8.632  -5.768
  455   2HE   LYS  62          2HE       LYS  62 -16.233   8.156  -7.355
  456   1HZ   LYS  62          1HZ       LYS  62 -15.662   6.125  -5.489
  457   2HZ   LYS  62          2HZ       LYS  62 -17.314   6.495  -5.386
  458   3HZ   LYS  62          3HZ       LYS  62 -16.638   6.041  -6.876
  459    H    THR  63           H        THR  63 -15.386   6.119  -1.917
  460    HA   THR  63           HA       THR  63 -12.628   5.056  -1.952
  461    HB   THR  63           HB       THR  63 -15.079   3.541  -1.110
  462    HG1  THR  63           HG1      THR  63 -14.061   5.910  -0.013
  463   1HG2  THR  63          1HG2      THR  63 -12.313   3.203  -0.859
  464   2HG2  THR  63          2HG2      THR  63 -12.841   3.739   0.736
  465   3HG2  THR  63          3HG2      THR  63 -13.561   2.305   0.004
  466    H    CYS  64           H        CYS  64 -12.795   2.456  -2.488
  467    HA   CYS  64           HA       CYS  64 -13.283   2.332  -5.367
  468   1HB   CYS  64          1HB       CYS  64 -11.381   1.280  -4.079
  469   2HB   CYS  64          2HB       CYS  64 -12.548   0.153  -3.387
  Start of MODEL   16
    1   1H    LYS   1          1H        LYS   1   5.670   8.197   7.823
    2   2H    LYS   1          2H        LYS   1   4.967   9.677   8.262
    3   3H    LYS   1          3H        LYS   1   5.786   8.749   9.425
    4    HA   LYS   1           HA       LYS   1   3.919   7.681   9.950
    5   1HB   LYS   1          1HB       LYS   1   2.897   9.822   9.437
    6   2HB   LYS   1          2HB       LYS   1   2.878   9.449   7.714
    7   1HG   LYS   1          1HG       LYS   1   1.522   7.305   8.656
    8   2HG   LYS   1          2HG       LYS   1   1.077   8.498   9.876
    9   1HD   LYS   1          1HD       LYS   1  -0.557   8.962   8.323
   10   2HD   LYS   1          2HD       LYS   1   0.713  10.015   7.700
   11   1HE   LYS   1          1HE       LYS   1   1.455   7.996   6.270
   12   2HE   LYS   1          2HE       LYS   1  -0.122   7.291   6.679
   13   1HZ   LYS   1          1HZ       LYS   1  -0.685   9.895   6.080
   14   2HZ   LYS   1          2HZ       LYS   1   0.483   9.471   4.920
   15   3HZ   LYS   1          3HZ       LYS   1  -0.942   8.563   5.058
   16    H    ASP   2           H        ASP   2   2.849   5.735   9.431
   17    HA   ASP   2           HA       ASP   2   3.563   4.552   6.783
   18   1HB   ASP   2          1HB       ASP   2   2.424   3.151   9.210
   19   2HB   ASP   2          2HB       ASP   2   3.418   2.469   7.922
   20    H    GLY   3           H        GLY   3   1.834   3.145   5.779
   21   1HA   GLY   3          1HA       GLY   3  -0.931   3.543   6.599
   22   2HA   GLY   3          2HA       GLY   3  -0.510   4.480   5.165
   23    H    TYR   4           H        TYR   4  -2.416   2.656   4.761
   24    HA   TYR   4           HA       TYR   4  -1.128   0.180   3.716
   25   1HB   TYR   4          1HB       TYR   4  -3.699   0.984   4.854
   26   2HB   TYR   4          2HB       TYR   4  -3.895   0.050   3.370
   27    HD1  TYR   4           HD1      TYR   4  -2.128  -2.011   3.208
   28    HD2  TYR   4           HD2      TYR   4  -3.599  -0.234   6.832
   29    HE1  TYR   4           HE1      TYR   4  -1.585  -4.089   4.448
   30    HE2  TYR   4           HE2      TYR   4  -3.056  -2.312   8.072
   31    HH   TYR   4           HH       TYR   4  -1.584  -4.243   7.867
   32    H    LEU   5           H        LEU   5  -0.992  -0.170   1.520
   33    HA   LEU   5           HA       LEU   5  -1.138   1.910  -0.373
   34   1HB   LEU   5          1HB       LEU   5  -0.720  -0.950  -0.238
   35   2HB   LEU   5          2HB       LEU   5  -1.627  -0.538  -1.693
   36    HG   LEU   5           HG       LEU   5   1.062   0.553  -0.830
   37   1HD1  LEU   5          1HD1      LEU   5   0.038  -1.318  -2.910
   38   2HD1  LEU   5          2HD1      LEU   5   1.342  -0.230  -3.388
   39   3HD1  LEU   5          3HD1      LEU   5   1.570  -1.339  -2.036
   40   1HD2  LEU   5          1HD2      LEU   5  -1.041   1.726  -2.518
   41   2HD2  LEU   5          2HD2      LEU   5   0.389   2.485  -1.818
   42   3HD2  LEU   5          3HD2      LEU   5   0.517   1.591  -3.333
   43    H    VAL   6           H        VAL   6  -2.706   2.451  -1.961
   44    HA   VAL   6           HA       VAL   6  -5.472   1.391  -1.463
   45    HB   VAL   6           HB       VAL   6  -6.195   3.697  -2.118
   46   1HG1  VAL   6          1HG1      VAL   6  -4.301   3.288   0.191
   47   2HG1  VAL   6          2HG1      VAL   6  -5.078   4.849  -0.073
   48   3HG1  VAL   6          3HG1      VAL   6  -6.060   3.413   0.216
   49   1HG2  VAL   6          1HG2      VAL   6  -3.708   3.883  -3.248
   50   2HG2  VAL   6          2HG2      VAL   6  -4.734   5.271  -2.886
   51   3HG2  VAL   6          3HG2      VAL   6  -3.471   4.788  -1.753
   52    H    GLU   7           H        GLU   7  -6.805   2.226  -3.626
   53    HA   GLU   7           HA       GLU   7  -5.161   1.371  -5.981
   54   1HB   GLU   7          1HB       GLU   7  -6.873  -0.255  -4.882
   55   2HB   GLU   7          2HB       GLU   7  -8.097   0.785  -5.615
   56   1HG   GLU   7          1HG       GLU   7  -5.938   0.096  -7.465
   57   2HG   GLU   7          2HG       GLU   7  -6.815  -1.318  -6.878
   58    H    LYS   8           H        LYS   8  -6.316   2.055  -8.091
   59    HA   LYS   8           HA       LYS   8  -6.536   4.813  -8.362
   60   1HB   LYS   8          1HB       LYS   8  -6.922   2.503  -9.903
   61   2HB   LYS   8          2HB       LYS   8  -8.442   3.388 -10.047
   62   1HG   LYS   8          1HG       LYS   8  -7.062   5.457 -10.561
   63   2HG   LYS   8          2HG       LYS   8  -5.658   4.393 -10.681
   64   1HD   LYS   8          1HD       LYS   8  -7.540   3.094 -12.237
   65   2HD   LYS   8          2HD       LYS   8  -7.862   4.795 -12.575
   66   1HE   LYS   8          1HE       LYS   8  -5.161   4.838 -12.712
   67   2HE   LYS   8          2HE       LYS   8  -5.459   3.165 -13.228
   68   1HZ   LYS   8          1HZ       LYS   8  -7.250   5.206 -14.287
   69   2HZ   LYS   8          2HZ       LYS   8  -5.665   5.219 -14.889
   70   3HZ   LYS   8          3HZ       LYS   8  -6.619   3.820 -15.039
   71    H    THR   9           H        THR   9  -9.243   2.534  -7.800
   72    HA   THR   9           HA       THR   9 -11.201   4.683  -7.515
   73    HB   THR   9           HB       THR   9 -12.581   2.649  -6.746
   74    HG1  THR   9           HG1      THR   9 -11.196   0.734  -7.644
   75   1HG2  THR   9          1HG2      THR   9 -11.928   3.574  -9.222
   76   2HG2  THR   9          2HG2      THR   9 -11.371   1.904  -9.338
   77   3HG2  THR   9          3HG2      THR   9 -13.054   2.247  -8.937
   78    H    GLY  10           H        GLY  10  -8.991   3.030  -5.400
   79   1HA   GLY  10          1HA       GLY  10  -8.590   4.245  -3.225
   80   2HA   GLY  10          2HA       GLY  10 -10.345   4.288  -3.046
   81    H    CYS  11           H        CYS  11  -9.668   1.387  -4.465
   82    HA   CYS  11           HA       CYS  11 -10.273  -0.132  -2.079
   83   1HB   CYS  11          1HB       CYS  11  -9.561  -0.638  -4.947
   84   2HB   CYS  11          2HB       CYS  11  -9.500  -1.993  -3.820
   85    H    LYS  12           H        LYS  12  -8.696  -2.176  -1.717
   86    HA   LYS  12           HA       LYS  12  -5.967  -1.037  -1.253
   87   1HB   LYS  12          1HB       LYS  12  -5.990  -3.012   0.457
   88   2HB   LYS  12          2HB       LYS  12  -6.937  -1.574   0.824
   89   1HG   LYS  12          1HG       LYS  12  -8.950  -2.642   0.455
   90   2HG   LYS  12          2HG       LYS  12  -8.264  -3.745  -0.738
   91   1HD   LYS  12          1HD       LYS  12  -6.963  -4.792   1.211
   92   2HD   LYS  12          2HD       LYS  12  -8.047  -3.890   2.271
   93   1HE   LYS  12          1HE       LYS  12  -9.976  -5.046   1.446
   94   2HE   LYS  12          2HE       LYS  12  -9.065  -5.733   0.086
   95   1HZ   LYS  12          1HZ       LYS  12  -8.256  -6.185   2.896
   96   2HZ   LYS  12          2HZ       LYS  12  -9.362  -7.212   2.115
   97   3HZ   LYS  12          3HZ       LYS  12  -7.782  -7.047   1.514
   98    H    LYS  13           H        LYS  13  -4.327  -3.021  -1.042
   99    HA   LYS  13           HA       LYS  13  -4.771  -4.804  -3.417
  100   1HB   LYS  13          1HB       LYS  13  -2.286  -3.392  -2.395
  101   2HB   LYS  13          2HB       LYS  13  -2.286  -4.550  -3.726
  102   1HG   LYS  13          1HG       LYS  13  -4.360  -2.704  -4.280
  103   2HG   LYS  13          2HG       LYS  13  -2.965  -1.749  -3.777
  104   1HD   LYS  13          1HD       LYS  13  -2.590  -2.010  -6.078
  105   2HD   LYS  13          2HD       LYS  13  -1.625  -3.315  -5.386
  106   1HE   LYS  13          1HE       LYS  13  -3.547  -4.881  -5.753
  107   2HE   LYS  13          2HE       LYS  13  -4.414  -3.565  -6.569
  108   1HZ   LYS  13          1HZ       LYS  13  -1.659  -3.980  -7.393
  109   2HZ   LYS  13          2HZ       LYS  13  -2.746  -5.209  -7.839
  110   3HZ   LYS  13          3HZ       LYS  13  -3.024  -3.607  -8.329
  111    H    THR  14           H        THR  14  -5.295  -6.734  -2.322
  112    HA   THR  14           HA       THR  14  -4.066  -7.604   0.139
  113    HB   THR  14           HB       THR  14  -5.393  -9.238  -2.048
  114    HG1  THR  14           HG1      THR  14  -7.311  -8.684  -1.051
  115   1HG2  THR  14          1HG2      THR  14  -4.743  -9.649   0.841
  116   2HG2  THR  14          2HG2      THR  14  -6.231 -10.356   0.211
  117   3HG2  THR  14          3HG2      THR  14  -4.678 -10.797  -0.497
  118    H    CYS  15           H        CYS  15  -2.688  -9.602   0.296
  119    HA   CYS  15           HA       CYS  15  -1.054 -10.226  -2.102
  120   1HB   CYS  15          1HB       CYS  15   1.019  -9.660  -0.870
  121   2HB   CYS  15          2HB       CYS  15  -0.025  -8.250  -1.046
  122    H    TYR  16           H        TYR  16  -0.557 -12.377  -2.087
  123    HA   TYR  16           HA       TYR  16  -1.388 -14.051   0.165
  124   1HB   TYR  16          1HB       TYR  16  -0.145 -14.479  -2.558
  125   2HB   TYR  16          2HB       TYR  16  -0.458 -15.820  -1.459
  126    HD1  TYR  16           HD1      TYR  16  -2.786 -13.108  -1.067
  127    HD2  TYR  16           HD2      TYR  16  -1.943 -16.608  -3.413
  128    HE1  TYR  16           HE1      TYR  16  -5.145 -13.171  -1.821
  129    HE2  TYR  16           HE2      TYR  16  -4.304 -16.670  -4.167
  130    HH   TYR  16           HH       TYR  16  -6.750 -14.784  -2.703
  131    H    LYS  17           H        LYS  17   1.700 -13.085  -1.328
  132    HA   LYS  17           HA       LYS  17   3.234 -14.747   0.571
  133   1HB   LYS  17          1HB       LYS  17   3.879 -14.585  -1.783
  134   2HB   LYS  17          2HB       LYS  17   4.000 -12.829  -1.650
  135   1HG   LYS  17          1HG       LYS  17   5.884 -12.957  -0.210
  136   2HG   LYS  17          2HG       LYS  17   5.616 -14.669   0.118
  137   1HD   LYS  17          1HD       LYS  17   7.055 -15.136  -1.548
  138   2HD   LYS  17          2HD       LYS  17   5.861 -14.489  -2.675
  139   1HE   LYS  17          1HE       LYS  17   7.151 -12.243  -1.504
  140   2HE   LYS  17          2HE       LYS  17   8.426 -13.381  -1.985
  141   1HZ   LYS  17          1HZ       LYS  17   6.151 -12.988  -3.789
  142   2HZ   LYS  17          2HZ       LYS  17   7.342 -11.777  -3.736
  143   3HZ   LYS  17          3HZ       LYS  17   7.766 -13.366  -4.155
  144    H    LEU  18           H        LEU  18   3.630 -13.933   2.582
  145    HA   LEU  18           HA       LEU  18   3.564 -11.037   3.106
  146   1HB   LEU  18          1HB       LEU  18   4.007 -13.545   4.747
  147   2HB   LEU  18          2HB       LEU  18   4.050 -11.929   5.452
  148    HG   LEU  18           HG       LEU  18   1.711 -13.051   3.887
  149   1HD1  LEU  18          1HD1      LEU  18   2.337 -14.058   6.223
  150   2HD1  LEU  18          2HD1      LEU  18   1.729 -12.525   6.847
  151   3HD1  LEU  18          3HD1      LEU  18   0.667 -13.580   5.913
  152   1HD2  LEU  18          1HD2      LEU  18   2.445 -10.408   4.618
  153   2HD2  LEU  18          2HD2      LEU  18   0.911 -10.945   3.936
  154   3HD2  LEU  18          3HD2      LEU  18   1.122 -10.878   5.685
  155    H    GLY  19           H        GLY  19   5.406  -9.770   3.466
  156   1HA   GLY  19          1HA       GLY  19   7.781  -9.616   4.171
  157   2HA   GLY  19          2HA       GLY  19   8.036 -11.189   3.419
  158    H    GLU  20           H        GLU  20   9.760 -10.113   2.221
  159    HA   GLU  20           HA       GLU  20   9.445  -7.929   0.443
  160   1HB   GLU  20          1HB       GLU  20  11.215 -10.301   0.761
  161   2HB   GLU  20          2HB       GLU  20  11.272  -9.485  -0.803
  162   1HG   GLU  20          1HG       GLU  20  12.904  -8.359   0.486
  163   2HG   GLU  20          2HG       GLU  20  11.495  -7.302   0.568
  164    H    ASN  21           H        ASN  21   7.215  -8.348  -0.381
  165    HA   ASN  21           HA       ASN  21   6.950 -10.550  -2.348
  166   1HB   ASN  21          1HB       ASN  21   5.192  -9.904  -0.644
  167   2HB   ASN  21          2HB       ASN  21   5.001  -8.380  -1.513
  168   1HD2  ASN  21          2HD2      ASN  21   3.142 -10.831  -1.196
  169   2HD2  ASN  21          1HD2      ASN  21   2.701 -11.211  -2.789
  170    H    ASP  22           H        ASP  22   8.277  -9.868  -4.078
  171    HA   ASP  22           HA       ASP  22   8.840  -7.470  -5.220
  172   1HB   ASP  22          1HB       ASP  22   8.308 -10.200  -6.177
  173   2HB   ASP  22          2HB       ASP  22   8.134  -8.972  -7.433
  174    H    PHE  23           H        PHE  23   5.767  -9.208  -5.877
  175    HA   PHE  23           HA       PHE  23   4.576  -7.231  -7.533
  176   1HB   PHE  23          1HB       PHE  23   3.933  -9.695  -6.400
  177   2HB   PHE  23          2HB       PHE  23   2.746  -8.596  -5.699
  178    HD1  PHE  23           HD1      PHE  23   4.034 -10.069  -8.817
  179    HD2  PHE  23           HD2      PHE  23   1.131  -7.412  -7.097
  180    HE1  PHE  23           HE1      PHE  23   2.775 -10.061 -10.954
  181    HE2  PHE  23           HE2      PHE  23  -0.130  -7.404  -9.234
  182    HZ   PHE  23           HZ       PHE  23   0.693  -8.729 -11.162
  183    H    CYS  24           H        CYS  24   4.337  -7.681  -3.988
  184    HA   CYS  24           HA       CYS  24   2.774  -5.259  -3.592
  185   1HB   CYS  24          1HB       CYS  24   3.454  -7.571  -2.194
  186   2HB   CYS  24          2HB       CYS  24   4.284  -6.292  -1.307
  187    H    ASN  25           H        ASN  25   6.214  -6.129  -3.278
  188    HA   ASN  25           HA       ASN  25   7.151  -3.711  -2.085
  189   1HB   ASN  25          1HB       ASN  25   8.393  -5.855  -2.327
  190   2HB   ASN  25          2HB       ASN  25   8.482  -5.588  -4.068
  191   1HD2  ASN  25          2HD2      ASN  25  10.629  -5.013  -4.483
  192   2HD2  ASN  25          1HD2      ASN  25  11.492  -3.825  -3.630
  193    H    ARG  26           H        ARG  26   7.250  -4.674  -5.538
  194    HA   ARG  26           HA       ARG  26   8.064  -2.138  -6.557
  195   1HB   ARG  26          1HB       ARG  26   7.445  -4.721  -7.470
  196   2HB   ARG  26          2HB       ARG  26   6.321  -3.662  -8.322
  197   1HG   ARG  26          1HG       ARG  26   7.993  -2.575  -9.465
  198   2HG   ARG  26          2HG       ARG  26   9.157  -2.762  -8.151
  199   1HD   ARG  26          1HD       ARG  26   8.697  -5.385  -8.912
  200   2HD   ARG  26          2HD       ARG  26   8.666  -4.515 -10.457
  201    HE   ARG  26           HE       ARG  26  10.829  -3.423  -9.067
  202   1HH1  ARG  26          1HH1      ARG  26   9.795  -6.556 -10.092
  203   2HH1  ARG  26          2HH1      ARG  26  11.403  -7.172 -10.268
  204   1HH2  ARG  26          1HH2      ARG  26  12.933  -4.217  -9.297
  205   2HH2  ARG  26          2HH2      ARG  26  13.177  -5.850  -9.820
  206    H    GLU  27           H        GLU  27   4.880  -3.435  -5.733
  207    HA   GLU  27           HA       GLU  27   3.225  -1.549  -7.074
  208   1HB   GLU  27          1HB       GLU  27   3.066  -3.328  -4.669
  209   2HB   GLU  27          2HB       GLU  27   1.772  -2.156  -4.922
  210   1HG   GLU  27          1HG       GLU  27   2.672  -3.873  -7.216
  211   2HG   GLU  27          2HG       GLU  27   1.590  -4.552  -5.999
  212    H    CYS  28           H        CYS  28   4.778  -1.400  -3.862
  213    HA   CYS  28           HA       CYS  28   3.611   1.195  -3.209
  214   1HB   CYS  28          1HB       CYS  28   4.359  -0.659  -1.630
  215   2HB   CYS  28          2HB       CYS  28   6.019  -0.198  -2.003
  216    H    LYS  29           H        LYS  29   6.541   0.064  -4.797
  217    HA   LYS  29           HA       LYS  29   8.154   2.408  -4.504
  218   1HB   LYS  29          1HB       LYS  29   8.842   0.128  -5.306
  219   2HB   LYS  29          2HB       LYS  29   8.004   0.457  -6.824
  220   1HG   LYS  29          1HG       LYS  29   9.977   2.485  -5.859
  221   2HG   LYS  29          2HG       LYS  29  10.608   0.981  -6.533
  222   1HD   LYS  29          1HD       LYS  29   8.490   1.877  -8.227
  223   2HD   LYS  29          2HD       LYS  29   9.569   3.242  -7.940
  224   1HE   LYS  29          1HE       LYS  29  11.118   2.347  -9.328
  225   2HE   LYS  29          2HE       LYS  29  11.118   0.834  -8.398
  226   1HZ   LYS  29          1HZ       LYS  29   8.800   1.444 -10.087
  227   2HZ   LYS  29          2HZ       LYS  29  10.214   0.887 -10.845
  228   3HZ   LYS  29          3HZ       LYS  29   9.457  -0.064  -9.662
  229    H    TRP  30           H        TRP  30   6.596   1.445  -7.581
  230    HA   TRP  30           HA       TRP  30   5.688   2.783  -9.305
  231   1HB   TRP  30          1HB       TRP  30   4.691   3.706  -6.684
  232   2HB   TRP  30          2HB       TRP  30   4.510   4.885  -7.983
  233    HD1  TRP  30           HD1      TRP  30   2.454   2.512  -6.457
  234    HE1  TRP  30           HE1      TRP  30   0.784   1.404  -8.079
  235    HE3  TRP  30           HE3      TRP  30   4.635   3.703 -10.917
  236    HZ2  TRP  30           HZ2      TRP  30   0.422   1.069 -10.897
  237    HZ3  TRP  30           HZ3      TRP  30   3.609   2.979 -13.052
  238    HH2  TRP  30           HH2      TRP  30   1.507   1.664 -13.048
  239    H    LYS  31           H        LYS  31   6.041   5.650  -7.338
  240    HA   LYS  31           HA       LYS  31   8.521   6.441  -8.795
  241   1HB   LYS  31          1HB       LYS  31   6.053   7.121  -9.681
  242   2HB   LYS  31          2HB       LYS  31   6.324   8.433  -8.534
  243   1HG   LYS  31          1HG       LYS  31   8.184   9.241  -9.691
  244   2HG   LYS  31          2HG       LYS  31   8.484   7.694 -10.484
  245   1HD   LYS  31          1HD       LYS  31   7.017   8.128 -12.171
  246   2HD   LYS  31          2HD       LYS  31   5.858   8.905 -11.091
  247   1HE   LYS  31          1HE       LYS  31   6.572  10.927 -11.814
  248   2HE   LYS  31          2HE       LYS  31   8.198  10.558 -11.202
  249   1HZ   LYS  31          1HZ       LYS  31   8.427   9.128 -13.265
  250   2HZ   LYS  31          2HZ       LYS  31   7.057   9.937 -13.863
  251   3HZ   LYS  31          3HZ       LYS  31   8.472  10.806 -13.503
  252    H    HIS  32           H        HIS  32   6.068   7.760  -6.539
  253    HA   HIS  32           HA       HIS  32   8.235   8.980  -4.910
  254   1HB   HIS  32          1HB       HIS  32   6.303  10.136  -3.860
  255   2HB   HIS  32          2HB       HIS  32   6.271  10.303  -5.616
  256    HD1  HIS  32           HD1      HIS  32   4.568   8.492  -2.782
  257    HD2  HIS  32           HD2      HIS  32   4.116   8.982  -6.897
  258    HE1  HIS  32           HE1      HIS  32   2.310   7.512  -3.377
  259    H    ILE  33           H        ILE  33   8.811   8.114  -2.927
  260    HA   ILE  33           HA       ILE  33   6.976   6.125  -1.653
  261    HB   ILE  33           HB       ILE  33   8.760   5.119  -3.171
  262   1HG1  ILE  33          1HG1      ILE  33   9.629   3.825  -0.844
  263   2HG1  ILE  33          2HG1      ILE  33   8.030   4.447  -0.439
  264   1HG2  ILE  33          1HG2      ILE  33  10.545   6.736  -2.576
  265   2HG2  ILE  33          2HG2      ILE  33  10.579   6.063  -0.947
  266   3HG2  ILE  33          3HG2      ILE  33  11.048   5.065  -2.322
  267   1HD1  ILE  33          1HD1      ILE  33   7.526   3.476  -2.913
  268   2HD1  ILE  33          2HD1      ILE  33   8.808   2.372  -2.413
  269   3HD1  ILE  33          3HD1      ILE  33   7.339   2.513  -1.448
  270    H    GLY  34           H        GLY  34   9.970   8.024  -1.338
  271   1HA   GLY  34          1HA       GLY  34  10.709   9.332   0.490
  272   2HA   GLY  34          2HA       GLY  34   9.176   8.993   1.290
  273    H    GLY  35           H        GLY  35  11.818   6.895   0.141
  274   1HA   GLY  35          1HA       GLY  35  12.884   5.100   1.220
  275   2HA   GLY  35          2HA       GLY  35  12.967   6.207   2.590
  276    H    SER  36           H        SER  36   9.797   5.384   1.446
  277    HA   SER  36           HA       SER  36   9.134   4.154   4.003
  278   1HB   SER  36          1HB       SER  36   6.978   4.517   3.272
  279   2HB   SER  36          2HB       SER  36   7.806   5.596   2.154
  280    HG   SER  36           HG       SER  36   6.460   4.208   1.003
  281    H    TYR  37           H        TYR  37   9.457   2.008   4.443
  282    HA   TYR  37           HA       TYR  37  10.238   0.105   2.394
  283   1HB   TYR  37          1HB       TYR  37  10.308   0.379   5.194
  284   2HB   TYR  37          2HB       TYR  37   9.296  -1.036   4.898
  285    HD1  TYR  37           HD1      TYR  37  10.180  -2.993   3.688
  286    HD2  TYR  37           HD2      TYR  37  12.652   0.405   4.578
  287    HE1  TYR  37           HE1      TYR  37  12.204  -4.330   3.173
  288    HE2  TYR  37           HE2      TYR  37  14.676  -0.932   4.063
  289    HH   TYR  37           HH       TYR  37  14.571  -3.877   2.445
  290    H    GLY  38           H        GLY  38   8.664  -0.474   0.909
  291   1HA   GLY  38          1HA       GLY  38   5.910  -0.984   1.922
  292   2HA   GLY  38          2HA       GLY  38   6.333  -0.709   0.232
  293    H    TYR  39           H        TYR  39   5.063  -3.027   1.902
  294    HA   TYR  39           HA       TYR  39   6.046  -5.163   0.205
  295   1HB   TYR  39          1HB       TYR  39   7.012  -6.481   2.133
  296   2HB   TYR  39          2HB       TYR  39   7.938  -5.040   1.716
  297    HD1  TYR  39           HD1      TYR  39   7.668  -2.945   3.084
  298    HD2  TYR  39           HD2      TYR  39   5.946  -6.700   4.262
  299    HE1  TYR  39           HE1      TYR  39   7.381  -2.090   5.395
  300    HE2  TYR  39           HE2      TYR  39   5.659  -5.844   6.572
  301    HH   TYR  39           HH       TYR  39   5.624  -2.794   7.408
  302    H    CYS  40           H        CYS  40   4.990  -7.299   0.914
  303    HA   CYS  40           HA       CYS  40   2.195  -6.856   1.485
  304   1HB   CYS  40          1HB       CYS  40   2.849  -8.665   0.070
  305   2HB   CYS  40          2HB       CYS  40   4.009  -9.267   1.254
  306    H    TYR  41           H        TYR  41   1.754  -6.076   3.547
  307    HA   TYR  41           HA       TYR  41   2.795  -7.688   5.857
  308   1HB   TYR  41          1HB       TYR  41   3.623  -5.299   5.513
  309   2HB   TYR  41          2HB       TYR  41   1.971  -4.772   5.838
  310    HD1  TYR  41           HD1      TYR  41   4.344  -7.287   7.314
  311    HD2  TYR  41           HD2      TYR  41   1.629  -4.033   8.015
  312    HE1  TYR  41           HE1      TYR  41   4.772  -7.455   9.752
  313    HE2  TYR  41           HE2      TYR  41   2.055  -4.202  10.452
  314    HH   TYR  41           HH       TYR  41   2.832  -5.910  12.067
  315    H    GLY  42           H        GLY  42   1.157  -8.785   6.863
  316   1HA   GLY  42          1HA       GLY  42  -0.967  -9.235   7.768
  317   2HA   GLY  42          2HA       GLY  42  -1.356  -7.528   7.538
  318    H    PHE  43           H        PHE  43  -0.377  -9.911   5.090
  319    HA   PHE  43           HA       PHE  43  -1.474 -10.605   3.118
  320   1HB   PHE  43          1HB       PHE  43  -3.613 -10.237   5.195
  321   2HB   PHE  43          2HB       PHE  43  -4.081 -10.638   3.544
  322    HD1  PHE  43           HD1      PHE  43  -2.084 -12.426   2.558
  323    HD2  PHE  43           HD2      PHE  43  -3.691 -12.159   6.533
  324    HE1  PHE  43           HE1      PHE  43  -1.491 -14.799   2.956
  325    HE2  PHE  43           HE2      PHE  43  -3.097 -14.534   6.931
  326    HZ   PHE  43           HZ       PHE  43  -1.997 -15.854   5.143
  327    H    GLY  44           H        GLY  44  -0.853  -7.715   3.557
  328   1HA   GLY  44          1HA       GLY  44  -2.428  -6.665   1.326
  329   2HA   GLY  44          2HA       GLY  44  -2.729  -5.842   2.858
  330    H    CYS  45           H        CYS  45  -1.411  -4.793   0.407
  331    HA   CYS  45           HA       CYS  45   1.438  -4.606   0.872
  332   1HB   CYS  45          1HB       CYS  45  -0.531  -3.824  -1.044
  333   2HB   CYS  45          2HB       CYS  45   0.386  -2.384  -0.605
  334    H    TYR  46           H        TYR  46   2.169  -3.648   2.750
  335    HA   TYR  46           HA       TYR  46   0.842  -1.110   3.649
  336   1HB   TYR  46          1HB       TYR  46   0.870  -3.211   5.117
  337   2HB   TYR  46          2HB       TYR  46   2.613  -2.980   5.245
  338    HD1  TYR  46           HD1      TYR  46  -0.678  -1.355   5.881
  339    HD2  TYR  46           HD2      TYR  46   3.538  -1.343   6.705
  340    HE1  TYR  46           HE1      TYR  46  -1.034   0.328   7.669
  341    HE2  TYR  46           HE2      TYR  46   3.183   0.341   8.491
  342    HH   TYR  46           HH       TYR  46   1.400   1.138   9.940
  343    H    CYS  47           H        CYS  47   2.163   0.729   3.844
  344    HA   CYS  47           HA       CYS  47   5.084   0.324   3.271
  345   1HB   CYS  47          1HB       CYS  47   3.182   2.486   2.309
  346   2HB   CYS  47          2HB       CYS  47   4.913   2.447   1.975
  347    H    GLU  48           H        GLU  48   6.446   1.340   4.693
  348    HA   GLU  48           HA       GLU  48   5.216   3.142   6.746
  349   1HB   GLU  48          1HB       GLU  48   7.635   1.313   6.711
  350   2HB   GLU  48          2HB       GLU  48   7.270   2.405   8.048
  351   1HG   GLU  48          1HG       GLU  48   5.579   1.096   8.815
  352   2HG   GLU  48          2HG       GLU  48   4.990   0.747   7.189
  353    H    GLY  49           H        GLY  49   5.484   5.080   5.415
  354   1HA   GLY  49          1HA       GLY  49   7.678   6.679   5.845
  355   2HA   GLY  49          2HA       GLY  49   8.140   5.776   4.406
  356    H    LEU  50           H        LEU  50   5.112   5.714   3.732
  357    HA   LEU  50           HA       LEU  50   4.850   7.451   1.684
  358   1HB   LEU  50          1HB       LEU  50   2.816   6.989   3.885
  359   2HB   LEU  50          2HB       LEU  50   2.432   7.548   2.261
  360    HG   LEU  50           HG       LEU  50   2.111   5.334   1.846
  361   1HD1  LEU  50          1HD1      LEU  50   4.302   5.960   0.681
  362   2HD1  LEU  50          2HD1      LEU  50   5.116   5.067   1.966
  363   3HD1  LEU  50          3HD1      LEU  50   3.992   4.236   0.890
  364   1HD2  LEU  50          1HD2      LEU  50   2.984   5.116   4.476
  365   2HD2  LEU  50          2HD2      LEU  50   2.316   3.814   3.493
  366   3HD2  LEU  50          3HD2      LEU  50   4.062   4.043   3.584
  367    HA   PRO  51           HA       PRO  51   5.726  11.493   3.415
  368   1HB   PRO  51          1HB       PRO  51   4.451  12.660   1.092
  369   2HB   PRO  51          2HB       PRO  51   6.174  12.582   1.475
  370   1HG   PRO  51          1HG       PRO  51   4.771  11.099  -0.522
  371   2HG   PRO  51          2HG       PRO  51   6.477  10.969  -0.083
  372   1HD   PRO  51          1HD       PRO  51   4.366   9.065   0.429
  373   2HD   PRO  51          2HD       PRO  51   6.087   8.933   0.866
  374    H    ASP  52           H        ASP  52   4.348  13.471   3.930
  375    HA   ASP  52           HA       ASP  52   1.814  12.672   5.058
  376   1HB   ASP  52          1HB       ASP  52   3.422  14.406   5.913
  377   2HB   ASP  52          2HB       ASP  52   2.949  15.441   4.565
  378    H    SER  53           H        SER  53   2.727  13.995   1.957
  379    HA   SER  53           HA       SER  53   0.013  14.988   1.365
  380   1HB   SER  53          1HB       SER  53   2.271  14.663  -0.594
  381   2HB   SER  53          2HB       SER  53   1.055  15.931  -0.508
  382    HG   SER  53           HG       SER  53   3.376  16.241   0.334
  383    H    THR  54           H        THR  54   1.125  11.942   1.603
  384    HA   THR  54           HA       THR  54   0.006  10.953  -0.978
  385    HB   THR  54           HB       THR  54   0.999   9.005   0.971
  386    HG1  THR  54           HG1      THR  54   2.917   9.835   1.331
  387   1HG2  THR  54          1HG2      THR  54   0.878   9.385  -1.816
  388   2HG2  THR  54          2HG2      THR  54   2.595   9.369  -1.410
  389   3HG2  THR  54          3HG2      THR  54   1.569   8.008  -0.959
  390    H    GLN  55           H        GLN  55  -1.667   9.320  -0.954
  391    HA   GLN  55           HA       GLN  55  -3.471   9.519   1.413
  392   1HB   GLN  55          1HB       GLN  55  -4.011   9.990  -1.124
  393   2HB   GLN  55          2HB       GLN  55  -4.136   8.233  -1.224
  394   1HG   GLN  55          1HG       GLN  55  -6.336   8.921  -0.711
  395   2HG   GLN  55          2HG       GLN  55  -5.676   8.426   0.848
  396   1HE2  GLN  55          2HE2      GLN  55  -5.572  10.010   2.495
  397   2HE2  GLN  55          1HE2      GLN  55  -5.949  11.648   2.257
  398    H    THR  56           H        THR  56  -4.449   7.510   2.237
  399    HA   THR  56           HA       THR  56  -3.049   4.989   1.460
  400    HB   THR  56           HB       THR  56  -1.758   5.764   3.300
  401    HG1  THR  56           HG1      THR  56  -3.812   4.179   4.440
  402   1HG2  THR  56          1HG2      THR  56  -4.422   6.607   4.442
  403   2HG2  THR  56          2HG2      THR  56  -2.976   6.485   5.444
  404   3HG2  THR  56          3HG2      THR  56  -3.017   7.613   4.089
  405    H    TRP  57           H        TRP  57  -4.155   3.086   2.662
  406    HA   TRP  57           HA       TRP  57  -7.094   3.415   2.398
  407   1HB   TRP  57          1HB       TRP  57  -5.365   1.605   1.436
  408   2HB   TRP  57          2HB       TRP  57  -5.707   0.833   2.981
  409    HD1  TRP  57           HD1      TRP  57  -7.622   2.267  -0.055
  410    HE1  TRP  57           HE1      TRP  57  -9.801   0.918  -0.341
  411    HE3  TRP  57           HE3      TRP  57  -7.294  -0.805   4.006
  412    HZ2  TRP  57           HZ2      TRP  57 -11.217  -1.188   0.983
  413    HZ3  TRP  57           HZ3      TRP  57  -9.066  -2.471   4.473
  414    HH2  TRP  57           HH2      TRP  57 -11.026  -2.668   2.969
  415    HA   PRO  58           HA       PRO  58  -8.831   2.332   2.928
  416   1HB   PRO  58          1HB       PRO  58 -10.865   3.396   4.587
  417   2HB   PRO  58          2HB       PRO  58 -10.599   1.694   4.198
  418   1HG   PRO  58          1HG       PRO  58 -10.174   3.042   6.720
  419   2HG   PRO  58          2HG       PRO  58 -10.019   1.321   6.356
  420   1HD   PRO  58          1HD       PRO  58  -7.904   3.243   6.807
  421   2HD   PRO  58          2HD       PRO  58  -7.750   1.501   6.474
  422    H    LEU  59           H        LEU  59  -9.835   4.026   1.658
  423    HA   LEU  59           HA       LEU  59  -8.609   6.615   1.762
  424   1HB   LEU  59          1HB       LEU  59 -10.554   5.100   0.202
  425   2HB   LEU  59          2HB       LEU  59 -11.017   6.797   0.326
  426    HG   LEU  59           HG       LEU  59  -8.656   7.395  -0.361
  427   1HD1  LEU  59          1HD1      LEU  59  -8.571   4.415  -0.929
  428   2HD1  LEU  59          2HD1      LEU  59  -7.376   5.579  -1.501
  429   3HD1  LEU  59          3HD1      LEU  59  -7.566   5.289   0.228
  430   1HD2  LEU  59          1HD2      LEU  59 -10.843   6.371  -1.942
  431   2HD2  LEU  59          2HD2      LEU  59  -9.704   7.656  -2.342
  432   3HD2  LEU  59          3HD2      LEU  59  -9.314   5.980  -2.729
  433    HA   PRO  60           HA       PRO  60 -11.064   9.117   4.429
  434   1HB   PRO  60          1HB       PRO  60 -12.257  10.771   2.371
  435   2HB   PRO  60          2HB       PRO  60 -10.948  11.178   3.484
  436   1HG   PRO  60          1HG       PRO  60 -10.748  10.661   0.679
  437   2HG   PRO  60          2HG       PRO  60  -9.434  11.000   1.810
  438   1HD   PRO  60          1HD       PRO  60 -10.043   8.497   0.522
  439   2HD   PRO  60          2HD       PRO  60  -8.743   8.832   1.692
  440    H    ASN  61           H        ASN  61 -13.568  10.259   4.177
  441    HA   ASN  61           HA       ASN  61 -15.415   8.207   4.573
  442   1HB   ASN  61          1HB       ASN  61 -15.445  11.070   3.848
  443   2HB   ASN  61          2HB       ASN  61 -16.917  10.202   3.411
  444   1HD2  ASN  61          2HD2      ASN  61 -16.498  12.210   5.627
  445   2HD2  ASN  61          1HD2      ASN  61 -16.957  11.406   7.050
  446    H    LYS  62           H        LYS  62 -14.101   9.432   1.592
  447    HA   LYS  62           HA       LYS  62 -16.084   8.069  -0.119
  448   1HB   LYS  62          1HB       LYS  62 -14.748  10.314  -0.440
  449   2HB   LYS  62          2HB       LYS  62 -13.457   9.250  -0.999
  450   1HG   LYS  62          1HG       LYS  62 -15.177   8.203  -2.566
  451   2HG   LYS  62          2HG       LYS  62 -16.234   9.554  -2.155
  452   1HD   LYS  62          1HD       LYS  62 -13.497  10.367  -2.865
  453   2HD   LYS  62          2HD       LYS  62 -14.373   9.585  -4.182
  454   1HE   LYS  62          1HE       LYS  62 -15.402  11.577  -4.540
  455   2HE   LYS  62          2HE       LYS  62 -16.237  11.337  -2.992
  456   1HZ   LYS  62          1HZ       LYS  62 -13.450  12.235  -2.932
  457   2HZ   LYS  62          2HZ       LYS  62 -14.635  13.376  -3.360
  458   3HZ   LYS  62          3HZ       LYS  62 -14.722  12.587  -1.862
  459    H    THR  63           H        THR  63 -15.151   6.065   1.364
  460    HA   THR  63           HA       THR  63 -12.668   4.845   0.696
  461    HB   THR  63           HB       THR  63 -14.250   4.303   2.577
  462    HG1  THR  63           HG1      THR  63 -12.721   2.797   2.246
  463   1HG2  THR  63          1HG2      THR  63 -15.990   3.808   0.336
  464   2HG2  THR  63          2HG2      THR  63 -15.837   2.342   1.302
  465   3HG2  THR  63          3HG2      THR  63 -16.386   3.840   2.054
  466    H    CYS  64           H        CYS  64 -13.275   2.310  -0.193
  467    HA   CYS  64           HA       CYS  64 -13.863   2.807  -3.074
  468   1HB   CYS  64          1HB       CYS  64 -11.743   1.692  -2.045
  469   2HB   CYS  64          2HB       CYS  64 -12.780   0.282  -1.823
  Start of MODEL   17
    1   1H    LYS   1          1H        LYS   1   7.075   5.604   9.701
    2   2H    LYS   1          2H        LYS   1   6.928   6.318  11.233
    3   3H    LYS   1          3H        LYS   1   7.050   4.630  11.093
    4    HA   LYS   1           HA       LYS   1   4.761   5.173  11.524
    5   1HB   LYS   1          1HB       LYS   1   5.526   7.489  10.236
    6   2HB   LYS   1          2HB       LYS   1   4.474   6.732   9.039
    7   1HG   LYS   1          1HG       LYS   1   3.670   7.029  11.939
    8   2HG   LYS   1          2HG       LYS   1   3.320   8.264  10.730
    9   1HD   LYS   1          1HD       LYS   1   2.559   5.386  10.262
   10   2HD   LYS   1          2HD       LYS   1   1.507   6.463  11.180
   11   1HE   LYS   1          1HE       LYS   1   2.413   7.789   8.766
   12   2HE   LYS   1          2HE       LYS   1   1.630   6.245   8.373
   13   1HZ   LYS   1          1HZ       LYS   1   0.425   7.902  10.462
   14   2HZ   LYS   1          2HZ       LYS   1   0.215   8.400   8.854
   15   3HZ   LYS   1          3HZ       LYS   1  -0.319   6.863   9.342
   16    H    ASP   2           H        ASP   2   3.451   3.530  10.770
   17    HA   ASP   2           HA       ASP   2   4.073   2.412   8.055
   18   1HB   ASP   2          1HB       ASP   2   2.855   0.943  10.402
   19   2HB   ASP   2          2HB       ASP   2   3.671   0.261   8.996
   20    H    GLY   3           H        GLY   3   2.240   1.632   6.826
   21   1HA   GLY   3          1HA       GLY   3  -0.474   1.892   7.782
   22   2HA   GLY   3          2HA       GLY   3  -0.033   3.256   6.754
   23    H    TYR   4           H        TYR   4  -1.977   1.920   5.668
   24    HA   TYR   4           HA       TYR   4  -0.814  -0.115   3.806
   25   1HB   TYR   4          1HB       TYR   4  -3.572   0.510   4.876
   26   2HB   TYR   4          2HB       TYR   4  -3.361  -0.508   3.453
   27    HD1  TYR   4           HD1      TYR   4  -2.205  -2.679   3.611
   28    HD2  TYR   4           HD2      TYR   4  -2.903  -0.251   7.084
   29    HE1  TYR   4           HE1      TYR   4  -1.699  -4.621   5.068
   30    HE2  TYR   4           HE2      TYR   4  -2.399  -2.194   8.543
   31    HH   TYR   4           HH       TYR   4  -2.516  -5.174   7.737
   32    H    LEU   5           H        LEU   5  -0.652   0.462   1.651
   33    HA   LEU   5           HA       LEU   5  -1.458   3.178   0.855
   34   1HB   LEU   5          1HB       LEU   5   0.427   1.131   0.106
   35   2HB   LEU   5          2HB       LEU   5  -0.470   1.651  -1.322
   36    HG   LEU   5           HG       LEU   5   0.733   3.625   0.625
   37   1HD1  LEU   5          1HD1      LEU   5   2.216   1.838  -0.882
   38   2HD1  LEU   5          2HD1      LEU   5   2.127   3.257  -1.926
   39   3HD1  LEU   5          3HD1      LEU   5   2.787   3.400  -0.297
   40   1HD2  LEU   5          1HD2      LEU   5  -0.759   3.709  -1.911
   41   2HD2  LEU   5          2HD2      LEU   5  -0.544   4.966  -0.693
   42   3HD2  LEU   5          3HD2      LEU   5   0.699   4.700  -1.916
   43    H    VAL   6           H        VAL   6  -2.838   3.586  -1.006
   44    HA   VAL   6           HA       VAL   6  -4.928   1.478  -1.379
   45    HB   VAL   6           HB       VAL   6  -6.351   3.375  -1.980
   46   1HG1  VAL   6          1HG1      VAL   6  -4.953   3.127   0.528
   47   2HG1  VAL   6          2HG1      VAL   6  -5.318   4.824   0.220
   48   3HG1  VAL   6          3HG1      VAL   6  -6.617   3.632   0.236
   49   1HG2  VAL   6          1HG2      VAL   6  -3.897   4.543  -2.722
   50   2HG2  VAL   6          2HG2      VAL   6  -5.494   5.286  -2.815
   51   3HG2  VAL   6          3HG2      VAL   6  -4.495   5.520  -1.381
   52    H    GLU   7           H        GLU   7  -6.042   2.166  -3.733
   53    HA   GLU   7           HA       GLU   7  -3.803   1.885  -5.711
   54   1HB   GLU   7          1HB       GLU   7  -6.675   0.898  -5.736
   55   2HB   GLU   7          2HB       GLU   7  -5.500   0.619  -7.021
   56   1HG   GLU   7          1HG       GLU   7  -4.009  -0.420  -5.202
   57   2HG   GLU   7          2HG       GLU   7  -5.456  -0.437  -4.192
   58    H    LYS   8           H        LYS   8  -4.649   2.620  -8.002
   59    HA   LYS   8           HA       LYS   8  -5.076   5.392  -8.059
   60   1HB   LYS   8          1HB       LYS   8  -5.076   3.121  -9.856
   61   2HB   LYS   8          2HB       LYS   8  -6.325   4.273 -10.336
   62   1HG   LYS   8          1HG       LYS   8  -3.489   5.112  -9.698
   63   2HG   LYS   8          2HG       LYS   8  -4.015   4.689 -11.328
   64   1HD   LYS   8          1HD       LYS   8  -5.910   6.507 -10.131
   65   2HD   LYS   8          2HD       LYS   8  -4.286   7.190 -10.042
   66   1HE   LYS   8          1HE       LYS   8  -4.153   6.349 -12.565
   67   2HE   LYS   8          2HE       LYS   8  -5.917   6.505 -12.460
   68   1HZ   LYS   8          1HZ       LYS   8  -4.408   8.649 -11.227
   69   2HZ   LYS   8          2HZ       LYS   8  -4.273   8.571 -12.918
   70   3HZ   LYS   8          3HZ       LYS   8  -5.801   8.723 -12.197
   71    H    THR   9           H        THR   9  -7.540   2.811  -8.407
   72    HA   THR   9           HA       THR   9  -9.802   4.569  -8.554
   73    HB   THR   9           HB       THR   9 -10.998   2.418  -7.949
   74    HG1  THR   9           HG1      THR   9  -9.714   1.263  -6.717
   75   1HG2  THR   9          1HG2      THR   9  -9.061   2.805 -10.157
   76   2HG2  THR   9          2HG2      THR   9  -9.628   1.151  -9.918
   77   3HG2  THR   9          3HG2      THR   9 -10.787   2.445 -10.219
   78    H    GLY  10           H        GLY  10  -7.800   3.637  -5.896
   79   1HA   GLY  10          1HA       GLY  10  -8.020   4.871  -3.778
   80   2HA   GLY  10          2HA       GLY  10  -9.767   4.885  -4.025
   81    H    CYS  11           H        CYS  11  -9.591   2.005  -4.953
   82    HA   CYS  11           HA       CYS  11 -10.235   0.740  -2.467
   83   1HB   CYS  11          1HB       CYS  11  -9.308  -0.542  -5.054
   84   2HB   CYS  11          2HB       CYS  11 -10.386  -1.242  -3.846
   85    H    LYS  12           H        LYS  12  -8.957  -1.463  -1.963
   86    HA   LYS  12           HA       LYS  12  -6.159  -0.654  -1.399
   87   1HB   LYS  12          1HB       LYS  12  -6.306  -2.421   0.259
   88   2HB   LYS  12          2HB       LYS  12  -7.764  -1.445   0.357
   89   1HG   LYS  12          1HG       LYS  12  -8.897  -3.111  -1.147
   90   2HG   LYS  12          2HG       LYS  12  -7.459  -4.120  -1.028
   91   1HD   LYS  12          1HD       LYS  12  -7.726  -4.195   1.432
   92   2HD   LYS  12          2HD       LYS  12  -9.192  -3.223   1.291
   93   1HE   LYS  12          1HE       LYS  12 -10.401  -4.953   0.264
   94   2HE   LYS  12          2HE       LYS  12  -8.929  -5.786  -0.277
   95   1HZ   LYS  12          1HZ       LYS  12  -9.200  -5.336   2.588
   96   2HZ   LYS  12          2HZ       LYS  12 -10.240  -6.495   1.917
   97   3HZ   LYS  12          3HZ       LYS  12  -8.558  -6.670   1.754
   98    H    LYS  13           H        LYS  13  -4.996  -3.127  -1.117
   99    HA   LYS  13           HA       LYS  13  -5.218  -4.476  -3.779
  100   1HB   LYS  13          1HB       LYS  13  -3.493  -2.612  -3.726
  101   2HB   LYS  13          2HB       LYS  13  -2.629  -3.545  -2.505
  102   1HG   LYS  13          1HG       LYS  13  -3.317  -5.246  -4.738
  103   2HG   LYS  13          2HG       LYS  13  -2.443  -3.824  -5.309
  104   1HD   LYS  13          1HD       LYS  13  -0.832  -4.320  -3.311
  105   2HD   LYS  13          2HD       LYS  13  -1.546  -5.933  -3.356
  106   1HE   LYS  13          1HE       LYS  13   0.294  -6.152  -4.818
  107   2HE   LYS  13          2HE       LYS  13  -1.030  -5.784  -5.940
  108   1HZ   LYS  13          1HZ       LYS  13  -0.333  -3.335  -5.178
  109   2HZ   LYS  13          2HZ       LYS  13   1.179  -4.102  -5.073
  110   3HZ   LYS  13          3HZ       LYS  13   0.332  -4.102  -6.541
  111    H    THR  14           H        THR  14  -6.236  -6.100  -2.193
  112    HA   THR  14           HA       THR  14  -4.738  -7.359  -0.109
  113    HB   THR  14           HB       THR  14  -6.979  -8.266  -1.938
  114    HG1  THR  14           HG1      THR  14  -7.112  -7.704   0.810
  115   1HG2  THR  14          1HG2      THR  14  -5.337  -9.861  -0.234
  116   2HG2  THR  14          2HG2      THR  14  -6.923  -9.713   0.524
  117   3HG2  THR  14          3HG2      THR  14  -6.784 -10.347  -1.116
  118    H    CYS  15           H        CYS  15  -3.439  -9.244  -0.144
  119    HA   CYS  15           HA       CYS  15  -2.751 -10.398  -2.809
  120   1HB   CYS  15          1HB       CYS  15  -0.349 -10.123  -2.218
  121   2HB   CYS  15          2HB       CYS  15  -1.180  -8.571  -2.313
  122    H    TYR  16           H        TYR  16  -1.620 -12.499  -2.578
  123    HA   TYR  16           HA       TYR  16  -2.466 -13.917  -0.097
  124   1HB   TYR  16          1HB       TYR  16  -1.977 -14.555  -2.966
  125   2HB   TYR  16          2HB       TYR  16  -1.636 -15.840  -1.804
  126    HD1  TYR  16           HD1      TYR  16  -4.245 -13.146  -2.020
  127    HD2  TYR  16           HD2      TYR  16  -3.404 -17.343  -1.659
  128    HE1  TYR  16           HE1      TYR  16  -6.673 -13.614  -1.818
  129    HE2  TYR  16           HE2      TYR  16  -5.831 -17.811  -1.457
  130    HH   TYR  16           HH       TYR  16  -7.870 -16.710  -0.868
  131    H    LYS  17           H        LYS  17   0.390 -13.444  -2.195
  132    HA   LYS  17           HA       LYS  17   2.170 -14.973  -0.472
  133   1HB   LYS  17          1HB       LYS  17   2.283 -14.374  -3.010
  134   2HB   LYS  17          2HB       LYS  17   2.977 -12.849  -2.457
  135   1HG   LYS  17          1HG       LYS  17   4.969 -13.826  -2.092
  136   2HG   LYS  17          2HG       LYS  17   4.221 -15.048  -1.065
  137   1HD   LYS  17          1HD       LYS  17   5.391 -16.012  -3.061
  138   2HD   LYS  17          2HD       LYS  17   3.676 -16.416  -2.995
  139   1HE   LYS  17          1HE       LYS  17   3.126 -14.874  -4.712
  140   2HE   LYS  17          2HE       LYS  17   4.667 -14.010  -4.541
  141   1HZ   LYS  17          1HZ       LYS  17   4.563 -16.888  -5.220
  142   2HZ   LYS  17          2HZ       LYS  17   4.495 -15.693  -6.426
  143   3HZ   LYS  17          3HZ       LYS  17   5.854 -15.802  -5.418
  144    H    LEU  18           H        LEU  18   1.493 -13.782   1.567
  145    HA   LEU  18           HA       LEU  18   1.956 -11.027   2.050
  146   1HB   LEU  18          1HB       LEU  18   2.109 -13.506   3.787
  147   2HB   LEU  18          2HB       LEU  18   2.148 -11.867   4.439
  148    HG   LEU  18           HG       LEU  18  -0.061 -12.864   2.626
  149   1HD1  LEU  18          1HD1      LEU  18   0.031 -14.181   4.739
  150   2HD1  LEU  18          2HD1      LEU  18  -0.043 -12.676   5.654
  151   3HD1  LEU  18          3HD1      LEU  18  -1.407 -13.164   4.649
  152   1HD2  LEU  18          1HD2      LEU  18   0.655 -10.318   3.287
  153   2HD2  LEU  18          2HD2      LEU  18  -1.002 -10.804   2.932
  154   3HD2  LEU  18          3HD2      LEU  18  -0.455 -10.696   4.604
  155    H    GLY  19           H        GLY  19   3.781  -9.864   2.643
  156   1HA   GLY  19          1HA       GLY  19   6.027  -9.449   3.235
  157   2HA   GLY  19          2HA       GLY  19   6.283 -11.183   3.377
  158    H    GLU  20           H        GLU  20   8.104  -9.453   2.161
  159    HA   GLU  20           HA       GLU  20   9.128  -8.896   0.053
  160   1HB   GLU  20          1HB       GLU  20  10.167 -10.955  -0.676
  161   2HB   GLU  20          2HB       GLU  20   9.966 -11.033   1.074
  162   1HG   GLU  20          1HG       GLU  20   7.626 -12.041  -0.369
  163   2HG   GLU  20          2HG       GLU  20   9.093 -12.947  -0.736
  164    H    ASN  21           H        ASN  21   6.293  -8.621  -0.375
  165    HA   ASN  21           HA       ASN  21   5.669 -10.150  -2.826
  166   1HB   ASN  21          1HB       ASN  21   4.085  -9.466  -0.900
  167   2HB   ASN  21          2HB       ASN  21   4.125  -7.852  -1.610
  168   1HD2  ASN  21          2HD2      ASN  21   2.107 -10.364  -1.548
  169   2HD2  ASN  21          1HD2      ASN  21   1.520 -10.359  -3.141
  170    H    ASP  22           H        ASP  22   7.358  -9.302  -4.235
  171    HA   ASP  22           HA       ASP  22   8.195  -6.749  -4.763
  172   1HB   ASP  22          1HB       ASP  22   7.405  -9.022  -6.592
  173   2HB   ASP  22          2HB       ASP  22   8.183  -7.567  -7.209
  174    H    PHE  23           H        PHE  23   5.096  -8.147  -5.870
  175    HA   PHE  23           HA       PHE  23   4.119  -6.113  -7.505
  176   1HB   PHE  23          1HB       PHE  23   3.156  -8.347  -6.077
  177   2HB   PHE  23          2HB       PHE  23   2.106  -7.007  -5.616
  178    HD1  PHE  23           HD1      PHE  23   3.905  -7.751  -8.821
  179    HD2  PHE  23           HD2      PHE  23   0.128  -7.196  -6.852
  180    HE1  PHE  23           HE1      PHE  23   2.743  -7.900 -11.009
  181    HE2  PHE  23           HE2      PHE  23  -1.034  -7.343  -9.039
  182    HZ   PHE  23           HZ       PHE  23   0.274  -7.696 -11.116
  183    H    CYS  24           H        CYS  24   3.670  -6.277  -3.941
  184    HA   CYS  24           HA       CYS  24   2.500  -3.706  -3.623
  185   1HB   CYS  24          1HB       CYS  24   2.809  -5.718  -2.008
  186   2HB   CYS  24          2HB       CYS  24   4.379  -5.002  -1.646
  187    H    ASN  25           H        ASN  25   5.919  -4.676  -3.162
  188    HA   ASN  25           HA       ASN  25   7.047  -2.175  -2.612
  189   1HB   ASN  25          1HB       ASN  25   8.003  -4.578  -4.184
  190   2HB   ASN  25          2HB       ASN  25   9.068  -3.225  -3.800
  191   1HD2  ASN  25          2HD2      ASN  25   7.720  -6.145  -2.558
  192   2HD2  ASN  25          1HD2      ASN  25   8.253  -5.969  -0.956
  193    H    ARG  26           H        ARG  26   6.445  -3.633  -5.825
  194    HA   ARG  26           HA       ARG  26   7.501  -1.616  -7.468
  195   1HB   ARG  26          1HB       ARG  26   6.022  -3.937  -7.734
  196   2HB   ARG  26          2HB       ARG  26   4.910  -2.705  -8.335
  197   1HG   ARG  26          1HG       ARG  26   6.654  -1.865  -9.863
  198   2HG   ARG  26          2HG       ARG  26   7.773  -3.086  -9.260
  199   1HD   ARG  26          1HD       ARG  26   6.935  -4.149 -11.172
  200   2HD   ARG  26          2HD       ARG  26   5.811  -4.749  -9.941
  201    HE   ARG  26           HE       ARG  26   4.736  -2.306 -10.782
  202   1HH1  ARG  26          1HH1      ARG  26   5.667  -5.308 -12.217
  203   2HH1  ARG  26          2HH1      ARG  26   4.490  -5.214 -13.484
  204   1HH2  ARG  26          1HH2      ARG  26   3.195  -2.177 -12.428
  205   2HH2  ARG  26          2HH2      ARG  26   3.093  -3.444 -13.605
  206    H    GLU  27           H        GLU  27   4.300  -1.770  -5.901
  207    HA   GLU  27           HA       GLU  27   3.382   0.746  -7.056
  208   1HB   GLU  27          1HB       GLU  27   2.459  -1.386  -5.258
  209   2HB   GLU  27          2HB       GLU  27   1.869   0.210  -4.794
  210   1HG   GLU  27          1HG       GLU  27   1.696  -0.834  -7.629
  211   2HG   GLU  27          2HG       GLU  27   0.404  -1.057  -6.450
  212    H    CYS  28           H        CYS  28   4.756  -0.243  -3.910
  213    HA   CYS  28           HA       CYS  28   4.598   2.464  -2.800
  214   1HB   CYS  28          1HB       CYS  28   4.828  -0.145  -1.861
  215   2HB   CYS  28          2HB       CYS  28   6.413   0.549  -1.526
  216    H    LYS  29           H        LYS  29   6.496   1.341  -5.213
  217    HA   LYS  29           HA       LYS  29   9.012   2.580  -4.193
  218   1HB   LYS  29          1HB       LYS  29   8.260   0.419  -6.010
  219   2HB   LYS  29          2HB       LYS  29   9.465   1.495  -6.717
  220   1HG   LYS  29          1HG       LYS  29   9.731   0.372  -3.920
  221   2HG   LYS  29          2HG       LYS  29  10.395  -0.439  -5.339
  222   1HD   LYS  29          1HD       LYS  29  12.232   0.843  -4.983
  223   2HD   LYS  29          2HD       LYS  29  11.278   2.147  -5.690
  224   1HE   LYS  29          1HE       LYS  29  10.710   3.043  -3.581
  225   2HE   LYS  29          2HE       LYS  29  11.094   1.529  -2.737
  226   1HZ   LYS  29          1HZ       LYS  29  13.420   1.872  -3.720
  227   2HZ   LYS  29          2HZ       LYS  29  12.945   3.483  -3.952
  228   3HZ   LYS  29          3HZ       LYS  29  12.975   2.825  -2.386
  229    H    TRP  30           H        TRP  30   8.130   2.420  -7.601
  230    HA   TRP  30           HA       TRP  30   8.205   4.183  -9.211
  231   1HB   TRP  30          1HB       TRP  30   6.399   5.177  -6.991
  232   2HB   TRP  30          2HB       TRP  30   6.492   5.931  -8.581
  233    HD1  TRP  30           HD1      TRP  30   3.757   4.960  -8.035
  234    HE1  TRP  30           HE1      TRP  30   2.714   2.889  -9.148
  235    HE3  TRP  30           HE3      TRP  30   8.001   2.436  -9.435
  236    HZ2  TRP  30           HZ2      TRP  30   3.543   0.498 -10.455
  237    HZ3  TRP  30           HZ3      TRP  30   7.827   0.272 -10.611
  238    HH2  TRP  30           HH2      TRP  30   5.608  -0.701 -11.123
  239    H    LYS  31           H        LYS  31   7.701   6.562  -6.713
  240    HA   LYS  31           HA       LYS  31  10.515   7.507  -7.126
  241   1HB   LYS  31          1HB       LYS  31   7.830   8.798  -6.971
  242   2HB   LYS  31          2HB       LYS  31   9.185   9.695  -6.281
  243   1HG   LYS  31          1HG       LYS  31  10.431   9.285  -8.449
  244   2HG   LYS  31          2HG       LYS  31   8.925   8.656  -9.115
  245   1HD   LYS  31          1HD       LYS  31   8.397  10.778  -9.653
  246   2HD   LYS  31          2HD       LYS  31   8.196  11.079  -7.928
  247   1HE   LYS  31          1HE       LYS  31  11.003  11.145  -8.494
  248   2HE   LYS  31          2HE       LYS  31  10.178  12.183  -9.672
  249   1HZ   LYS  31          1HZ       LYS  31   9.127  12.338  -6.982
  250   2HZ   LYS  31          2HZ       LYS  31  10.718  12.909  -7.136
  251   3HZ   LYS  31          3HZ       LYS  31   9.483  13.584  -8.080
  252    H    HIS  32           H        HIS  32  11.443   8.647  -5.196
  253    HA   HIS  32           HA       HIS  32  11.319   7.083  -2.825
  254   1HB   HIS  32          1HB       HIS  32  12.534   9.573  -3.810
  255   2HB   HIS  32          2HB       HIS  32  12.279   9.563  -2.066
  256    HD1  HIS  32           HD1      HIS  32  13.782   8.069  -0.667
  257    HD2  HIS  32           HD2      HIS  32  14.210   7.378  -4.757
  258    HE1  HIS  32           HE1      HIS  32  15.761   6.510  -0.928
  259    H    ILE  33           H        ILE  33   9.860   7.085  -1.163
  260    HA   ILE  33           HA       ILE  33   7.878   9.322  -1.017
  261    HB   ILE  33           HB       ILE  33   7.770   6.580   0.265
  262   1HG1  ILE  33          1HG1      ILE  33   6.085   6.636  -1.986
  263   2HG1  ILE  33          2HG1      ILE  33   7.621   7.304  -2.541
  264   1HG2  ILE  33          1HG2      ILE  33   6.120   8.895   0.350
  265   2HG2  ILE  33          2HG2      ILE  33   5.260   7.679  -0.596
  266   3HG2  ILE  33          3HG2      ILE  33   5.790   7.307   1.045
  267   1HD1  ILE  33          1HD1      ILE  33   8.744   5.326  -1.382
  268   2HD1  ILE  33          2HD1      ILE  33   7.132   4.627  -1.226
  269   3HD1  ILE  33          3HD1      ILE  33   7.807   4.940  -2.825
  270    H    GLY  34           H        GLY  34  10.206   7.428   0.863
  271   1HA   GLY  34          1HA       GLY  34  11.086   9.336   2.617
  272   2HA   GLY  34          2HA       GLY  34   9.578   8.810   3.365
  273    H    GLY  35           H        GLY  35  11.830   6.795   1.522
  274   1HA   GLY  35          1HA       GLY  35  13.001   4.860   2.149
  275   2HA   GLY  35          2HA       GLY  35  13.223   5.643   3.715
  276    H    SER  36           H        SER  36  10.047   5.018   2.397
  277    HA   SER  36           HA       SER  36   9.260   3.532   4.766
  278   1HB   SER  36          1HB       SER  36   7.106   3.756   3.817
  279   2HB   SER  36          2HB       SER  36   7.967   5.169   3.214
  280    HG   SER  36           HG       SER  36   6.738   3.502   1.753
  281    H    TYR  37           H        TYR  37   9.615   1.360   5.027
  282    HA   TYR  37           HA       TYR  37  10.503  -0.367   2.862
  283   1HB   TYR  37          1HB       TYR  37  10.716  -0.338   5.564
  284   2HB   TYR  37          2HB       TYR  37   9.375  -1.470   5.390
  285    HD1  TYR  37           HD1      TYR  37  12.585  -0.783   3.553
  286    HD2  TYR  37           HD2      TYR  37  10.018  -3.698   5.386
  287    HE1  TYR  37           HE1      TYR  37  14.179  -2.578   2.929
  288    HE2  TYR  37           HE2      TYR  37  11.610  -5.494   4.760
  289    HH   TYR  37           HH       TYR  37  14.029  -5.100   2.508
  290    H    GLY  38           H        GLY  38   9.168  -1.484   1.452
  291   1HA   GLY  38          1HA       GLY  38   6.256  -1.529   2.108
  292   2HA   GLY  38          2HA       GLY  38   6.913  -1.580   0.475
  293    H    TYR  39           H        TYR  39   5.196  -3.426   2.300
  294    HA   TYR  39           HA       TYR  39   6.116  -5.917   1.109
  295   1HB   TYR  39          1HB       TYR  39   6.487  -7.007   3.369
  296   2HB   TYR  39          2HB       TYR  39   7.703  -5.806   2.934
  297    HD1  TYR  39           HD1      TYR  39   7.595  -3.505   3.915
  298    HD2  TYR  39           HD2      TYR  39   5.024  -6.682   5.232
  299    HE1  TYR  39           HE1      TYR  39   7.070  -2.225   5.974
  300    HE2  TYR  39           HE2      TYR  39   4.496  -5.402   7.290
  301    HH   TYR  39           HH       TYR  39   4.759  -3.485   8.378
  302    H    CYS  40           H        CYS  40   4.434  -7.497   1.224
  303    HA   CYS  40           HA       CYS  40   1.783  -6.432   1.815
  304   1HB   CYS  40          1HB       CYS  40   3.012  -8.478   0.267
  305   2HB   CYS  40          2HB       CYS  40   1.831  -9.260   1.317
  306    H    TYR  41           H        TYR  41   0.718  -6.622   3.725
  307    HA   TYR  41           HA       TYR  41   1.233  -8.951   5.498
  308   1HB   TYR  41          1HB       TYR  41   2.373  -6.359   5.830
  309   2HB   TYR  41          2HB       TYR  41   1.142  -6.550   7.079
  310    HD1  TYR  41           HD1      TYR  41   4.029  -8.330   5.499
  311    HD2  TYR  41           HD2      TYR  41   1.593  -7.825   9.002
  312    HE1  TYR  41           HE1      TYR  41   5.547  -9.824   6.772
  313    HE2  TYR  41           HE2      TYR  41   3.111  -9.318  10.274
  314    HH   TYR  41           HH       TYR  41   4.773 -11.283   9.564
  315    H    GLY  42           H        GLY  42  -0.732  -9.653   6.268
  316   1HA   GLY  42          1HA       GLY  42  -2.957  -9.541   7.067
  317   2HA   GLY  42          2HA       GLY  42  -2.854  -7.781   6.995
  318    H    PHE  43           H        PHE  43  -2.107  -9.895   4.293
  319    HA   PHE  43           HA       PHE  43  -3.057 -10.016   2.137
  320   1HB   PHE  43          1HB       PHE  43  -5.452  -9.706   3.968
  321   2HB   PHE  43          2HB       PHE  43  -5.596 -10.099   2.254
  322    HD1  PHE  43           HD1      PHE  43  -4.378 -12.170   1.372
  323    HD2  PHE  43           HD2      PHE  43  -4.931 -11.385   5.559
  324    HE1  PHE  43           HE1      PHE  43  -3.925 -14.554   1.878
  325    HE2  PHE  43           HE2      PHE  43  -4.472 -13.770   6.066
  326    HZ   PHE  43           HZ       PHE  43  -3.969 -15.354   4.225
  327    H    GLY  44           H        GLY  44  -1.946  -7.598   2.478
  328   1HA   GLY  44          1HA       GLY  44  -3.430  -5.862   0.766
  329   2HA   GLY  44          2HA       GLY  44  -3.595  -5.296   2.430
  330    H    CYS  45           H        CYS  45  -2.204  -3.865   0.341
  331    HA   CYS  45           HA       CYS  45   0.654  -4.261   0.576
  332   1HB   CYS  45          1HB       CYS  45  -1.259  -2.567  -0.788
  333   2HB   CYS  45          2HB       CYS  45   0.076  -1.598  -0.165
  334    H    TYR  46           H        TYR  46   1.970  -3.597   2.226
  335    HA   TYR  46           HA       TYR  46   1.001  -1.409   4.029
  336   1HB   TYR  46          1HB       TYR  46   0.738  -3.847   4.820
  337   2HB   TYR  46          2HB       TYR  46   2.499  -3.887   4.899
  338    HD1  TYR  46           HD1      TYR  46  -0.279  -1.561   5.901
  339    HD2  TYR  46           HD2      TYR  46   3.434  -3.429   6.978
  340    HE1  TYR  46           HE1      TYR  46  -0.360  -0.444   8.116
  341    HE2  TYR  46           HE2      TYR  46   3.352  -2.315   9.195
  342    HH   TYR  46           HH       TYR  46   2.286  -0.844  10.471
  343    H    CYS  47           H        CYS  47   2.529   0.218   4.079
  344    HA   CYS  47           HA       CYS  47   5.367  -0.539   3.453
  345   1HB   CYS  47          1HB       CYS  47   3.541   1.397   2.379
  346   2HB   CYS  47          2HB       CYS  47   4.886   2.256   3.130
  347    H    GLU  48           H        GLU  48   7.023   0.805   4.603
  348    HA   GLU  48           HA       GLU  48   6.044   1.630   7.321
  349   1HB   GLU  48          1HB       GLU  48   7.942  -0.289   6.417
  350   2HB   GLU  48          2HB       GLU  48   8.845   0.997   7.220
  351   1HG   GLU  48          1HG       GLU  48   6.613   0.586   8.854
  352   2HG   GLU  48          2HG       GLU  48   7.122  -1.036   8.385
  353    H    GLY  49           H        GLY  49   5.859   3.744   5.766
  354   1HA   GLY  49          1HA       GLY  49   7.618   5.688   6.744
  355   2HA   GLY  49          2HA       GLY  49   8.315   5.158   5.219
  356    H    LEU  50           H        LEU  50   4.904   5.553   6.149
  357    HA   LEU  50           HA       LEU  50   4.496   7.199   3.700
  358   1HB   LEU  50          1HB       LEU  50   2.364   6.175   5.568
  359   2HB   LEU  50          2HB       LEU  50   2.258   6.466   3.833
  360    HG   LEU  50           HG       LEU  50   3.735   4.224   5.235
  361   1HD1  LEU  50          1HD1      LEU  50   1.139   4.342   4.502
  362   2HD1  LEU  50          2HD1      LEU  50   1.845   3.809   2.977
  363   3HD1  LEU  50          3HD1      LEU  50   2.078   2.851   4.440
  364   1HD2  LEU  50          1HD2      LEU  50   4.331   5.550   2.736
  365   2HD2  LEU  50          2HD2      LEU  50   5.177   4.204   3.501
  366   3HD2  LEU  50          3HD2      LEU  50   3.814   3.892   2.426
  367    HA   PRO  51           HA       PRO  51   4.638  10.682   6.621
  368   1HB   PRO  51          1HB       PRO  51   3.956  12.332   4.337
  369   2HB   PRO  51          2HB       PRO  51   5.489  12.245   5.211
  370   1HG   PRO  51          1HG       PRO  51   4.932  11.248   2.599
  371   2HG   PRO  51          2HG       PRO  51   6.428  11.071   3.519
  372   1HD   PRO  51          1HD       PRO  51   4.475   9.032   2.892
  373   2HD   PRO  51          2HD       PRO  51   6.002   8.850   3.791
  374    H    ASP  52           H        ASP  52   2.949  12.322   7.228
  375    HA   ASP  52           HA       ASP  52   0.286  11.198   7.183
  376   1HB   ASP  52          1HB       ASP  52   1.802  13.167   8.560
  377   2HB   ASP  52          2HB       ASP  52   0.374  13.983   7.922
  378    H    SER  53           H        SER  53   1.967  13.550   5.199
  379    HA   SER  53           HA       SER  53  -0.439  14.740   4.049
  380   1HB   SER  53          1HB       SER  53   2.518  14.857   3.734
  381   2HB   SER  53          2HB       SER  53   1.561  15.365   2.346
  382    HG   SER  53           HG       SER  53   0.421  16.758   3.805
  383    H    THR  54           H        THR  54   0.969  11.712   3.665
  384    HA   THR  54           HA       THR  54   0.407  11.495   0.761
  385    HB   THR  54           HB       THR  54   1.107   9.043   2.153
  386    HG1  THR  54           HG1      THR  54   2.398   9.850   3.576
  387   1HG2  THR  54          1HG2      THR  54   2.224  10.809   0.004
  388   2HG2  THR  54          2HG2      THR  54   3.227   9.522   0.672
  389   3HG2  THR  54          3HG2      THR  54   1.689   9.131  -0.097
  390    H    GLN  55           H        GLN  55  -0.951   9.622   0.027
  391    HA   GLN  55           HA       GLN  55  -3.450   9.487   1.592
  392   1HB   GLN  55          1HB       GLN  55  -2.587   9.358  -1.133
  393   2HB   GLN  55          2HB       GLN  55  -3.445   7.863  -0.766
  394   1HG   GLN  55          1HG       GLN  55  -4.468  10.689  -0.385
  395   2HG   GLN  55          2HG       GLN  55  -5.071   9.487  -1.525
  396   1HE2  GLN  55          2HE2      GLN  55  -6.273   7.628  -0.631
  397   2HE2  GLN  55          1HE2      GLN  55  -6.947   7.704   0.925
  398    H    THR  56           H        THR  56  -3.792   7.835   3.026
  399    HA   THR  56           HA       THR  56  -2.425   5.217   2.507
  400    HB   THR  56           HB       THR  56  -2.677   5.339   5.223
  401    HG1  THR  56           HG1      THR  56  -3.171   7.338   5.648
  402   1HG2  THR  56          1HG2      THR  56  -0.650   5.018   3.575
  403   2HG2  THR  56          2HG2      THR  56  -0.339   6.714   3.947
  404   3HG2  THR  56          3HG2      THR  56  -0.359   5.516   5.242
  405    H    TRP  57           H        TRP  57  -3.794   3.467   2.568
  406    HA   TRP  57           HA       TRP  57  -6.614   3.693   2.610
  407   1HB   TRP  57          1HB       TRP  57  -4.882   1.842   1.875
  408   2HB   TRP  57          2HB       TRP  57  -5.140   1.233   3.506
  409    HD1  TRP  57           HD1      TRP  57  -6.924   1.795   0.186
  410    HE1  TRP  57           HE1      TRP  57  -9.132   0.467   0.186
  411    HE3  TRP  57           HE3      TRP  57  -7.001   0.208   5.038
  412    HZ2  TRP  57           HZ2      TRP  57 -10.723  -1.064   2.002
  413    HZ3  TRP  57           HZ3      TRP  57  -8.874  -1.183   5.875
  414    HH2  TRP  57           HH2      TRP  57 -10.733  -1.821   4.365
  415    HA   PRO  58           HA       PRO  58  -8.385   2.676   3.148
  416   1HB   PRO  58          1HB       PRO  58 -10.530   3.893   4.504
  417   2HB   PRO  58          2HB       PRO  58 -10.198   2.160   4.413
  418   1HG   PRO  58          1HG       PRO  58  -9.936   3.939   6.698
  419   2HG   PRO  58          2HG       PRO  58  -9.819   2.179   6.647
  420   1HD   PRO  58          1HD       PRO  58  -7.671   4.079   6.929
  421   2HD   PRO  58          2HD       PRO  58  -7.551   2.303   6.845
  422    H    LEU  59           H        LEU  59  -9.884   4.315   1.980
  423    HA   LEU  59           HA       LEU  59  -8.456   6.873   1.697
  424   1HB   LEU  59          1HB       LEU  59 -10.204   5.118   0.197
  425   2HB   LEU  59          2HB       LEU  59 -10.814   6.773   0.136
  426    HG   LEU  59           HG       LEU  59  -8.391   7.456  -0.421
  427   1HD1  LEU  59          1HD1      LEU  59  -8.212   4.516  -0.319
  428   2HD1  LEU  59          2HD1      LEU  59  -7.524   5.229  -1.779
  429   3HD1  LEU  59          3HD1      LEU  59  -6.933   5.725  -0.192
  430   1HD2  LEU  59          1HD2      LEU  59 -10.404   6.088  -2.129
  431   2HD2  LEU  59          2HD2      LEU  59  -9.727   7.710  -2.272
  432   3HD2  LEU  59          3HD2      LEU  59  -8.808   6.317  -2.843
  433    HA   PRO  60           HA       PRO  60 -11.144   9.608   3.862
  434   1HB   PRO  60          1HB       PRO  60 -12.177  11.015   1.556
  435   2HB   PRO  60          2HB       PRO  60 -10.949  11.549   2.708
  436   1HG   PRO  60          1HG       PRO  60 -10.548  10.744   0.000
  437   2HG   PRO  60          2HG       PRO  60  -9.315  11.188   1.184
  438   1HD   PRO  60          1HD       PRO  60  -9.891   8.560   0.121
  439   2HD   PRO  60          2HD       PRO  60  -8.635   9.014   1.299
  440    H    ASN  61           H        ASN  61 -13.602  10.716   3.264
  441    HA   ASN  61           HA       ASN  61 -15.491   8.711   3.759
  442   1HB   ASN  61          1HB       ASN  61 -15.407  11.504   2.901
  443   2HB   ASN  61          2HB       ASN  61 -16.815  10.661   2.252
  444   1HD2  ASN  61          2HD2      ASN  61 -18.583  10.726   3.646
  445   2HD2  ASN  61          1HD2      ASN  61 -18.490  10.805   5.339
  446    H    LYS  62           H        LYS  62 -13.982   9.627   0.759
  447    HA   LYS  62           HA       LYS  62 -15.915   8.238  -0.965
  448   1HB   LYS  62          1HB       LYS  62 -13.202   9.541  -1.299
  449   2HB   LYS  62          2HB       LYS  62 -14.029   8.753  -2.643
  450   1HG   LYS  62          1HG       LYS  62 -15.678  10.361  -2.753
  451   2HG   LYS  62          2HG       LYS  62 -15.588  10.722  -1.028
  452   1HD   LYS  62          1HD       LYS  62 -13.181  11.603  -1.633
  453   2HD   LYS  62          2HD       LYS  62 -13.846  11.719  -3.261
  454   1HE   LYS  62          1HE       LYS  62 -14.282  13.852  -2.273
  455   2HE   LYS  62          2HE       LYS  62 -15.826  12.985  -2.147
  456   1HZ   LYS  62          1HZ       LYS  62 -15.028  12.166   0.059
  457   2HZ   LYS  62          2HZ       LYS  62 -13.739  13.261  -0.054
  458   3HZ   LYS  62          3HZ       LYS  62 -15.337  13.834   0.002
  459    H    THR  63           H        THR  63 -15.181   6.394   0.916
  460    HA   THR  63           HA       THR  63 -12.828   4.855   0.359
  461    HB   THR  63           HB       THR  63 -14.047   4.652   2.429
  462    HG1  THR  63           HG1      THR  63 -14.144   2.464   2.533
  463   1HG2  THR  63          1HG2      THR  63 -16.295   4.899   0.810
  464   2HG2  THR  63          2HG2      THR  63 -16.387   3.242   1.402
  465   3HG2  THR  63          3HG2      THR  63 -16.304   4.583   2.545
  466    H    CYS  64           H        CYS  64 -13.115   2.459  -0.324
  467    HA   CYS  64           HA       CYS  64 -14.474   2.431  -2.977
  468   1HB   CYS  64          1HB       CYS  64 -12.061   1.943  -2.813
  469   2HB   CYS  64          2HB       CYS  64 -12.397   0.627  -1.690
  Start of MODEL   18
    1   1H    LYS   1          1H        LYS   1   6.231   4.920  10.236
    2   2H    LYS   1          2H        LYS   1   5.917   6.589  10.151
    3   3H    LYS   1          3H        LYS   1   5.823   5.784  11.640
    4    HA   LYS   1           HA       LYS   1   3.755   4.993  11.259
    5   1HB   LYS   1          1HB       LYS   1   4.311   7.553  10.250
    6   2HB   LYS   1          2HB       LYS   1   3.285   6.801   9.027
    7   1HG   LYS   1          1HG       LYS   1   2.627   6.787  11.981
    8   2HG   LYS   1          2HG       LYS   1   2.023   8.008  10.860
    9   1HD   LYS   1          1HD       LYS   1   1.607   5.022  10.528
   10   2HD   LYS   1          2HD       LYS   1   0.410   6.127  11.204
   11   1HE   LYS   1          1HE       LYS   1   1.108   7.405   8.855
   12   2HE   LYS   1          2HE       LYS   1   1.153   5.692   8.392
   13   1HZ   LYS   1          1HZ       LYS   1  -1.004   5.730   9.947
   14   2HZ   LYS   1          2HZ       LYS   1  -1.089   7.302   9.308
   15   3HZ   LYS   1          3HZ       LYS   1  -1.071   5.959   8.267
   16    H    ASP   2           H        ASP   2   2.633   3.426  10.113
   17    HA   ASP   2           HA       ASP   2   3.653   2.764   7.367
   18   1HB   ASP   2          1HB       ASP   2   2.396   0.895   9.396
   19   2HB   ASP   2          2HB       ASP   2   3.320   0.458   7.958
   20    H    GLY   3           H        GLY   3   2.077   2.352   5.776
   21   1HA   GLY   3          1HA       GLY   3  -0.780   2.422   6.599
   22   2HA   GLY   3          2HA       GLY   3  -0.222   3.604   5.412
   23    H    TYR   4           H        TYR   4  -2.176   1.942   4.550
   24    HA   TYR   4           HA       TYR   4  -0.842  -0.296   3.095
   25   1HB   TYR   4          1HB       TYR   4  -3.641   0.445   3.902
   26   2HB   TYR   4          2HB       TYR   4  -3.394  -0.697   2.579
   27    HD1  TYR   4           HD1      TYR   4  -2.197  -2.832   2.959
   28    HD2  TYR   4           HD2      TYR   4  -3.109  -0.139   6.180
   29    HE1  TYR   4           HE1      TYR   4  -1.733  -4.634   4.598
   30    HE2  TYR   4           HE2      TYR   4  -2.646  -1.942   7.818
   31    HH   TYR   4           HH       TYR   4  -2.733  -4.654   7.634
   32    H    LEU   5           H        LEU   5  -1.822  -0.599   0.791
   33    HA   LEU   5           HA       LEU   5  -1.677   2.042  -0.597
   34   1HB   LEU   5          1HB       LEU   5  -0.521  -0.566  -0.928
   35   2HB   LEU   5          2HB       LEU   5  -1.483  -0.196  -2.357
   36    HG   LEU   5           HG       LEU   5   0.859   1.338  -1.226
   37   1HD1  LEU   5          1HD1      LEU   5   0.181  -0.204  -3.675
   38   2HD1  LEU   5          2HD1      LEU   5   1.178   1.232  -3.899
   39   3HD1  LEU   5          3HD1      LEU   5   1.717  -0.060  -2.829
   40   1HD2  LEU   5          1HD2      LEU   5  -1.371   2.302  -3.014
   41   2HD2  LEU   5          2HD2      LEU   5  -0.624   3.127  -1.647
   42   3HD2  LEU   5          3HD2      LEU   5   0.251   2.971  -3.168
   43    H    VAL   6           H        VAL   6  -3.122   2.346  -2.461
   44    HA   VAL   6           HA       VAL   6  -5.706   0.868  -2.149
   45    HB   VAL   6           HB       VAL   6  -6.736   2.935  -2.924
   46   1HG1  VAL   6          1HG1      VAL   6  -4.876   2.870  -0.667
   47   2HG1  VAL   6          2HG1      VAL   6  -5.195   4.503  -1.240
   48   3HG1  VAL   6          3HG1      VAL   6  -6.532   3.470  -0.736
   49   1HG2  VAL   6          1HG2      VAL   6  -3.877   3.664  -3.549
   50   2HG2  VAL   6          2HG2      VAL   6  -5.288   3.741  -4.602
   51   3HG2  VAL   6          3HG2      VAL   6  -5.093   4.916  -3.303
   52    H    GLU   7           H        GLU   7  -6.946   1.435  -4.478
   53    HA   GLU   7           HA       GLU   7  -5.211   0.113  -6.521
   54   1HB   GLU   7          1HB       GLU   7  -7.652  -0.544  -5.550
   55   2HB   GLU   7          2HB       GLU   7  -8.143   0.486  -6.895
   56   1HG   GLU   7          1HG       GLU   7  -6.497  -0.898  -8.318
   57   2HG   GLU   7          2HG       GLU   7  -6.502  -2.048  -6.982
   58    H    LYS   8           H        LYS   8  -5.807   0.864  -8.863
   59    HA   LYS   8           HA       LYS   8  -5.068   3.517  -9.328
   60   1HB   LYS   8          1HB       LYS   8  -5.571   1.384 -10.853
   61   2HB   LYS   8          2HB       LYS   8  -7.099   2.226 -11.113
   62   1HG   LYS   8          1HG       LYS   8  -5.437   4.302 -11.466
   63   2HG   LYS   8          2HG       LYS   8  -4.343   3.004 -11.943
   64   1HD   LYS   8          1HD       LYS   8  -6.942   2.551 -13.108
   65   2HD   LYS   8          2HD       LYS   8  -6.391   4.180 -13.504
   66   1HE   LYS   8          1HE       LYS   8  -4.448   1.900 -13.766
   67   2HE   LYS   8          2HE       LYS   8  -5.655   2.163 -15.040
   68   1HZ   LYS   8          1HZ       LYS   8  -3.957   4.327 -13.925
   69   2HZ   LYS   8          2HZ       LYS   8  -3.551   3.458 -15.327
   70   3HZ   LYS   8          3HZ       LYS   8  -4.960   4.402 -15.294
   71    H    THR   9           H        THR   9  -8.186   2.282  -8.344
   72    HA   THR   9           HA       THR   9  -9.506   4.891  -8.889
   73    HB   THR   9           HB       THR   9 -11.527   3.590  -8.520
   74    HG1  THR   9           HG1      THR   9  -9.904   1.378  -7.890
   75   1HG2  THR   9          1HG2      THR   9  -9.847   3.200 -10.583
   76   2HG2  THR   9          2HG2      THR   9  -9.880   1.562  -9.934
   77   3HG2  THR   9          3HG2      THR   9 -11.380   2.339 -10.437
   78    H    GLY  10           H        GLY  10  -8.242   2.917  -6.299
   79   1HA   GLY  10          1HA       GLY  10  -7.726   4.363  -4.242
   80   2HA   GLY  10          2HA       GLY  10  -9.438   4.786  -4.295
   81    H    CYS  11           H        CYS  11  -9.703   1.796  -5.291
   82    HA   CYS  11           HA       CYS  11 -10.714   0.684  -2.893
   83   1HB   CYS  11          1HB       CYS  11  -9.798  -0.312  -5.564
   84   2HB   CYS  11          2HB       CYS  11 -10.175  -1.500  -4.315
   85    H    LYS  12           H        LYS  12  -9.594  -1.757  -2.440
   86    HA   LYS  12           HA       LYS  12  -7.085  -1.059  -1.050
   87   1HB   LYS  12          1HB       LYS  12  -8.679  -3.635  -1.123
   88   2HB   LYS  12          2HB       LYS  12  -7.534  -3.126   0.117
   89   1HG   LYS  12          1HG       LYS  12  -9.157  -2.019   1.208
   90   2HG   LYS  12          2HG       LYS  12  -9.497  -1.065  -0.235
   91   1HD   LYS  12          1HD       LYS  12 -10.514  -3.764  -0.530
   92   2HD   LYS  12          2HD       LYS  12 -11.164  -3.004   0.924
   93   1HE   LYS  12          1HE       LYS  12 -12.498  -1.644  -0.305
   94   2HE   LYS  12          2HE       LYS  12 -11.136  -1.143  -1.327
   95   1HZ   LYS  12          1HZ       LYS  12 -12.014  -3.888  -1.660
   96   2HZ   LYS  12          2HZ       LYS  12 -13.119  -2.712  -2.190
   97   3HZ   LYS  12          3HZ       LYS  12 -11.550  -2.748  -2.831
   98    H    LYS  13           H        LYS  13  -5.739  -3.421  -0.994
   99    HA   LYS  13           HA       LYS  13  -5.319  -4.482  -3.712
  100   1HB   LYS  13          1HB       LYS  13  -4.139  -2.187  -3.393
  101   2HB   LYS  13          2HB       LYS  13  -3.036  -3.064  -2.330
  102   1HG   LYS  13          1HG       LYS  13  -2.041  -3.103  -4.511
  103   2HG   LYS  13          2HG       LYS  13  -2.701  -4.716  -4.237
  104   1HD   LYS  13          1HD       LYS  13  -4.666  -4.204  -5.560
  105   2HD   LYS  13          2HD       LYS  13  -4.173  -2.518  -5.714
  106   1HE   LYS  13          1HE       LYS  13  -3.095  -3.105  -7.621
  107   2HE   LYS  13          2HE       LYS  13  -1.959  -4.023  -6.614
  108   1HZ   LYS  13          1HZ       LYS  13  -4.120  -5.623  -6.627
  109   2HZ   LYS  13          2HZ       LYS  13  -4.196  -4.968  -8.190
  110   3HZ   LYS  13          3HZ       LYS  13  -2.800  -5.795  -7.681
  111    H    THR  14           H        THR  14  -6.035  -6.223  -1.972
  112    HA   THR  14           HA       THR  14  -4.057  -7.107  -0.044
  113    HB   THR  14           HB       THR  14  -6.526  -8.325  -1.307
  114    HG1  THR  14           HG1      THR  14  -6.117  -7.524   1.361
  115   1HG2  THR  14          1HG2      THR  14  -4.429  -9.650   0.104
  116   2HG2  THR  14          2HG2      THR  14  -5.832  -9.569   1.169
  117   3HG2  THR  14          3HG2      THR  14  -5.976 -10.313  -0.422
  118    H    CYS  15           H        CYS  15  -2.592  -8.831  -0.228
  119    HA   CYS  15           HA       CYS  15  -2.105  -9.842  -3.010
  120   1HB   CYS  15          1HB       CYS  15   0.232  -9.918  -2.356
  121   2HB   CYS  15          2HB       CYS  15  -0.400  -8.340  -1.889
  122    H    TYR  16           H        TYR  16  -1.253 -12.115  -3.082
  123    HA   TYR  16           HA       TYR  16  -2.664 -13.820  -1.115
  124   1HB   TYR  16          1HB       TYR  16  -1.139 -14.342  -3.685
  125   2HB   TYR  16          2HB       TYR  16  -1.970 -15.593  -2.763
  126    HD1  TYR  16           HD1      TYR  16  -4.448 -14.520  -1.915
  127    HD2  TYR  16           HD2      TYR  16  -2.354 -13.750  -5.585
  128    HE1  TYR  16           HE1      TYR  16  -6.588 -13.905  -3.007
  129    HE2  TYR  16           HE2      TYR  16  -4.493 -13.133  -6.677
  130    HH   TYR  16           HH       TYR  16  -7.533 -13.779  -5.266
  131    H    LYS  17           H        LYS  17   0.654 -13.487  -2.425
  132    HA   LYS  17           HA       LYS  17   1.728 -15.190  -0.256
  133   1HB   LYS  17          1HB       LYS  17   2.345 -14.786  -2.888
  134   2HB   LYS  17          2HB       LYS  17   3.517 -13.723  -2.109
  135   1HG   LYS  17          1HG       LYS  17   4.637 -15.795  -2.200
  136   2HG   LYS  17          2HG       LYS  17   4.007 -15.740  -0.554
  137   1HD   LYS  17          1HD       LYS  17   2.187 -17.194  -1.103
  138   2HD   LYS  17          2HD       LYS  17   2.495 -17.035  -2.832
  139   1HE   LYS  17          1HE       LYS  17   4.901 -17.954  -1.531
  140   2HE   LYS  17          2HE       LYS  17   3.546 -19.015  -1.097
  141   1HZ   LYS  17          1HZ       LYS  17   4.009 -18.072  -3.867
  142   2HZ   LYS  17          2HZ       LYS  17   4.676 -19.518  -3.285
  143   3HZ   LYS  17          3HZ       LYS  17   2.989 -19.326  -3.347
  144    H    LEU  18           H        LEU  18   2.797 -14.360   1.534
  145    HA   LEU  18           HA       LEU  18   2.861 -11.392   1.812
  146   1HB   LEU  18          1HB       LEU  18   3.114 -13.664   3.807
  147   2HB   LEU  18          2HB       LEU  18   3.010 -11.950   4.216
  148    HG   LEU  18           HG       LEU  18   0.900 -13.380   2.585
  149   1HD1  LEU  18          1HD1      LEU  18   1.354 -14.130   5.090
  150   2HD1  LEU  18          2HD1      LEU  18   0.500 -12.632   5.457
  151   3HD1  LEU  18          3HD1      LEU  18  -0.294 -13.887   4.509
  152   1HD2  LEU  18          1HD2      LEU  18   1.325 -10.753   2.719
  153   2HD2  LEU  18          2HD2      LEU  18  -0.312 -11.407   2.737
  154   3HD2  LEU  18          3HD2      LEU  18   0.462 -10.927   4.248
  155    H    GLY  19           H        GLY  19   4.789 -11.095   3.736
  156   1HA   GLY  19          1HA       GLY  19   7.145 -11.249   4.161
  157   2HA   GLY  19          2HA       GLY  19   7.291 -12.349   2.788
  158    H    GLU  20           H        GLU  20   9.146 -10.874   2.238
  159    HA   GLU  20           HA       GLU  20   8.766  -8.135   1.496
  160   1HB   GLU  20          1HB       GLU  20  10.885  -8.512   0.257
  161   2HB   GLU  20          2HB       GLU  20  10.946  -9.253   1.857
  162   1HG   GLU  20          1HG       GLU  20  11.191 -11.314   0.981
  163   2HG   GLU  20          2HG       GLU  20   9.824 -11.078  -0.110
  164    H    ASN  21           H        ASN  21   6.580  -8.465   0.434
  165    HA   ASN  21           HA       ASN  21   6.467  -9.817  -2.156
  166   1HB   ASN  21          1HB       ASN  21   4.624  -9.587  -0.445
  167   2HB   ASN  21          2HB       ASN  21   4.550  -7.870  -0.845
  168   1HD2  ASN  21          2HD2      ASN  21   2.471  -9.997  -1.325
  169   2HD2  ASN  21          1HD2      ASN  21   2.177  -9.965  -2.997
  170    H    ASP  22           H        ASP  22   8.071  -8.661  -3.436
  171    HA   ASP  22           HA       ASP  22   8.387  -5.904  -3.760
  172   1HB   ASP  22          1HB       ASP  22   9.541  -7.973  -4.842
  173   2HB   ASP  22          2HB       ASP  22   8.300  -7.825  -6.087
  174    H    PHE  23           H        PHE  23   5.840  -8.007  -5.049
  175    HA   PHE  23           HA       PHE  23   4.614  -6.396  -6.969
  176   1HB   PHE  23          1HB       PHE  23   4.052  -8.735  -5.883
  177   2HB   PHE  23          2HB       PHE  23   2.992  -7.779  -4.848
  178    HD1  PHE  23           HD1      PHE  23   1.562  -5.939  -6.182
  179    HD2  PHE  23           HD2      PHE  23   3.140  -9.559  -7.871
  180    HE1  PHE  23           HE1      PHE  23  -0.127  -5.830  -7.994
  181    HE2  PHE  23           HE2      PHE  23   1.451  -9.449  -9.684
  182    HZ   PHE  23           HZ       PHE  23  -0.182  -7.584  -9.745
  183    H    CYS  24           H        CYS  24   3.812  -6.383  -3.469
  184    HA   CYS  24           HA       CYS  24   2.122  -4.079  -3.567
  185   1HB   CYS  24          1HB       CYS  24   3.781  -5.412  -1.408
  186   2HB   CYS  24          2HB       CYS  24   2.662  -4.093  -1.068
  187    H    ASN  25           H        ASN  25   5.539  -4.353  -2.476
  188    HA   ASN  25           HA       ASN  25   6.079  -1.654  -1.979
  189   1HB   ASN  25          1HB       ASN  25   7.695  -3.365  -1.512
  190   2HB   ASN  25          2HB       ASN  25   7.726  -3.884  -3.197
  191   1HD2  ASN  25          2HD2      ASN  25  10.192  -3.409  -2.690
  192   2HD2  ASN  25          1HD2      ASN  25  10.724  -1.835  -3.039
  193    H    ARG  26           H        ARG  26   6.211  -3.371  -5.112
  194    HA   ARG  26           HA       ARG  26   7.126  -1.236  -6.737
  195   1HB   ARG  26          1HB       ARG  26   5.316  -3.621  -7.160
  196   2HB   ARG  26          2HB       ARG  26   5.767  -2.559  -8.494
  197   1HG   ARG  26          1HG       ARG  26   7.673  -4.091  -6.701
  198   2HG   ARG  26          2HG       ARG  26   7.327  -4.437  -8.395
  199   1HD   ARG  26          1HD       ARG  26   8.039  -1.730  -8.393
  200   2HD   ARG  26          2HD       ARG  26   9.182  -2.492  -7.271
  201    HE   ARG  26           HE       ARG  26   9.003  -4.260  -9.427
  202   1HH1  ARG  26          1HH1      ARG  26   9.783  -0.931  -8.945
  203   2HH1  ARG  26          2HH1      ARG  26  10.891  -0.865 -10.274
  204   1HH2  ARG  26          1HH2      ARG  26  10.441  -4.186 -11.165
  205   2HH2  ARG  26          2HH2      ARG  26  11.262  -2.706 -11.531
  206    H    GLU  27           H        GLU  27   3.733  -2.257  -6.147
  207    HA   GLU  27           HA       GLU  27   2.479  -0.072  -7.473
  208   1HB   GLU  27          1HB       GLU  27   1.803  -2.346  -5.950
  209   2HB   GLU  27          2HB       GLU  27   1.084  -0.986  -5.089
  210   1HG   GLU  27          1HG       GLU  27   0.722  -1.587  -8.039
  211   2HG   GLU  27          2HG       GLU  27  -0.478  -1.873  -6.778
  212    H    CYS  28           H        CYS  28   3.652  -0.460  -4.148
  213    HA   CYS  28           HA       CYS  28   2.694   2.133  -3.219
  214   1HB   CYS  28          1HB       CYS  28   3.324  -0.141  -2.009
  215   2HB   CYS  28          2HB       CYS  28   4.936   0.564  -1.979
  216    H    LYS  29           H        LYS  29   5.171   1.256  -5.308
  217    HA   LYS  29           HA       LYS  29   7.284   3.025  -4.400
  218   1HB   LYS  29          1HB       LYS  29   7.491   0.974  -5.847
  219   2HB   LYS  29          2HB       LYS  29   6.717   1.876  -7.149
  220   1HG   LYS  29          1HG       LYS  29   8.520   3.384  -7.341
  221   2HG   LYS  29          2HG       LYS  29   9.154   2.963  -5.748
  222   1HD   LYS  29          1HD       LYS  29   9.007   0.595  -7.387
  223   2HD   LYS  29          2HD       LYS  29   9.912   1.850  -8.236
  224   1HE   LYS  29          1HE       LYS  29  11.544   0.719  -6.904
  225   2HE   LYS  29          2HE       LYS  29  11.165   2.189  -5.985
  226   1HZ   LYS  29          1HZ       LYS  29   9.332   0.021  -5.504
  227   2HZ   LYS  29          2HZ       LYS  29  10.925  -0.342  -5.036
  228   3HZ   LYS  29          3HZ       LYS  29  10.138   1.020  -4.394
  229    H    TRP  30           H        TRP  30   4.749   3.283  -6.917
  230    HA   TRP  30           HA       TRP  30   5.386   5.650  -8.184
  231   1HB   TRP  30          1HB       TRP  30   2.655   4.939  -7.074
  232   2HB   TRP  30          2HB       TRP  30   2.987   5.916  -8.501
  233    HD1  TRP  30           HD1      TRP  30   1.506   2.907  -8.132
  234    HE1  TRP  30           HE1      TRP  30   2.220   1.099  -9.822
  235    HE3  TRP  30           HE3      TRP  30   5.928   4.899  -9.755
  236    HZ2  TRP  30           HZ2      TRP  30   4.373   0.565 -11.621
  237    HZ3  TRP  30           HZ3      TRP  30   7.284   3.717 -11.454
  238    HH2  TRP  30           HH2      TRP  30   6.514   1.555 -12.391
  239    H    LYS  31           H        LYS  31   3.014   5.856  -5.517
  240    HA   LYS  31           HA       LYS  31   3.960   8.587  -4.914
  241   1HB   LYS  31          1HB       LYS  31   1.776   6.887  -3.665
  242   2HB   LYS  31          2HB       LYS  31   1.949   8.637  -3.529
  243   1HG   LYS  31          1HG       LYS  31   0.776   8.900  -5.426
  244   2HG   LYS  31          2HG       LYS  31   1.994   7.975  -6.304
  245   1HD   LYS  31          1HD       LYS  31  -0.052   6.799  -6.635
  246   2HD   LYS  31          2HD       LYS  31   0.827   5.877  -5.413
  247   1HE   LYS  31          1HE       LYS  31  -1.132   6.040  -4.234
  248   2HE   LYS  31          2HE       LYS  31  -0.554   7.675  -3.854
  249   1HZ   LYS  31          1HZ       LYS  31  -1.980   7.100  -6.376
  250   2HZ   LYS  31          2HZ       LYS  31  -2.836   7.465  -4.955
  251   3HZ   LYS  31          3HZ       LYS  31  -1.750   8.595  -5.610
  252    H    HIS  32           H        HIS  32   5.433   8.983  -3.311
  253    HA   HIS  32           HA       HIS  32   5.449   7.524  -0.801
  254   1HB   HIS  32          1HB       HIS  32   6.725   6.344  -3.007
  255   2HB   HIS  32          2HB       HIS  32   8.032   7.039  -2.048
  256    HD1  HIS  32           HD1      HIS  32   8.858   4.805  -1.075
  257    HD2  HIS  32           HD2      HIS  32   4.828   5.537  -0.308
  258    HE1  HIS  32           HE1      HIS  32   8.128   3.074   0.623
  259    H    ILE  33           H        ILE  33   7.115   8.393   0.662
  260    HA   ILE  33           HA       ILE  33   8.490  10.859  -0.333
  261    HB   ILE  33           HB       ILE  33   6.627  10.491   2.023
  262   1HG1  ILE  33          1HG1      ILE  33   6.448  12.843   0.249
  263   2HG1  ILE  33          2HG1      ILE  33   6.153  11.303  -0.557
  264   1HG2  ILE  33          1HG2      ILE  33   8.773  12.531   1.523
  265   2HG2  ILE  33          2HG2      ILE  33   7.283  13.028   2.327
  266   3HG2  ILE  33          3HG2      ILE  33   8.292  11.768   3.038
  267   1HD1  ILE  33          1HD1      ILE  33   4.825  11.369   2.016
  268   2HD1  ILE  33          2HD1      ILE  33   4.337  12.748   1.032
  269   3HD1  ILE  33          3HD1      ILE  33   4.132  11.109   0.415
  270    H    GLY  34           H        GLY  34   8.122   8.611   2.435
  271   1HA   GLY  34          1HA       GLY  34  10.824   9.230   3.394
  272   2HA   GLY  34          2HA       GLY  34   9.722   8.048   4.099
  273    H    GLY  35           H        GLY  35   9.194   6.286   2.205
  274   1HA   GLY  35          1HA       GLY  35  10.047   4.535   0.885
  275   2HA   GLY  35          2HA       GLY  35  11.445   5.551   0.547
  276    H    SER  36           H        SER  36  10.062   3.913   3.401
  277    HA   SER  36           HA       SER  36  12.806   3.321   4.363
  278   1HB   SER  36          1HB       SER  36  11.777   3.398   6.390
  279   2HB   SER  36          2HB       SER  36  10.377   4.017   5.522
  280    HG   SER  36           HG       SER  36   9.606   2.256   6.515
  281    H    TYR  37           H        TYR  37   9.769   1.452   3.962
  282    HA   TYR  37           HA       TYR  37  11.081  -0.694   2.509
  283   1HB   TYR  37          1HB       TYR  37  11.702  -0.675   5.124
  284   2HB   TYR  37          2HB       TYR  37  10.177  -1.555   5.219
  285    HD1  TYR  37           HD1      TYR  37  13.519  -1.521   3.568
  286    HD2  TYR  37           HD2      TYR  37  10.010  -3.815   4.510
  287    HE1  TYR  37           HE1      TYR  37  14.653  -3.582   2.779
  288    HE2  TYR  37           HE2      TYR  37  11.145  -5.874   3.719
  289    HH   TYR  37           HH       TYR  37  13.277  -6.207   1.880
  290    H    GLY  38           H        GLY  38   9.453  -1.618   1.318
  291   1HA   GLY  38          1HA       GLY  38   6.672  -1.406   2.397
  292   2HA   GLY  38          2HA       GLY  38   7.062  -1.370   0.678
  293    H    TYR  39           H        TYR  39   5.583  -3.284   2.730
  294    HA   TYR  39           HA       TYR  39   6.260  -5.728   1.229
  295   1HB   TYR  39          1HB       TYR  39   7.198  -6.904   3.019
  296   2HB   TYR  39          2HB       TYR  39   7.811  -5.282   3.330
  297    HD1  TYR  39           HD1      TYR  39   5.355  -7.840   4.349
  298    HD2  TYR  39           HD2      TYR  39   6.965  -3.946   5.184
  299    HE1  TYR  39           HE1      TYR  39   4.228  -7.848   6.557
  300    HE2  TYR  39           HE2      TYR  39   5.838  -3.955   7.393
  301    HH   TYR  39           HH       TYR  39   3.695  -5.188   8.356
  302    H    CYS  40           H        CYS  40   4.618  -7.423   1.624
  303    HA   CYS  40           HA       CYS  40   1.988  -6.261   2.218
  304   1HB   CYS  40          1HB       CYS  40   2.942  -8.134   0.494
  305   2HB   CYS  40          2HB       CYS  40   2.331  -9.175   1.781
  306    H    TYR  41           H        TYR  41   0.847  -6.540   4.102
  307    HA   TYR  41           HA       TYR  41   1.864  -8.543   6.090
  308   1HB   TYR  41          1HB       TYR  41   2.619  -6.384   6.809
  309   2HB   TYR  41          2HB       TYR  41   1.071  -5.638   6.408
  310    HD1  TYR  41           HD1      TYR  41   1.294  -8.952   7.998
  311    HD2  TYR  41           HD2      TYR  41   0.693  -4.749   8.655
  312    HE1  TYR  41           HE1      TYR  41   0.467  -9.428  10.287
  313    HE2  TYR  41           HE2      TYR  41  -0.134  -5.226  10.945
  314    HH   TYR  41           HH       TYR  41  -0.850  -8.439  12.006
  315    H    GLY  42           H        GLY  42   0.234  -9.937   6.666
  316   1HA   GLY  42          1HA       GLY  42  -1.931 -10.797   6.968
  317   2HA   GLY  42          2HA       GLY  42  -2.403  -9.147   7.374
  318    H    PHE  43           H        PHE  43  -1.404 -10.910   4.421
  319    HA   PHE  43           HA       PHE  43  -2.243 -10.715   2.212
  320   1HB   PHE  43          1HB       PHE  43  -4.770 -10.602   3.891
  321   2HB   PHE  43          2HB       PHE  43  -4.686 -11.082   2.196
  322    HD1  PHE  43           HD1      PHE  43  -3.345 -11.939   5.582
  323    HD2  PHE  43           HD2      PHE  43  -4.226 -13.315   1.608
  324    HE1  PHE  43           HE1      PHE  43  -2.807 -14.261   6.265
  325    HE2  PHE  43           HE2      PHE  43  -3.687 -15.636   2.293
  326    HZ   PHE  43           HZ       PHE  43  -2.979 -16.109   4.621
  327    H    GLY  44           H        GLY  44  -1.280  -8.267   2.829
  328   1HA   GLY  44          1HA       GLY  44  -2.998  -6.476   1.355
  329   2HA   GLY  44          2HA       GLY  44  -2.988  -6.064   3.071
  330    H    CYS  45           H        CYS  45  -1.714  -4.898   0.443
  331    HA   CYS  45           HA       CYS  45   1.143  -4.970   0.840
  332   1HB   CYS  45          1HB       CYS  45  -0.667  -2.948  -0.524
  333   2HB   CYS  45          2HB       CYS  45   1.069  -3.110  -0.789
  334    H    TYR  46           H        TYR  46   2.072  -4.155   2.688
  335    HA   TYR  46           HA       TYR  46   0.912  -1.650   3.860
  336   1HB   TYR  46          1HB       TYR  46   0.985  -3.977   5.057
  337   2HB   TYR  46          2HB       TYR  46   2.694  -3.612   5.287
  338    HD1  TYR  46           HD1      TYR  46  -0.395  -1.485   5.350
  339    HD2  TYR  46           HD2      TYR  46   3.056  -2.899   7.482
  340    HE1  TYR  46           HE1      TYR  46  -0.972  -0.014   7.260
  341    HE2  TYR  46           HE2      TYR  46   2.478  -1.430   9.393
  342    HH   TYR  46           HH       TYR  46  -0.546   0.094   9.690
  343    H    CYS  47           H        CYS  47   2.204   0.126   3.730
  344    HA   CYS  47           HA       CYS  47   5.127  -0.256   3.180
  345   1HB   CYS  47          1HB       CYS  47   3.331   2.136   2.665
  346   2HB   CYS  47          2HB       CYS  47   4.954   1.873   2.024
  347    H    GLU  48           H        GLU  48   6.583   0.655   4.653
  348    HA   GLU  48           HA       GLU  48   5.379   2.118   6.979
  349   1HB   GLU  48          1HB       GLU  48   7.972   0.559   6.764
  350   2HB   GLU  48          2HB       GLU  48   7.214   1.146   8.246
  351   1HG   GLU  48          1HG       GLU  48   5.711  -0.559   8.300
  352   2HG   GLU  48          2HG       GLU  48   5.456  -0.515   6.555
  353    H    GLY  49           H        GLY  49   6.564   3.928   7.846
  354   1HA   GLY  49          1HA       GLY  49   8.453   5.477   7.799
  355   2HA   GLY  49          2HA       GLY  49   8.744   5.013   6.124
  356    H    LEU  50           H        LEU  50   6.738   5.456   4.686
  357    HA   LEU  50           HA       LEU  50   6.298   8.023   4.045
  358   1HB   LEU  50          1HB       LEU  50   3.862   7.216   3.550
  359   2HB   LEU  50          2HB       LEU  50   5.206   6.372   2.785
  360    HG   LEU  50           HG       LEU  50   4.518   5.337   5.454
  361   1HD1  LEU  50          1HD1      LEU  50   2.264   5.986   4.500
  362   2HD1  LEU  50          2HD1      LEU  50   2.578   4.865   3.176
  363   3HD1  LEU  50          3HD1      LEU  50   2.457   4.264   4.829
  364   1HD2  LEU  50          1HD2      LEU  50   5.410   4.410   2.791
  365   2HD2  LEU  50          2HD2      LEU  50   5.878   3.845   4.394
  366   3HD2  LEU  50          3HD2      LEU  50   4.380   3.278   3.664
  367    HA   PRO  51           HA       PRO  51   4.780   9.591   8.062
  368   1HB   PRO  51          1HB       PRO  51   5.124  12.218   6.936
  369   2HB   PRO  51          2HB       PRO  51   6.099  11.428   8.179
  370   1HG   PRO  51          1HG       PRO  51   6.838  11.975   5.470
  371   2HG   PRO  51          2HG       PRO  51   7.788  11.138   6.701
  372   1HD   PRO  51          1HD       PRO  51   6.488  10.006   4.374
  373   2HD   PRO  51          2HD       PRO  51   7.489   9.173   5.590
  374    H    ASP  52           H        ASP  52   2.987  11.288   8.479
  375    HA   ASP  52           HA       ASP  52   0.563  10.667   7.296
  376   1HB   ASP  52          1HB       ASP  52   1.634  12.554   9.091
  377   2HB   ASP  52          2HB       ASP  52   0.739  13.502   7.904
  378    H    SER  53           H        SER  53   3.003  12.918   6.082
  379    HA   SER  53           HA       SER  53   1.500  14.341   4.159
  380   1HB   SER  53          1HB       SER  53   4.363  13.388   4.316
  381   2HB   SER  53          2HB       SER  53   3.802  14.452   3.028
  382    HG   SER  53           HG       SER  53   4.542  15.733   4.683
  383    H    THR  54           H        THR  54   2.528  10.996   4.111
  384    HA   THR  54           HA       THR  54   2.195  10.754   1.191
  385    HB   THR  54           HB       THR  54   2.432   8.460   3.116
  386    HG1  THR  54           HG1      THR  54   4.147   9.326   3.917
  387   1HG2  THR  54          1HG2      THR  54   3.117   9.109   0.299
  388   2HG2  THR  54          2HG2      THR  54   4.249   8.067   1.161
  389   3HG2  THR  54          3HG2      THR  54   2.558   7.591   1.003
  390    H    GLN  55           H        GLN  55   0.514   9.559   0.193
  391    HA   GLN  55           HA       GLN  55  -1.992   9.361   1.796
  392   1HB   GLN  55          1HB       GLN  55  -1.837  10.710  -0.321
  393   2HB   GLN  55          2HB       GLN  55  -1.496   9.218  -1.196
  394   1HG   GLN  55          1HG       GLN  55  -3.868   9.681  -1.390
  395   2HG   GLN  55          2HG       GLN  55  -3.662   8.287  -0.329
  396   1HE2  GLN  55          2HE2      GLN  55  -3.158  11.750   0.491
  397   2HE2  GLN  55          1HE2      GLN  55  -4.349  11.795   1.699
  398    H    THR  56           H        THR  56  -2.362   7.330   2.613
  399    HA   THR  56           HA       THR  56  -1.836   4.982   0.827
  400    HB   THR  56           HB       THR  56  -1.375   4.156   3.471
  401    HG1  THR  56           HG1      THR  56  -1.108   6.161   4.263
  402   1HG2  THR  56          1HG2      THR  56  -0.167   3.852   1.093
  403   2HG2  THR  56          2HG2      THR  56   0.937   5.026   1.808
  404   3HG2  THR  56          3HG2      THR  56   0.649   3.485   2.614
  405    H    TRP  57           H        TRP  57  -3.275   3.176   1.245
  406    HA   TRP  57           HA       TRP  57  -5.967   3.752   1.833
  407   1HB   TRP  57          1HB       TRP  57  -4.783   1.710   0.747
  408   2HB   TRP  57          2HB       TRP  57  -4.621   1.104   2.392
  409    HD1  TRP  57           HD1      TRP  57  -7.162   1.708  -0.343
  410    HE1  TRP  57           HE1      TRP  57  -9.425   0.693   0.362
  411    HE3  TRP  57           HE3      TRP  57  -6.124   0.544   4.512
  412    HZ2  TRP  57           HZ2      TRP  57 -10.633  -0.465   2.686
  413    HZ3  TRP  57           HZ3      TRP  57  -7.840  -0.512   5.950
  414    HH2  TRP  57           HH2      TRP  57 -10.093  -1.019   5.044
  415    HA   PRO  58           HA       PRO  58  -7.719   3.084   2.619
  416   1HB   PRO  58          1HB       PRO  58  -9.414   4.436   4.432
  417   2HB   PRO  58          2HB       PRO  58  -9.383   2.697   4.117
  418   1HG   PRO  58          1HG       PRO  58  -8.533   4.102   6.497
  419   2HG   PRO  58          2HG       PRO  58  -8.613   2.359   6.220
  420   1HD   PRO  58          1HD       PRO  58  -6.260   4.056   6.310
  421   2HD   PRO  58          2HD       PRO  58  -6.334   2.287   6.112
  422    H    LEU  59           H        LEU  59  -9.196   5.068   1.953
  423    HA   LEU  59           HA       LEU  59  -7.437   7.473   1.799
  424   1HB   LEU  59          1HB       LEU  59  -9.305   6.039   0.104
  425   2HB   LEU  59          2HB       LEU  59  -9.736   7.746   0.196
  426    HG   LEU  59           HG       LEU  59  -7.568   8.428  -0.565
  427   1HD1  LEU  59          1HD1      LEU  59  -6.812   5.833   0.498
  428   2HD1  LEU  59          2HD1      LEU  59  -6.159   6.077  -1.122
  429   3HD1  LEU  59          3HD1      LEU  59  -5.798   7.236   0.154
  430   1HD2  LEU  59          1HD2      LEU  59  -9.214   7.357  -2.238
  431   2HD2  LEU  59          2HD2      LEU  59  -7.537   7.516  -2.758
  432   3HD2  LEU  59          3HD2      LEU  59  -8.145   5.955  -2.203
  433    HA   PRO  60           HA       PRO  60 -10.005  10.101   4.230
  434   1HB   PRO  60          1HB       PRO  60 -10.693  12.024   2.236
  435   2HB   PRO  60          2HB       PRO  60  -9.372  12.114   3.403
  436   1HG   PRO  60          1HG       PRO  60  -9.212  11.669   0.553
  437   2HG   PRO  60          2HG       PRO  60  -7.891  11.862   1.710
  438   1HD   PRO  60          1HD       PRO  60  -8.727   9.449   0.393
  439   2HD   PRO  60          2HD       PRO  60  -7.439   9.627   1.608
  440    H    ASN  61           H        ASN  61 -12.216  11.659   3.527
  441    HA   ASN  61           HA       ASN  61 -14.406   9.902   3.622
  442   1HB   ASN  61          1HB       ASN  61 -14.064  12.718   2.555
  443   2HB   ASN  61          2HB       ASN  61 -15.646  11.964   2.758
  444   1HD2  ASN  61          2HD2      ASN  61 -15.665  10.756   5.144
  445   2HD2  ASN  61          1HD2      ASN  61 -15.210  11.794   6.408
  446    H    LYS  62           H        LYS  62 -12.440  10.826   0.915
  447    HA   LYS  62           HA       LYS  62 -14.416   9.912  -1.097
  448   1HB   LYS  62          1HB       LYS  62 -11.678  11.176  -1.079
  449   2HB   LYS  62          2HB       LYS  62 -12.343  10.507  -2.569
  450   1HG   LYS  62          1HG       LYS  62 -13.423  12.466  -2.845
  451   2HG   LYS  62          2HG       LYS  62 -14.442  11.998  -1.483
  452   1HD   LYS  62          1HD       LYS  62 -13.560  14.130  -0.895
  453   2HD   LYS  62          2HD       LYS  62 -12.607  12.965   0.025
  454   1HE   LYS  62          1HE       LYS  62 -10.758  13.888  -0.909
  455   2HE   LYS  62          2HE       LYS  62 -11.290  13.215  -2.463
  456   1HZ   LYS  62          1HZ       LYS  62 -12.824  15.187  -2.597
  457   2HZ   LYS  62          2HZ       LYS  62 -11.957  15.863  -1.306
  458   3HZ   LYS  62          3HZ       LYS  62 -11.172  15.536  -2.776
  459    H    THR  63           H        THR  63 -14.322   7.644  -0.056
  460    HA   THR  63           HA       THR  63 -11.894   6.074  -0.296
  461    HB   THR  63           HB       THR  63 -13.760   5.621   1.272
  462    HG1  THR  63           HG1      THR  63 -13.934   3.360   0.727
  463   1HG2  THR  63          1HG2      THR  63 -15.263   4.972  -1.275
  464   2HG2  THR  63          2HG2      THR  63 -15.840   4.605   0.350
  465   3HG2  THR  63          3HG2      THR  63 -15.626   6.282  -0.151
  466    H    CYS  64           H        CYS  64 -12.683   3.768  -1.564
  467    HA   CYS  64           HA       CYS  64 -12.333   4.460  -4.367
  468   1HB   CYS  64          1HB       CYS  64 -11.355   2.477  -3.232
  469   2HB   CYS  64          2HB       CYS  64 -12.978   1.831  -2.988
  Start of MODEL   19
    1   1H    LYS   1          1H        LYS   1   3.950   8.006   5.897
    2   2H    LYS   1          2H        LYS   1   2.281   8.214   5.666
    3   3H    LYS   1          3H        LYS   1   3.161   9.357   6.557
    4    HA   LYS   1           HA       LYS   1   3.564   7.775   8.314
    5   1HB   LYS   1          1HB       LYS   1   0.712   7.974   7.293
    6   2HB   LYS   1          2HB       LYS   1   1.147   7.516   8.940
    7   1HG   LYS   1          1HG       LYS   1   1.819  10.146   7.585
    8   2HG   LYS   1          2HG       LYS   1   0.619   9.906   8.856
    9   1HD   LYS   1          1HD       LYS   1   2.301  10.410  10.288
   10   2HD   LYS   1          2HD       LYS   1   2.875   8.775   9.964
   11   1HE   LYS   1          1HE       LYS   1   4.701   9.556   8.869
   12   2HE   LYS   1          2HE       LYS   1   3.707  10.637   7.871
   13   1HZ   LYS   1          1HZ       LYS   1   3.845  11.376  10.662
   14   2HZ   LYS   1          2HZ       LYS   1   5.336  11.470   9.855
   15   3HZ   LYS   1          3HZ       LYS   1   3.999  12.345   9.278
   16    H    ASP   2           H        ASP   2   3.109   5.600   9.150
   17    HA   ASP   2           HA       ASP   2   3.509   3.509   7.198
   18   1HB   ASP   2          1HB       ASP   2   2.579   3.258  10.073
   19   2HB   ASP   2          2HB       ASP   2   3.559   2.113   9.157
   20    H    GLY   3           H        GLY   3   1.807   3.017   5.805
   21   1HA   GLY   3          1HA       GLY   3  -0.749   2.189   7.043
   22   2HA   GLY   3          2HA       GLY   3  -0.834   3.486   5.853
   23    H    TYR   4           H        TYR   4  -2.207   1.869   4.726
   24    HA   TYR   4           HA       TYR   4  -0.669  -0.280   3.333
   25   1HB   TYR   4          1HB       TYR   4  -3.498   0.238   4.141
   26   2HB   TYR   4          2HB       TYR   4  -3.232  -0.742   2.700
   27    HD1  TYR   4           HD1      TYR   4  -1.700  -2.773   2.870
   28    HD2  TYR   4           HD2      TYR   4  -3.181  -0.662   6.304
   29    HE1  TYR   4           HE1      TYR   4  -1.175  -4.729   4.300
   30    HE2  TYR   4           HE2      TYR   4  -2.655  -2.618   7.734
   31    HH   TYR   4           HH       TYR   4  -2.278  -5.542   6.776
   32    H    LEU   5           H        LEU   5  -1.007  -0.502   0.996
   33    HA   LEU   5           HA       LEU   5  -1.244   2.118  -0.365
   34   1HB   LEU   5          1HB       LEU   5   0.020  -0.489  -0.761
   35   2HB   LEU   5          2HB       LEU   5  -0.787   0.077  -2.224
   36    HG   LEU   5           HG       LEU   5   1.124   1.772  -0.595
   37   1HD1  LEU   5          1HD1      LEU   5   1.585   0.131  -3.105
   38   2HD1  LEU   5          2HD1      LEU   5   2.713   1.338  -2.486
   39   3HD1  LEU   5          3HD1      LEU   5   2.356  -0.105  -1.537
   40   1HD2  LEU   5          1HD2      LEU   5  -0.420   2.096  -3.152
   41   2HD2  LEU   5          2HD2      LEU   5  -0.177   3.254  -1.843
   42   3HD2  LEU   5          3HD2      LEU   5   1.132   2.915  -2.976
   43    H    VAL   6           H        VAL   6  -2.795   2.437  -2.097
   44    HA   VAL   6           HA       VAL   6  -5.196   0.666  -1.857
   45    HB   VAL   6           HB       VAL   6  -6.421   2.642  -2.585
   46   1HG1  VAL   6          1HG1      VAL   6  -4.702   2.572  -0.269
   47   2HG1  VAL   6          2HG1      VAL   6  -4.932   4.236  -0.806
   48   3HG1  VAL   6          3HG1      VAL   6  -6.330   3.232  -0.422
   49   1HG2  VAL   6          1HG2      VAL   6  -3.731   3.436  -3.470
   50   2HG2  VAL   6          2HG2      VAL   6  -5.307   3.941  -4.079
   51   3HG2  VAL   6          3HG2      VAL   6  -4.618   4.727  -2.660
   52    H    GLU   7           H        GLU   7  -6.536   1.020  -4.090
   53    HA   GLU   7           HA       GLU   7  -4.645   0.343  -6.324
   54   1HB   GLU   7          1HB       GLU   7  -5.979  -1.550  -5.434
   55   2HB   GLU   7          2HB       GLU   7  -7.459  -0.644  -5.746
   56   1HG   GLU   7          1HG       GLU   7  -7.035  -2.229  -7.573
   57   2HG   GLU   7          2HG       GLU   7  -6.894  -0.571  -8.157
   58    H    LYS   8           H        LYS   8  -5.694   0.817  -8.530
   59    HA   LYS   8           HA       LYS   8  -6.272   3.492  -8.940
   60   1HB   LYS   8          1HB       LYS   8  -6.096   1.245 -10.459
   61   2HB   LYS   8          2HB       LYS   8  -7.827   1.565 -10.580
   62   1HG   LYS   8          1HG       LYS   8  -6.869   2.789 -12.374
   63   2HG   LYS   8          2HG       LYS   8  -7.161   3.994 -11.119
   64   1HD   LYS   8          1HD       LYS   8  -4.527   2.607 -11.050
   65   2HD   LYS   8          2HD       LYS   8  -4.784   3.763 -12.359
   66   1HE   LYS   8          1HE       LYS   8  -4.317   5.426 -10.890
   67   2HE   LYS   8          2HE       LYS   8  -5.790   4.990 -10.001
   68   1HZ   LYS   8          1HZ       LYS   8  -4.184   3.017  -9.257
   69   2HZ   LYS   8          2HZ       LYS   8  -3.024   4.234  -9.484
   70   3HZ   LYS   8          3HZ       LYS   8  -4.305   4.475  -8.394
   71    H    THR   9           H        THR   9  -8.821   0.970  -8.803
   72    HA   THR   9           HA       THR   9 -10.993   2.826  -8.592
   73    HB   THR   9           HB       THR   9 -12.245   0.787  -8.002
   74    HG1  THR   9           HG1      THR   9 -11.248  -0.644  -6.870
   75   1HG2  THR   9          1HG2      THR   9 -10.915   1.227 -10.330
   76   2HG2  THR   9          2HG2      THR   9 -10.266  -0.350  -9.883
   77   3HG2  THR   9          3HG2      THR   9 -12.006  -0.134 -10.072
   78    H    GLY  10           H        GLY  10  -8.667   1.703  -6.293
   79   1HA   GLY  10          1HA       GLY  10  -8.506   3.077  -4.211
   80   2HA   GLY  10          2HA       GLY  10 -10.261   2.960  -4.094
   81    H    CYS  11           H        CYS  11 -10.252   0.105  -4.919
   82    HA   CYS  11           HA       CYS  11 -10.298  -1.196  -2.441
   83   1HB   CYS  11          1HB       CYS  11  -9.939  -1.979  -5.303
   84   2HB   CYS  11          2HB       CYS  11  -9.654  -3.219  -4.083
   85    H    LYS  12           H        LYS  12  -8.700  -1.833  -1.030
   86    HA   LYS  12           HA       LYS  12  -5.994  -1.133  -1.231
   87   1HB   LYS  12          1HB       LYS  12  -5.738  -2.997   0.492
   88   2HB   LYS  12          2HB       LYS  12  -6.984  -1.807   0.848
   89   1HG   LYS  12          1HG       LYS  12  -8.470  -3.496   0.980
   90   2HG   LYS  12          2HG       LYS  12  -8.240  -3.760  -0.749
   91   1HD   LYS  12          1HD       LYS  12  -6.006  -4.887   0.656
   92   2HD   LYS  12          2HD       LYS  12  -7.497  -5.487   1.385
   93   1HE   LYS  12          1HE       LYS  12  -7.805  -5.490  -1.479
   94   2HE   LYS  12          2HE       LYS  12  -6.314  -6.352  -1.047
   95   1HZ   LYS  12          1HZ       LYS  12  -8.723  -6.770   0.580
   96   2HZ   LYS  12          2HZ       LYS  12  -8.611  -7.562  -0.915
   97   3HZ   LYS  12          3HZ       LYS  12  -7.429  -7.829   0.275
   98    H    LYS  13           H        LYS  13  -4.245  -3.047  -1.083
   99    HA   LYS  13           HA       LYS  13  -4.539  -4.640  -3.607
  100   1HB   LYS  13          1HB       LYS  13  -2.175  -3.459  -2.117
  101   2HB   LYS  13          2HB       LYS  13  -1.998  -4.544  -3.498
  102   1HG   LYS  13          1HG       LYS  13  -3.852  -2.691  -4.396
  103   2HG   LYS  13          2HG       LYS  13  -2.738  -1.709  -3.444
  104   1HD   LYS  13          1HD       LYS  13  -1.048  -3.399  -4.855
  105   2HD   LYS  13          2HD       LYS  13  -2.315  -3.023  -6.024
  106   1HE   LYS  13          1HE       LYS  13  -1.828  -0.558  -4.851
  107   2HE   LYS  13          2HE       LYS  13  -0.211  -1.282  -4.956
  108   1HZ   LYS  13          1HZ       LYS  13  -1.216  -2.044  -7.282
  109   2HZ   LYS  13          2HZ       LYS  13  -2.074  -0.593  -7.091
  110   3HZ   LYS  13          3HZ       LYS  13  -0.375  -0.581  -7.089
  111    H    THR  14           H        THR  14  -4.188  -6.877  -3.487
  112    HA   THR  14           HA       THR  14  -3.769  -7.979  -0.735
  113    HB   THR  14           HB       THR  14  -5.293  -8.838  -3.191
  114    HG1  THR  14           HG1      THR  14  -6.307  -9.092  -0.646
  115   1HG2  THR  14          1HG2      THR  14  -4.065 -10.546  -1.099
  116   2HG2  THR  14          2HG2      THR  14  -5.756 -10.881  -1.471
  117   3HG2  THR  14          3HG2      THR  14  -4.542 -10.952  -2.748
  118    H    CYS  15           H        CYS  15  -2.260  -9.672  -0.438
  119    HA   CYS  15           HA       CYS  15  -0.683 -10.539  -2.817
  120   1HB   CYS  15          1HB       CYS  15   1.391  -9.936  -1.753
  121   2HB   CYS  15          2HB       CYS  15   0.343  -8.523  -1.670
  122    H    TYR  16           H        TYR  16  -0.513 -12.731  -2.754
  123    HA   TYR  16           HA       TYR  16  -1.425 -14.302  -0.507
  124   1HB   TYR  16          1HB       TYR  16  -0.098 -14.756  -3.164
  125   2HB   TYR  16          2HB       TYR  16  -0.212 -16.100  -2.030
  126    HD1  TYR  16           HD1      TYR  16  -2.648 -16.271  -0.850
  127    HD2  TYR  16           HD2      TYR  16  -1.830 -14.521  -4.687
  128    HE1  TYR  16           HE1      TYR  16  -5.010 -16.632  -1.520
  129    HE2  TYR  16           HE2      TYR  16  -4.189 -14.881  -5.355
  130    HH   TYR  16           HH       TYR  16  -6.077 -16.182  -4.792
  131    H    LYS  17           H        LYS  17   1.758 -13.258  -1.636
  132    HA   LYS  17           HA       LYS  17   3.157 -14.981   0.314
  133   1HB   LYS  17          1HB       LYS  17   4.375 -12.801  -1.379
  134   2HB   LYS  17          2HB       LYS  17   5.087 -14.334  -0.880
  135   1HG   LYS  17          1HG       LYS  17   3.258 -15.460  -2.290
  136   2HG   LYS  17          2HG       LYS  17   2.964 -13.863  -2.979
  137   1HD   LYS  17          1HD       LYS  17   4.528 -15.026  -4.418
  138   2HD   LYS  17          2HD       LYS  17   5.404 -13.746  -3.576
  139   1HE   LYS  17          1HE       LYS  17   6.608 -15.240  -2.279
  140   2HE   LYS  17          2HE       LYS  17   5.306 -16.448  -2.281
  141   1HZ   LYS  17          1HZ       LYS  17   6.573 -15.696  -4.823
  142   2HZ   LYS  17          2HZ       LYS  17   7.381 -16.785  -3.798
  143   3HZ   LYS  17          3HZ       LYS  17   5.830 -17.155  -4.384
  144    H    LEU  18           H        LEU  18   2.102 -13.896   2.223
  145    HA   LEU  18           HA       LEU  18   2.364 -11.150   2.871
  146   1HB   LEU  18          1HB       LEU  18   2.319 -13.688   4.529
  147   2HB   LEU  18          2HB       LEU  18   2.174 -12.075   5.232
  148    HG   LEU  18           HG       LEU  18   0.313 -13.364   3.218
  149   1HD1  LEU  18          1HD1      LEU  18  -0.021 -12.388   6.069
  150   2HD1  LEU  18          2HD1      LEU  18  -1.360 -12.880   5.033
  151   3HD1  LEU  18          3HD1      LEU  18  -0.129 -14.054   5.500
  152   1HD2  LEU  18          1HD2      LEU  18   0.880 -10.543   3.840
  153   2HD2  LEU  18          2HD2      LEU  18   0.033 -11.240   2.460
  154   3HD2  LEU  18          3HD2      LEU  18  -0.825 -10.970   3.976
  155    H    GLY  19           H        GLY  19   3.898 -10.275   4.609
  156   1HA   GLY  19          1HA       GLY  19   6.076 -10.088   5.567
  157   2HA   GLY  19          2HA       GLY  19   6.494 -11.631   4.827
  158    H    GLU  20           H        GLU  20   8.501 -10.455   4.240
  159    HA   GLU  20           HA       GLU  20   8.740  -8.216   2.574
  160   1HB   GLU  20          1HB       GLU  20  10.314 -10.342   3.536
  161   2HB   GLU  20          2HB       GLU  20  10.519 -10.374   1.784
  162   1HG   GLU  20          1HG       GLU  20  12.118  -8.801   2.255
  163   2HG   GLU  20          2HG       GLU  20  10.726  -7.718   2.193
  164    H    ASN  21           H        ASN  21   6.882  -8.263   1.098
  165    HA   ASN  21           HA       ASN  21   6.977 -10.363  -1.015
  166   1HB   ASN  21          1HB       ASN  21   4.884  -9.709   0.325
  167   2HB   ASN  21          2HB       ASN  21   4.904  -8.204  -0.598
  168   1HD2  ASN  21          2HD2      ASN  21   3.144 -10.834  -0.648
  169   2HD2  ASN  21          1HD2      ASN  21   3.044 -11.176  -2.307
  170    H    ASP  22           H        ASP  22   8.729  -9.561  -2.283
  171    HA   ASP  22           HA       ASP  22   9.482  -7.061  -3.080
  172   1HB   ASP  22          1HB       ASP  22   9.015  -9.436  -4.912
  173   2HB   ASP  22          2HB       ASP  22  10.176  -8.136  -5.174
  174    H    PHE  23           H        PHE  23   6.760  -8.867  -4.576
  175    HA   PHE  23           HA       PHE  23   5.935  -7.143  -6.573
  176   1HB   PHE  23          1HB       PHE  23   4.887  -9.262  -5.059
  177   2HB   PHE  23          2HB       PHE  23   3.693  -7.974  -4.905
  178    HD1  PHE  23           HD1      PHE  23   3.859  -6.560  -7.446
  179    HD2  PHE  23           HD2      PHE  23   4.073 -10.778  -6.657
  180    HE1  PHE  23           HE1      PHE  23   3.050  -7.032  -9.743
  181    HE2  PHE  23           HE2      PHE  23   3.264 -11.249  -8.955
  182    HZ   PHE  23           HZ       PHE  23   2.754  -9.375 -10.498
  183    H    CYS  24           H        CYS  24   4.824  -6.861  -3.158
  184    HA   CYS  24           HA       CYS  24   3.555  -4.304  -3.556
  185   1HB   CYS  24          1HB       CYS  24   4.565  -5.879  -1.177
  186   2HB   CYS  24          2HB       CYS  24   3.763  -4.321  -0.983
  187    H    ASN  25           H        ASN  25   6.801  -5.284  -2.485
  188    HA   ASN  25           HA       ASN  25   7.760  -2.727  -1.664
  189   1HB   ASN  25          1HB       ASN  25   8.790  -5.016  -1.335
  190   2HB   ASN  25          2HB       ASN  25   9.283  -4.968  -3.028
  191   1HD2  ASN  25          2HD2      ASN  25  11.036  -4.949  -0.582
  192   2HD2  ASN  25          1HD2      ASN  25  11.968  -3.535  -0.708
  193    H    ARG  26           H        ARG  26   8.380  -4.399  -4.784
  194    HA   ARG  26           HA       ARG  26   9.541  -2.206  -6.128
  195   1HB   ARG  26          1HB       ARG  26   9.100  -3.523  -8.111
  196   2HB   ARG  26          2HB       ARG  26   9.443  -4.641  -6.797
  197   1HG   ARG  26          1HG       ARG  26   7.465  -5.634  -7.168
  198   2HG   ARG  26          2HG       ARG  26   6.654  -4.133  -6.737
  199   1HD   ARG  26          1HD       ARG  26   5.905  -4.123  -8.890
  200   2HD   ARG  26          2HD       ARG  26   7.556  -3.640  -9.322
  201    HE   ARG  26           HE       ARG  26   7.689  -6.409  -9.012
  202   1HH1  ARG  26          1HH1      ARG  26   5.839  -4.159 -10.873
  203   2HH1  ARG  26          2HH1      ARG  26   5.619  -5.244 -12.204
  204   1HH2  ARG  26          1HH2      ARG  26   7.408  -7.832 -10.743
  205   2HH2  ARG  26          2HH2      ARG  26   6.506  -7.321 -12.131
  206    H    GLU  27           H        GLU  27   6.153  -2.907  -5.461
  207    HA   GLU  27           HA       GLU  27   5.134  -0.917  -7.364
  208   1HB   GLU  27          1HB       GLU  27   4.178  -3.095  -5.789
  209   2HB   GLU  27          2HB       GLU  27   3.265  -1.663  -5.313
  210   1HG   GLU  27          1HG       GLU  27   2.395  -1.339  -7.453
  211   2HG   GLU  27          2HG       GLU  27   3.714  -2.214  -8.230
  212    H    CYS  28           H        CYS  28   6.200  -0.965  -4.039
  213    HA   CYS  28           HA       CYS  28   4.795   1.476  -3.241
  214   1HB   CYS  28          1HB       CYS  28   6.274  -0.662  -2.074
  215   2HB   CYS  28          2HB       CYS  28   7.082   0.839  -1.620
  216    H    LYS  29           H        LYS  29   7.929   0.669  -4.631
  217    HA   LYS  29           HA       LYS  29   8.967   3.406  -4.158
  218   1HB   LYS  29          1HB       LYS  29   9.981   0.724  -4.919
  219   2HB   LYS  29          2HB       LYS  29  10.851   2.093  -5.612
  220   1HG   LYS  29          1HG       LYS  29  10.729   3.021  -3.138
  221   2HG   LYS  29          2HG       LYS  29  10.530   1.314  -2.736
  222   1HD   LYS  29          1HD       LYS  29  12.764   2.363  -4.490
  223   2HD   LYS  29          2HD       LYS  29  12.931   2.109  -2.752
  224   1HE   LYS  29          1HE       LYS  29  11.815  -0.284  -3.625
  225   2HE   LYS  29          2HE       LYS  29  12.962   0.134  -4.915
  226   1HZ   LYS  29          1HZ       LYS  29  14.579   0.676  -3.106
  227   2HZ   LYS  29          2HZ       LYS  29  13.501  -0.033  -2.001
  228   3HZ   LYS  29          3HZ       LYS  29  14.196  -0.971  -3.235
  229    H    TRP  30           H        TRP  30   6.906   2.123  -6.395
  230    HA   TRP  30           HA       TRP  30   8.124   3.123  -8.842
  231   1HB   TRP  30          1HB       TRP  30   6.171   2.285  -9.856
  232   2HB   TRP  30          2HB       TRP  30   6.427   1.229  -8.475
  233    HD1  TRP  30           HD1      TRP  30   3.602   1.600  -9.799
  234    HE1  TRP  30           HE1      TRP  30   1.633   2.485  -8.400
  235    HE3  TRP  30           HE3      TRP  30   6.146   3.989  -6.041
  236    HZ2  TRP  30           HZ2      TRP  30   1.183   3.987  -6.022
  237    HZ3  TRP  30           HZ3      TRP  30   4.913   5.123  -4.231
  238    HH2  TRP  30           HH2      TRP  30   2.435   5.131  -4.214
  239    H    LYS  31           H        LYS  31   8.417   5.267  -7.356
  240    HA   LYS  31           HA       LYS  31   7.272   7.428  -8.659
  241   1HB   LYS  31          1HB       LYS  31   5.388   6.068  -6.945
  242   2HB   LYS  31          2HB       LYS  31   5.631   7.715  -6.370
  243   1HG   LYS  31          1HG       LYS  31   4.778   8.659  -8.280
  244   2HG   LYS  31          2HG       LYS  31   5.337   7.339  -9.306
  245   1HD   LYS  31          1HD       LYS  31   3.349   6.296  -9.163
  246   2HD   LYS  31          2HD       LYS  31   3.374   6.384  -7.402
  247   1HE   LYS  31          1HE       LYS  31   1.727   7.935  -7.521
  248   2HE   LYS  31          2HE       LYS  31   2.876   9.025  -8.322
  249   1HZ   LYS  31          1HZ       LYS  31   1.777   6.873  -9.948
  250   2HZ   LYS  31          2HZ       LYS  31   0.693   8.110  -9.526
  251   3HZ   LYS  31          3HZ       LYS  31   2.122   8.479 -10.368
  252    H    HIS  32           H        HIS  32   7.225   9.490  -7.093
  253    HA   HIS  32           HA       HIS  32   9.597   9.209  -5.282
  254   1HB   HIS  32          1HB       HIS  32   8.858  10.963  -7.436
  255   2HB   HIS  32          2HB       HIS  32   9.043  11.916  -5.963
  256    HD1  HIS  32           HD1      HIS  32  10.958   9.783  -8.374
  257    HD2  HIS  32           HD2      HIS  32  11.687  11.900  -4.857
  258    HE1  HIS  32           HE1      HIS  32  13.475   9.902  -8.118
  259    H    ILE  33           H        ILE  33   8.260   8.641  -3.420
  260    HA   ILE  33           HA       ILE  33   6.519  10.866  -2.413
  261    HB   ILE  33           HB       ILE  33   6.549   7.865  -2.137
  262   1HG1  ILE  33          1HG1      ILE  33   3.967   8.616  -2.368
  263   2HG1  ILE  33          2HG1      ILE  33   4.737   9.997  -3.150
  264   1HG2  ILE  33          1HG2      ILE  33   5.459   9.885  -0.190
  265   2HG2  ILE  33          2HG2      ILE  33   4.649   8.333  -0.404
  266   3HG2  ILE  33          3HG2      ILE  33   6.326   8.385   0.140
  267   1HD1  ILE  33          1HD1      ILE  33   6.133   7.922  -4.255
  268   2HD1  ILE  33          2HD1      ILE  33   4.541   7.192  -4.051
  269   3HD1  ILE  33          3HD1      ILE  33   4.719   8.668  -4.999
  270    H    GLY  34           H        GLY  34   9.207   8.696  -1.669
  271   1HA   GLY  34          1HA       GLY  34  11.023   9.374  -0.209
  272   2HA   GLY  34          2HA       GLY  34   9.909  10.458   0.618
  273    H    GLY  35           H        GLY  35   9.944   6.962  -0.122
  274   1HA   GLY  35          1HA       GLY  35   9.083   6.479   2.699
  275   2HA   GLY  35          2HA       GLY  35   8.788   5.369   1.360
  276    H    SER  36           H        SER  36  10.079   4.565   3.785
  277    HA   SER  36           HA       SER  36  12.928   4.236   2.945
  278   1HB   SER  36          1HB       SER  36  13.350   4.024   5.283
  279   2HB   SER  36          2HB       SER  36  12.198   5.340   5.133
  280    HG   SER  36           HG       SER  36  10.729   4.155   6.080
  281    H    TYR  37           H        TYR  37  10.021   2.458   3.995
  282    HA   TYR  37           HA       TYR  37  11.259  -0.035   2.923
  283   1HB   TYR  37          1HB       TYR  37  11.361   0.570   5.577
  284   2HB   TYR  37          2HB       TYR  37   9.820  -0.286   5.504
  285    HD1  TYR  37           HD1      TYR  37  12.995  -0.723   3.563
  286    HD2  TYR  37           HD2      TYR  37  10.168  -2.470   6.286
  287    HE1  TYR  37           HE1      TYR  37  14.196  -2.887   3.422
  288    HE2  TYR  37           HE2      TYR  37  11.372  -4.634   6.144
  289    HH   TYR  37           HH       TYR  37  13.172  -5.688   5.365
  290    H    GLY  38           H        GLY  38   9.579  -1.816   2.787
  291   1HA   GLY  38          1HA       GLY  38   6.764  -1.106   2.968
  292   2HA   GLY  38          2HA       GLY  38   7.341  -1.157   1.302
  293    H    TYR  39           H        TYR  39   6.047  -3.031   3.776
  294    HA   TYR  39           HA       TYR  39   6.819  -5.538   2.328
  295   1HB   TYR  39          1HB       TYR  39   7.097  -6.605   4.544
  296   2HB   TYR  39          2HB       TYR  39   8.186  -5.229   4.370
  297    HD1  TYR  39           HD1      TYR  39   7.753  -3.113   5.548
  298    HD2  TYR  39           HD2      TYR  39   5.200  -6.529   6.062
  299    HE1  TYR  39           HE1      TYR  39   6.748  -2.060   7.556
  300    HE2  TYR  39           HE2      TYR  39   4.195  -5.477   8.071
  301    HH   TYR  39           HH       TYR  39   3.914  -3.335   9.076
  302    H    CYS  40           H        CYS  40   5.185  -7.247   2.526
  303    HA   CYS  40           HA       CYS  40   2.458  -6.177   2.733
  304   1HB   CYS  40          1HB       CYS  40   3.805  -8.198   1.346
  305   2HB   CYS  40          2HB       CYS  40   2.740  -9.065   2.454
  306    H    TYR  41           H        TYR  41   1.072  -6.456   4.433
  307    HA   TYR  41           HA       TYR  41   1.803  -8.411   6.583
  308   1HB   TYR  41          1HB       TYR  41   2.477  -6.052   7.121
  309   2HB   TYR  41          2HB       TYR  41   0.788  -5.572   6.954
  310    HD1  TYR  41           HD1      TYR  41   3.164  -7.616   8.936
  311    HD2  TYR  41           HD2      TYR  41  -0.843  -6.093   8.652
  312    HE1  TYR  41           HE1      TYR  41   2.733  -8.313  11.278
  313    HE2  TYR  41           HE2      TYR  41  -1.272  -6.791  10.994
  314    HH   TYR  41           HH       TYR  41   1.008  -7.441  13.165
  315    H    GLY  42           H        GLY  42   0.016  -9.587   7.294
  316   1HA   GLY  42          1HA       GLY  42  -2.249 -10.208   7.542
  317   2HA   GLY  42          2HA       GLY  42  -2.702  -8.577   7.033
  318    H    PHE  43           H        PHE  43  -2.439  -8.112   4.662
  319    HA   PHE  43           HA       PHE  43  -2.133 -10.231   2.731
  320   1HB   PHE  43          1HB       PHE  43  -4.794  -9.693   3.942
  321   2HB   PHE  43          2HB       PHE  43  -4.767  -9.902   2.194
  322    HD1  PHE  43           HD1      PHE  43  -2.534 -11.837   1.875
  323    HD2  PHE  43           HD2      PHE  43  -5.724 -11.708   4.749
  324    HE1  PHE  43           HE1      PHE  43  -2.369 -14.294   2.172
  325    HE2  PHE  43           HE2      PHE  43  -5.558 -14.163   5.046
  326    HZ   PHE  43           HZ       PHE  43  -3.881 -15.457   3.755
  327    H    GLY  44           H        GLY  44  -1.131  -7.614   2.858
  328   1HA   GLY  44          1HA       GLY  44  -1.940  -6.575   0.300
  329   2HA   GLY  44          2HA       GLY  44  -2.603  -5.579   1.596
  330    H    CYS  45           H        CYS  45  -0.745  -4.506  -0.192
  331    HA   CYS  45           HA       CYS  45   1.973  -4.669   0.798
  332   1HB   CYS  45          1HB       CYS  45   0.679  -2.450  -0.804
  333   2HB   CYS  45          2HB       CYS  45   2.363  -2.968  -0.845
  334    H    TYR  46           H        TYR  46   3.012  -3.335   2.257
  335    HA   TYR  46           HA       TYR  46   1.426  -1.133   3.532
  336   1HB   TYR  46          1HB       TYR  46   1.602  -3.412   4.739
  337   2HB   TYR  46          2HB       TYR  46   3.304  -3.016   4.969
  338    HD1  TYR  46           HD1      TYR  46  -0.165  -2.078   5.807
  339    HD2  TYR  46           HD2      TYR  46   3.993  -1.220   6.456
  340    HE1  TYR  46           HE1      TYR  46  -0.763  -0.655   7.748
  341    HE2  TYR  46           HE2      TYR  46   3.396   0.202   8.399
  342    HH   TYR  46           HH       TYR  46   0.974   0.109  10.068
  343    H    CYS  47           H        CYS  47   2.596   0.782   3.496
  344    HA   CYS  47           HA       CYS  47   5.578   0.554   3.179
  345   1HB   CYS  47          1HB       CYS  47   3.546   1.749   1.568
  346   2HB   CYS  47          2HB       CYS  47   4.544   3.047   2.222
  347    H    GLU  48           H        GLU  48   6.843   1.858   4.511
  348    HA   GLU  48           HA       GLU  48   5.388   3.596   6.485
  349   1HB   GLU  48          1HB       GLU  48   7.780   1.753   6.753
  350   2HB   GLU  48          2HB       GLU  48   7.274   2.872   8.018
  351   1HG   GLU  48          1HG       GLU  48   5.117   1.783   8.201
  352   2HG   GLU  48          2HG       GLU  48   5.473   0.755   6.813
  353    H    GLY  49           H        GLY  49   6.319   5.618   6.903
  354   1HA   GLY  49          1HA       GLY  49   8.145   7.213   6.898
  355   2HA   GLY  49          2HA       GLY  49   8.955   6.234   5.675
  356    H    LEU  50           H        LEU  50   5.562   7.167   5.528
  357    HA   LEU  50           HA       LEU  50   6.167   8.606   2.985
  358   1HB   LEU  50          1HB       LEU  50   3.346   8.285   3.651
  359   2HB   LEU  50          2HB       LEU  50   4.223   7.707   2.241
  360    HG   LEU  50           HG       LEU  50   4.095   6.325   4.942
  361   1HD1  LEU  50          1HD1      LEU  50   2.652   6.036   2.346
  362   2HD1  LEU  50          2HD1      LEU  50   3.043   4.571   3.246
  363   3HD1  LEU  50          3HD1      LEU  50   2.055   5.826   3.992
  364   1HD2  LEU  50          1HD2      LEU  50   6.182   6.194   3.202
  365   2HD2  LEU  50          2HD2      LEU  50   5.663   4.828   4.190
  366   3HD2  LEU  50          3HD2      LEU  50   5.128   4.959   2.516
  367    HA   PRO  51           HA       PRO  51   5.358  12.476   4.950
  368   1HB   PRO  51          1HB       PRO  51   4.478  13.745   2.573
  369   2HB   PRO  51          2HB       PRO  51   6.129  13.700   3.201
  370   1HG   PRO  51          1HG       PRO  51   5.051  12.343   0.881
  371   2HG   PRO  51          2HG       PRO  51   6.727  12.419   1.433
  372   1HD   PRO  51          1HD       PRO  51   4.912  10.177   1.590
  373   2HD   PRO  51          2HD       PRO  51   6.602  10.256   2.146
  374    H    ASP  52           H        ASP  52   3.511  13.824   5.547
  375    HA   ASP  52           HA       ASP  52   1.017  12.514   5.814
  376   1HB   ASP  52          1HB       ASP  52   1.857  14.429   7.151
  377   2HB   ASP  52          2HB       ASP  52   1.653  15.482   5.751
  378    H    SER  53           H        SER  53   2.120  14.811   3.319
  379    HA   SER  53           HA       SER  53  -0.310  15.314   1.988
  380   1HB   SER  53          1HB       SER  53   2.170  16.116   1.649
  381   2HB   SER  53          2HB       SER  53   2.258  14.770   0.515
  382    HG   SER  53           HG       SER  53   0.555  15.670  -0.628
  383    H    THR  54           H        THR  54   1.880  12.520   1.684
  384    HA   THR  54           HA       THR  54   0.584  11.251  -0.523
  385    HB   THR  54           HB       THR  54   2.059  10.048   1.845
  386    HG1  THR  54           HG1      THR  54   3.335  11.598   0.939
  387   1HG2  THR  54          1HG2      THR  54   0.883   8.426   0.360
  388   2HG2  THR  54          2HG2      THR  54   1.773   9.080  -1.013
  389   3HG2  THR  54          3HG2      THR  54   2.637   8.262   0.289
  390    H    GLN  55           H        GLN  55  -1.252   9.970  -0.611
  391    HA   GLN  55           HA       GLN  55  -2.951   9.831   1.810
  392   1HB   GLN  55          1HB       GLN  55  -4.675   9.276   0.209
  393   2HB   GLN  55          2HB       GLN  55  -3.699  10.562  -0.502
  394   1HG   GLN  55          1HG       GLN  55  -3.460   9.200  -2.290
  395   2HG   GLN  55          2HG       GLN  55  -2.373   8.248  -1.277
  396   1HE2  GLN  55          2HE2      GLN  55  -5.964   8.636  -1.354
  397   2HE2  GLN  55          1HE2      GLN  55  -6.287   6.970  -1.412
  398    H    THR  56           H        THR  56  -4.142   7.667   2.136
  399    HA   THR  56           HA       THR  56  -2.709   5.248   1.286
  400    HB   THR  56           HB       THR  56  -2.721   5.064   4.088
  401    HG1  THR  56           HG1      THR  56  -1.728   6.927   4.749
  402   1HG2  THR  56          1HG2      THR  56  -0.864   5.052   1.870
  403   2HG2  THR  56          2HG2      THR  56  -0.137   5.797   3.294
  404   3HG2  THR  56          3HG2      THR  56  -0.790   4.161   3.390
  405    H    TRP  57           H        TRP  57  -3.830   3.292   2.034
  406    HA   TRP  57           HA       TRP  57  -6.703   3.480   2.052
  407   1HB   TRP  57          1HB       TRP  57  -4.940   1.601   1.429
  408   2HB   TRP  57          2HB       TRP  57  -5.115   1.154   3.121
  409    HD1  TRP  57           HD1      TRP  57  -7.252   1.636  -0.045
  410    HE1  TRP  57           HE1      TRP  57  -9.337   0.132   0.154
  411    HE3  TRP  57           HE3      TRP  57  -6.587  -0.170   4.685
  412    HZ2  TRP  57           HZ2      TRP  57 -10.560  -1.609   2.069
  413    HZ3  TRP  57           HZ3      TRP  57  -8.224  -1.747   5.671
  414    HH2  TRP  57           HH2      TRP  57 -10.208  -2.468   4.371
  415    HA   PRO  58           HA       PRO  58  -8.429   2.349   2.862
  416   1HB   PRO  58          1HB       PRO  58 -10.495   3.705   4.261
  417   2HB   PRO  58          2HB       PRO  58 -10.177   1.968   4.249
  418   1HG   PRO  58          1HG       PRO  58  -9.795   3.833   6.414
  419   2HG   PRO  58          2HG       PRO  58  -9.540   2.086   6.417
  420   1HD   PRO  58          1HD       PRO  58  -7.542   4.181   6.407
  421   2HD   PRO  58          2HD       PRO  58  -7.287   2.419   6.466
  422    H    LEU  59           H        LEU  59 -10.217   3.787   1.749
  423    HA   LEU  59           HA       LEU  59  -8.949   6.356   0.980
  424   1HB   LEU  59          1HB       LEU  59 -10.751   4.321  -0.137
  425   2HB   LEU  59          2HB       LEU  59 -11.262   5.967  -0.508
  426    HG   LEU  59           HG       LEU  59  -8.834   6.401  -1.206
  427   1HD1  LEU  59          1HD1      LEU  59  -8.524   3.822  -0.145
  428   2HD1  LEU  59          2HD1      LEU  59  -8.404   3.609  -1.891
  429   3HD1  LEU  59          3HD1      LEU  59  -7.324   4.730  -1.064
  430   1HD2  LEU  59          1HD2      LEU  59 -10.884   4.749  -2.601
  431   2HD2  LEU  59          2HD2      LEU  59 -10.178   6.295  -3.071
  432   3HD2  LEU  59          3HD2      LEU  59  -9.281   4.800  -3.335
  433    HA   PRO  60           HA       PRO  60 -11.782   9.130   2.897
  434   1HB   PRO  60          1HB       PRO  60 -13.050  10.127   0.504
  435   2HB   PRO  60          2HB       PRO  60 -11.793  10.897   1.477
  436   1HG   PRO  60          1HG       PRO  60 -11.519   9.715  -1.123
  437   2HG   PRO  60          2HG       PRO  60 -10.264  10.468  -0.136
  438   1HD   PRO  60          1HD       PRO  60 -10.586   7.672  -0.733
  439   2HD   PRO  60          2HD       PRO  60  -9.349   8.426   0.301
  440    H    ASN  61           H        ASN  61 -14.351   9.921   2.355
  441    HA   ASN  61           HA       ASN  61 -16.000   7.785   3.151
  442   1HB   ASN  61          1HB       ASN  61 -17.804   9.302   2.597
  443   2HB   ASN  61          2HB       ASN  61 -16.446  10.286   3.144
  444   1HD2  ASN  61          2HD2      ASN  61 -18.761  10.244   0.792
  445   2HD2  ASN  61          1HD2      ASN  61 -17.928  11.035  -0.457
  446    H    LYS  62           H        LYS  62 -14.956   8.759  -0.064
  447    HA   LYS  62           HA       LYS  62 -16.829   6.960  -1.449
  448   1HB   LYS  62          1HB       LYS  62 -16.031   9.157  -2.336
  449   2HB   LYS  62          2HB       LYS  62 -14.395   8.503  -2.413
  450   1HG   LYS  62          1HG       LYS  62 -15.451   6.610  -3.844
  451   2HG   LYS  62          2HG       LYS  62 -16.811   7.717  -4.034
  452   1HD   LYS  62          1HD       LYS  62 -15.546   9.288  -5.210
  453   2HD   LYS  62          2HD       LYS  62 -14.021   8.710  -4.537
  454   1HE   LYS  62          1HE       LYS  62 -14.318   8.061  -6.944
  455   2HE   LYS  62          2HE       LYS  62 -14.193   6.646  -5.879
  456   1HZ   LYS  62          1HZ       LYS  62 -16.758   7.921  -6.665
  457   2HZ   LYS  62          2HZ       LYS  62 -16.117   6.543  -7.417
  458   3HZ   LYS  62          3HZ       LYS  62 -16.563   6.484  -5.779
  459    H    THR  63           H        THR  63 -15.527   5.360   0.312
  460    HA   THR  63           HA       THR  63 -13.011   4.271  -0.453
  461    HB   THR  63           HB       THR  63 -14.021   3.818   1.693
  462    HG1  THR  63           HG1      THR  63 -13.308   1.853   1.679
  463   1HG2  THR  63          1HG2      THR  63 -16.345   3.150  -0.006
  464   2HG2  THR  63          2HG2      THR  63 -16.108   2.094   1.386
  465   3HG2  THR  63          3HG2      THR  63 -16.297   3.831   1.620
  466    H    CYS  64           H        CYS  64 -13.281   1.617  -0.931
  467    HA   CYS  64           HA       CYS  64 -14.117   1.545  -3.745
  468   1HB   CYS  64          1HB       CYS  64 -12.052   0.514  -2.488
  469   2HB   CYS  64          2HB       CYS  64 -13.173  -0.792  -2.103
  Start of MODEL   20
    1   1H    LYS   1          1H        LYS   1   5.325   6.484  10.694
    2   2H    LYS   1          2H        LYS   1   5.495   8.050  10.056
    3   3H    LYS   1          3H        LYS   1   4.812   7.826  11.596
    4    HA   LYS   1           HA       LYS   1   2.811   7.057  10.768
    5   1HB   LYS   1          1HB       LYS   1   2.785   9.325  10.255
    6   2HB   LYS   1          2HB       LYS   1   4.163   9.197   9.163
    7   1HG   LYS   1          1HG       LYS   1   2.861   8.615   7.365
    8   2HG   LYS   1          2HG       LYS   1   1.704   7.730   8.357
    9   1HD   LYS   1          1HD       LYS   1   0.699   9.804   9.126
   10   2HD   LYS   1          2HD       LYS   1   1.929  10.751   8.287
   11   1HE   LYS   1          1HE       LYS   1   0.153  10.805   6.744
   12   2HE   LYS   1          2HE       LYS   1   1.075   9.402   6.167
   13   1HZ   LYS   1          1HZ       LYS   1  -0.846   8.963   8.323
   14   2HZ   LYS   1          2HZ       LYS   1  -1.481   9.220   6.772
   15   3HZ   LYS   1          3HZ       LYS   1  -0.400   7.937   7.045
   16    H    ASP   2           H        ASP   2   2.237   5.149   9.830
   17    HA   ASP   2           HA       ASP   2   3.560   4.346   7.266
   18   1HB   ASP   2          1HB       ASP   2   2.003   2.744   9.324
   19   2HB   ASP   2          2HB       ASP   2   2.896   2.081   7.955
   20    H    GLY   3           H        GLY   3   1.820   2.780   6.042
   21   1HA   GLY   3          1HA       GLY   3  -0.933   3.707   6.248
   22   2HA   GLY   3          2HA       GLY   3  -0.101   4.356   4.838
   23    H    TYR   4           H        TYR   4  -2.274   2.751   4.463
   24    HA   TYR   4           HA       TYR   4  -1.131   0.113   3.606
   25   1HB   TYR   4          1HB       TYR   4  -3.446   0.925   5.080
   26   2HB   TYR   4          2HB       TYR   4  -3.996   0.230   3.556
   27    HD1  TYR   4           HD1      TYR   4  -2.439  -1.932   2.851
   28    HD2  TYR   4           HD2      TYR   4  -3.289  -0.579   6.839
   29    HE1  TYR   4           HE1      TYR   4  -1.977  -4.207   3.722
   30    HE2  TYR   4           HE2      TYR   4  -2.825  -2.855   7.709
   31    HH   TYR   4           HH       TYR   4  -2.943  -5.326   6.546
   32    H    LEU   5           H        LEU   5  -0.615   0.314   1.416
   33    HA   LEU   5           HA       LEU   5  -1.434   2.192  -0.436
   34   1HB   LEU   5          1HB       LEU   5  -0.265  -0.417  -0.426
   35   2HB   LEU   5          2HB       LEU   5  -1.451  -0.359  -1.731
   36    HG   LEU   5           HG       LEU   5   0.894   1.504  -1.288
   37   1HD1  LEU   5          1HD1      LEU   5   0.598  -0.859  -2.757
   38   2HD1  LEU   5          2HD1      LEU   5   0.437   0.425  -3.954
   39   3HD1  LEU   5          3HD1      LEU   5   1.882   0.336  -2.947
   40   1HD2  LEU   5          1HD2      LEU   5  -1.620   1.823  -2.897
   41   2HD2  LEU   5          2HD2      LEU   5  -0.720   3.035  -1.984
   42   3HD2  LEU   5          3HD2      LEU   5  -0.108   2.467  -3.537
   43    H    VAL   6           H        VAL   6  -3.202   2.451  -1.834
   44    HA   VAL   6           HA       VAL   6  -5.681   0.996  -1.019
   45    HB   VAL   6           HB       VAL   6  -6.810   2.966  -1.896
   46   1HG1  VAL   6          1HG1      VAL   6  -4.557   3.206   0.001
   47   2HG1  VAL   6          2HG1      VAL   6  -5.140   4.734  -0.657
   48   3HG1  VAL   6          3HG1      VAL   6  -6.249   3.662   0.197
   49   1HG2  VAL   6          1HG2      VAL   6  -4.463   3.144  -3.503
   50   2HG2  VAL   6          2HG2      VAL   6  -5.913   4.144  -3.591
   51   3HG2  VAL   6          3HG2      VAL   6  -4.568   4.631  -2.558
   52    H    GLU   7           H        GLU   7  -7.271   1.290  -3.171
   53    HA   GLU   7           HA       GLU   7  -5.791   0.102  -5.492
   54   1HB   GLU   7          1HB       GLU   7  -6.997  -1.542  -3.959
   55   2HB   GLU   7          2HB       GLU   7  -8.504  -0.772  -4.458
   56   1HG   GLU   7          1HG       GLU   7  -8.408  -1.644  -6.578
   57   2HG   GLU   7          2HG       GLU   7  -6.646  -1.586  -6.633
   58    H    LYS   8           H        LYS   8  -7.340   0.137  -7.490
   59    HA   LYS   8           HA       LYS   8  -7.969   2.695  -8.316
   60   1HB   LYS   8          1HB       LYS   8  -9.253   0.016  -8.884
   61   2HB   LYS   8          2HB       LYS   8  -9.698   1.469  -9.781
   62   1HG   LYS   8          1HG       LYS   8  -6.907   0.302  -9.558
   63   2HG   LYS   8          2HG       LYS   8  -7.946   0.242 -10.982
   64   1HD   LYS   8          1HD       LYS   8  -8.013   2.858 -10.683
   65   2HD   LYS   8          2HD       LYS   8  -6.520   2.592  -9.781
   66   1HE   LYS   8          1HE       LYS   8  -7.051   1.686 -12.636
   67   2HE   LYS   8          2HE       LYS   8  -5.970   3.004 -12.139
   68   1HZ   LYS   8          1HZ       LYS   8  -5.144   1.038 -10.541
   69   2HZ   LYS   8          2HZ       LYS   8  -5.614   0.129 -11.893
   70   3HZ   LYS   8          3HZ       LYS   8  -4.450   1.356 -12.058
   71    H    THR   9           H        THR   9 -10.398   0.429  -6.956
   72    HA   THR   9           HA       THR   9 -12.491   2.381  -6.734
   73    HB   THR   9           HB       THR   9 -13.286   0.555  -5.026
   74    HG1  THR   9           HG1      THR   9 -11.394  -1.042  -6.282
   75   1HG2  THR   9          1HG2      THR   9 -13.578   0.845  -7.695
   76   2HG2  THR   9          2HG2      THR   9 -12.725  -0.699  -7.659
   77   3HG2  THR   9          3HG2      THR   9 -14.256  -0.517  -6.801
   78    H    GLY  10           H        GLY  10  -9.690   1.745  -4.800
   79   1HA   GLY  10          1HA       GLY  10  -9.048   3.540  -3.193
   80   2HA   GLY  10          2HA       GLY  10 -10.742   3.601  -2.702
   81    H    CYS  11           H        CYS  11 -11.014   0.658  -2.809
   82    HA   CYS  11           HA       CYS  11 -10.568  -0.050  -0.134
   83   1HB   CYS  11          1HB       CYS  11 -10.896  -1.480  -2.744
   84   2HB   CYS  11          2HB       CYS  11 -10.454  -2.436  -1.330
   85    H    LYS  12           H        LYS  12  -8.978  -1.889   0.546
   86    HA   LYS  12           HA       LYS  12  -6.250  -0.953   0.068
   87   1HB   LYS  12          1HB       LYS  12  -7.694  -2.942   1.764
   88   2HB   LYS  12          2HB       LYS  12  -5.966  -3.191   1.524
   89   1HG   LYS  12          1HG       LYS  12  -5.391  -1.198   2.581
   90   2HG   LYS  12          2HG       LYS  12  -6.965  -0.462   2.276
   91   1HD   LYS  12          1HD       LYS  12  -6.729  -1.066   4.656
   92   2HD   LYS  12          2HD       LYS  12  -8.004  -2.015   3.892
   93   1HE   LYS  12          1HE       LYS  12  -5.524  -3.416   3.541
   94   2HE   LYS  12          2HE       LYS  12  -5.703  -3.000   5.257
   95   1HZ   LYS  12          1HZ       LYS  12  -7.968  -4.050   3.669
   96   2HZ   LYS  12          2HZ       LYS  12  -6.879  -5.095   4.448
   97   3HZ   LYS  12          3HZ       LYS  12  -7.796  -3.997   5.359
   98    H    LYS  13           H        LYS  13  -4.681  -3.121  -0.058
   99    HA   LYS  13           HA       LYS  13  -5.526  -4.588  -2.538
  100   1HB   LYS  13          1HB       LYS  13  -3.502  -2.728  -2.225
  101   2HB   LYS  13          2HB       LYS  13  -2.646  -4.257  -2.023
  102   1HG   LYS  13          1HG       LYS  13  -4.271  -4.811  -4.165
  103   2HG   LYS  13          2HG       LYS  13  -3.887  -3.110  -4.435
  104   1HD   LYS  13          1HD       LYS  13  -1.624  -3.517  -4.691
  105   2HD   LYS  13          2HD       LYS  13  -1.661  -4.951  -3.665
  106   1HE   LYS  13          1HE       LYS  13  -2.417  -6.333  -5.387
  107   2HE   LYS  13          2HE       LYS  13  -3.162  -4.987  -6.272
  108   1HZ   LYS  13          1HZ       LYS  13  -0.836  -4.075  -6.486
  109   2HZ   LYS  13          2HZ       LYS  13  -0.275  -5.590  -5.971
  110   3HZ   LYS  13          3HZ       LYS  13  -1.171  -5.461  -7.409
  111    H    THR  14           H        THR  14  -4.849  -6.808  -2.633
  112    HA   THR  14           HA       THR  14  -4.083  -7.934   0.033
  113    HB   THR  14           HB       THR  14  -5.670  -8.986  -2.321
  114    HG1  THR  14           HG1      THR  14  -6.506  -8.894   0.346
  115   1HG2  THR  14          1HG2      THR  14  -4.128 -10.692  -1.178
  116   2HG2  THR  14          2HG2      THR  14  -5.130 -10.464   0.255
  117   3HG2  THR  14          3HG2      THR  14  -5.845 -11.089  -1.230
  118    H    CYS  15           H        CYS  15  -2.490  -9.569   0.116
  119    HA   CYS  15           HA       CYS  15  -1.038 -10.276  -2.380
  120   1HB   CYS  15          1HB       CYS  15   1.105  -9.623  -1.249
  121   2HB   CYS  15          2HB       CYS  15   0.045  -8.248  -1.556
  122    H    TYR  16           H        TYR  16  -0.745 -12.451  -2.295
  123    HA   TYR  16           HA       TYR  16  -1.260 -13.994   0.102
  124   1HB   TYR  16          1HB       TYR  16   0.057 -14.834  -2.496
  125   2HB   TYR  16          2HB       TYR  16  -0.861 -15.854  -1.386
  126    HD1  TYR  16           HD1      TYR  16  -3.325 -15.369  -1.020
  127    HD2  TYR  16           HD2      TYR  16  -1.039 -13.547  -4.166
  128    HE1  TYR  16           HE1      TYR  16  -5.425 -14.757  -2.188
  129    HE2  TYR  16           HE2      TYR  16  -3.138 -12.937  -5.338
  130    HH   TYR  16           HH       TYR  16  -5.967 -12.708  -4.031
  131    H    LYS  17           H        LYS  17   1.716 -13.197  -1.721
  132    HA   LYS  17           HA       LYS  17   3.467 -14.722   0.010
  133   1HB   LYS  17          1HB       LYS  17   3.602 -12.847  -2.267
  134   2HB   LYS  17          2HB       LYS  17   5.018 -12.814  -1.214
  135   1HG   LYS  17          1HG       LYS  17   3.818 -15.336  -2.395
  136   2HG   LYS  17          2HG       LYS  17   5.221 -14.496  -3.054
  137   1HD   LYS  17          1HD       LYS  17   6.585 -15.451  -1.538
  138   2HD   LYS  17          2HD       LYS  17   5.549 -14.928  -0.210
  139   1HE   LYS  17          1HE       LYS  17   5.606 -17.351  -0.157
  140   2HE   LYS  17          2HE       LYS  17   4.015 -16.891  -0.797
  141   1HZ   LYS  17          1HZ       LYS  17   5.116 -16.946  -3.055
  142   2HZ   LYS  17          2HZ       LYS  17   6.411 -17.752  -2.314
  143   3HZ   LYS  17          3HZ       LYS  17   4.865 -18.455  -2.314
  144    H    LEU  18           H        LEU  18   3.305 -14.125   2.185
  145    HA   LEU  18           HA       LEU  18   3.210 -11.318   3.021
  146   1HB   LEU  18          1HB       LEU  18   3.429 -14.009   4.386
  147   2HB   LEU  18          2HB       LEU  18   3.453 -12.500   5.297
  148    HG   LEU  18           HG       LEU  18   1.255 -13.324   3.380
  149   1HD1  LEU  18          1HD1      LEU  18   1.767 -13.978   6.171
  150   2HD1  LEU  18          2HD1      LEU  18   0.248 -13.105   5.981
  151   3HD1  LEU  18          3HD1      LEU  18   0.521 -14.602   5.091
  152   1HD2  LEU  18          1HD2      LEU  18   2.015 -10.809   4.431
  153   2HD2  LEU  18          2HD2      LEU  18   0.526 -11.202   3.572
  154   3HD2  LEU  18          3HD2      LEU  18   0.585 -11.309   5.331
  155    H    GLY  19           H        GLY  19   4.943 -10.111   3.833
  156   1HA   GLY  19          1HA       GLY  19   7.176  -9.970   4.847
  157   2HA   GLY  19          2HA       GLY  19   7.589 -11.476   4.029
  158    H    GLU  20           H        GLU  20   9.468 -10.076   3.342
  159    HA   GLU  20           HA       GLU  20   9.338  -7.844   1.648
  160   1HB   GLU  20          1HB       GLU  20  11.155 -10.175   2.066
  161   2HB   GLU  20          2HB       GLU  20  11.439  -9.179   0.638
  162   1HG   GLU  20          1HG       GLU  20  11.107  -7.983   3.394
  163   2HG   GLU  20          2HG       GLU  20  12.679  -8.474   2.763
  164    H    ASN  21           H        ASN  21   7.430  -8.120   0.303
  165    HA   ASN  21           HA       ASN  21   7.520 -10.275  -1.742
  166   1HB   ASN  21          1HB       ASN  21   5.454  -9.723  -0.438
  167   2HB   ASN  21          2HB       ASN  21   5.471  -8.112  -1.156
  168   1HD2  ASN  21          2HD2      ASN  21   3.720 -10.763  -1.491
  169   2HD2  ASN  21          1HD2      ASN  21   3.539 -10.849  -3.177
  170    H    ASP  22           H        ASP  22   9.208  -9.518  -3.110
  171    HA   ASP  22           HA       ASP  22   9.996  -7.115  -4.050
  172   1HB   ASP  22          1HB       ASP  22  11.034  -8.845  -5.136
  173   2HB   ASP  22          2HB       ASP  22   9.555  -9.792  -5.248
  174    H    PHE  23           H        PHE  23   7.179  -8.757  -5.591
  175    HA   PHE  23           HA       PHE  23   6.401  -6.596  -7.244
  176   1HB   PHE  23          1HB       PHE  23   5.543  -9.145  -6.677
  177   2HB   PHE  23          2HB       PHE  23   4.224  -8.172  -6.021
  178    HD1  PHE  23           HD1      PHE  23   6.361  -8.576  -9.064
  179    HD2  PHE  23           HD2      PHE  23   2.610  -7.239  -7.456
  180    HE1  PHE  23           HE1      PHE  23   5.524  -8.159 -11.362
  181    HE2  PHE  23           HE2      PHE  23   1.773  -6.822  -9.752
  182    HZ   PHE  23           HZ       PHE  23   3.230  -7.282 -11.705
  183    H    CYS  24           H        CYS  24   5.059  -7.450  -4.023
  184    HA   CYS  24           HA       CYS  24   3.503  -5.063  -3.727
  185   1HB   CYS  24          1HB       CYS  24   3.971  -7.457  -2.381
  186   2HB   CYS  24          2HB       CYS  24   4.585  -6.239  -1.263
  187    H    ASN  25           H        ASN  25   6.880  -5.835  -3.012
  188    HA   ASN  25           HA       ASN  25   7.518  -3.542  -1.417
  189   1HB   ASN  25          1HB       ASN  25   8.903  -5.574  -1.643
  190   2HB   ASN  25          2HB       ASN  25   9.180  -5.200  -3.345
  191   1HD2  ASN  25          2HD2      ASN  25  11.331  -4.512  -3.471
  192   2HD2  ASN  25          1HD2      ASN  25  12.030  -3.343  -2.457
  193    H    ARG  26           H        ARG  26   8.216  -4.124  -4.891
  194    HA   ARG  26           HA       ARG  26   9.020  -1.484  -5.538
  195   1HB   ARG  26          1HB       ARG  26   8.691  -3.918  -6.802
  196   2HB   ARG  26          2HB       ARG  26   7.457  -2.925  -7.580
  197   1HG   ARG  26          1HG       ARG  26   9.284  -1.150  -7.866
  198   2HG   ARG  26          2HG       ARG  26  10.427  -2.414  -7.424
  199   1HD   ARG  26          1HD       ARG  26  10.285  -3.379  -9.470
  200   2HD   ARG  26          2HD       ARG  26   8.515  -3.318  -9.456
  201    HE   ARG  26           HE       ARG  26  10.231  -1.493 -10.840
  202   1HH1  ARG  26          1HH1      ARG  26   7.487  -1.455  -8.723
  203   2HH1  ARG  26          2HH1      ARG  26   7.053   0.169  -9.128
  204   1HH2  ARG  26          1HH2      ARG  26   9.644   0.599 -11.382
  205   2HH2  ARG  26          2HH2      ARG  26   8.261   1.325 -10.632
  206    H    GLU  27           H        GLU  27   5.804  -2.975  -5.427
  207    HA   GLU  27           HA       GLU  27   4.179  -1.045  -6.612
  208   1HB   GLU  27          1HB       GLU  27   3.990  -3.010  -4.392
  209   2HB   GLU  27          2HB       GLU  27   2.721  -1.786  -4.437
  210   1HG   GLU  27          1HG       GLU  27   3.518  -3.412  -6.862
  211   2HG   GLU  27          2HG       GLU  27   2.234  -3.906  -5.758
  212    H    CYS  28           H        CYS  28   5.021  -1.098  -3.118
  213    HA   CYS  28           HA       CYS  28   4.065   1.631  -2.717
  214   1HB   CYS  28          1HB       CYS  28   3.959  -0.129  -0.998
  215   2HB   CYS  28          2HB       CYS  28   5.718  -0.268  -1.016
  216    H    LYS  29           H        LYS  29   6.960   0.301  -3.944
  217    HA   LYS  29           HA       LYS  29   8.709   2.471  -2.964
  218   1HB   LYS  29          1HB       LYS  29   9.108  -0.126  -3.577
  219   2HB   LYS  29          2HB       LYS  29   9.511   0.595  -5.137
  220   1HG   LYS  29          1HG       LYS  29  10.663   2.000  -2.811
  221   2HG   LYS  29          2HG       LYS  29  11.270   0.361  -3.050
  222   1HD   LYS  29          1HD       LYS  29  12.088   0.842  -5.204
  223   2HD   LYS  29          2HD       LYS  29  11.081   2.282  -5.363
  224   1HE   LYS  29          1HE       LYS  29  12.643   3.594  -4.360
  225   2HE   LYS  29          2HE       LYS  29  12.902   2.414  -3.060
  226   1HZ   LYS  29          1HZ       LYS  29  13.835   1.904  -5.819
  227   2HZ   LYS  29          2HZ       LYS  29  14.799   2.754  -4.712
  228   3HZ   LYS  29          3HZ       LYS  29  14.333   1.154  -4.378
  229    H    TRP  30           H        TRP  30   6.308   2.553  -5.100
  230    HA   TRP  30           HA       TRP  30   7.186   3.327  -7.623
  231   1HB   TRP  30          1HB       TRP  30   4.933   3.858  -5.824
  232   2HB   TRP  30          2HB       TRP  30   5.208   5.167  -6.974
  233    HD1  TRP  30           HD1      TRP  30   3.095   2.389  -6.794
  234    HE1  TRP  30           HE1      TRP  30   2.623   1.299  -9.080
  235    HE3  TRP  30           HE3      TRP  30   6.914   4.394  -9.536
  236    HZ2  TRP  30           HZ2      TRP  30   3.718   1.277 -11.723
  237    HZ3  TRP  30           HZ3      TRP  30   7.173   3.820 -11.934
  238    HH2  TRP  30           HH2      TRP  30   5.582   2.266 -13.029
  239    H    LYS  31           H        LYS  31   8.508   4.945  -8.355
  240    HA   LYS  31           HA       LYS  31   9.978   6.695  -6.701
  241   1HB   LYS  31          1HB       LYS  31   9.121   7.151  -9.575
  242   2HB   LYS  31          2HB       LYS  31  10.591   7.745  -8.802
  243   1HG   LYS  31          1HG       LYS  31  10.360   4.868  -8.496
  244   2HG   LYS  31          2HG       LYS  31  10.294   5.325 -10.199
  245   1HD   LYS  31          1HD       LYS  31  12.380   6.519 -10.037
  246   2HD   LYS  31          2HD       LYS  31  12.403   6.348  -8.282
  247   1HE   LYS  31          1HE       LYS  31  13.712   4.516  -8.698
  248   2HE   LYS  31          2HE       LYS  31  12.180   3.721  -9.115
  249   1HZ   LYS  31          1HZ       LYS  31  12.441   4.653 -11.386
  250   2HZ   LYS  31          2HZ       LYS  31  13.997   5.183 -10.957
  251   3HZ   LYS  31          3HZ       LYS  31  13.639   3.523 -10.981
  252    H    HIS  32           H        HIS  32   6.763   7.063  -8.089
  253    HA   HIS  32           HA       HIS  32   6.533   9.918  -7.596
  254   1HB   HIS  32          1HB       HIS  32   4.458   7.727  -7.955
  255   2HB   HIS  32          2HB       HIS  32   4.160   9.458  -8.120
  256    HD1  HIS  32           HD1      HIS  32   6.697  10.250  -9.701
  257    HD2  HIS  32           HD2      HIS  32   4.322   6.954 -10.633
  258    HE1  HIS  32           HE1      HIS  32   7.131   9.722 -12.140
  259    H    ILE  33           H        ILE  33   6.380   7.106  -5.624
  260    HA   ILE  33           HA       ILE  33   4.924   8.586  -3.470
  261    HB   ILE  33           HB       ILE  33   5.275   5.728  -4.308
  262   1HG1  ILE  33          1HG1      ILE  33   2.867   5.675  -3.860
  263   2HG1  ILE  33          2HG1      ILE  33   2.941   7.289  -3.155
  264   1HG2  ILE  33          1HG2      ILE  33   4.863   6.678  -1.467
  265   2HG2  ILE  33          2HG2      ILE  33   4.296   5.100  -2.015
  266   3HG2  ILE  33          3HG2      ILE  33   6.017   5.483  -2.061
  267   1HD1  ILE  33          1HD1      ILE  33   3.860   6.765  -5.983
  268   2HD1  ILE  33          2HD1      ILE  33   2.171   7.110  -5.612
  269   3HD1  ILE  33          3HD1      ILE  33   3.416   8.303  -5.242
  270    H    GLY  34           H        GLY  34   8.003   7.441  -4.472
  271   1HA   GLY  34          1HA       GLY  34  10.057   7.178  -3.337
  272   2HA   GLY  34          2HA       GLY  34   9.560   8.686  -2.574
  273    H    GLY  35           H        GLY  35   8.016   5.517  -2.223
  274   1HA   GLY  35          1HA       GLY  35   7.858   5.767   0.634
  275   2HA   GLY  35          2HA       GLY  35   7.555   4.285  -0.275
  276    H    SER  36           H        SER  36   9.274   5.102   2.219
  277    HA   SER  36           HA       SER  36  12.016   4.499   1.521
  278   1HB   SER  36          1HB       SER  36  12.318   4.984   3.735
  279   2HB   SER  36          2HB       SER  36  10.635   5.502   3.669
  280    HG   SER  36           HG       SER  36  10.035   3.716   4.673
  281    H    TYR  37           H        TYR  37   9.504   2.547   3.184
  282    HA   TYR  37           HA       TYR  37  10.737   0.083   2.016
  283   1HB   TYR  37          1HB       TYR  37  10.893   1.028   4.713
  284   2HB   TYR  37          2HB       TYR  37   9.862  -0.402   4.703
  285    HD1  TYR  37           HD1      TYR  37  10.728  -2.504   3.495
  286    HD2  TYR  37           HD2      TYR  37  13.235   0.827   4.533
  287    HE1  TYR  37           HE1      TYR  37  12.734  -3.942   3.265
  288    HE2  TYR  37           HE2      TYR  37  15.241  -0.614   4.303
  289    HH   TYR  37           HH       TYR  37  15.773  -2.815   2.930
  290    H    GLY  38           H        GLY  38   9.152  -1.347   1.301
  291   1HA   GLY  38          1HA       GLY  38   6.473  -1.305   2.516
  292   2HA   GLY  38          2HA       GLY  38   6.536  -0.776   0.836
  293    H    TYR  39           H        TYR  39   5.124  -3.091   1.697
  294    HA   TYR  39           HA       TYR  39   5.885  -5.021  -0.218
  295   1HB   TYR  39          1HB       TYR  39   6.868  -6.714   1.503
  296   2HB   TYR  39          2HB       TYR  39   7.916  -5.428   0.910
  297    HD1  TYR  39           HD1      TYR  39   5.369  -5.961   3.631
  298    HD2  TYR  39           HD2      TYR  39   9.139  -4.250   2.486
  299    HE1  TYR  39           HE1      TYR  39   5.711  -5.158   5.953
  300    HE2  TYR  39           HE2      TYR  39   9.480  -3.448   4.807
  301    HH   TYR  39           HH       TYR  39   8.636  -3.317   6.847
  302    H    CYS  40           H        CYS  40   5.095  -7.404   0.806
  303    HA   CYS  40           HA       CYS  40   2.260  -6.999   1.323
  304   1HB   CYS  40          1HB       CYS  40   3.168  -8.828  -0.049
  305   2HB   CYS  40          2HB       CYS  40   4.041  -9.458   1.349
  306    H    TYR  41           H        TYR  41   1.287  -6.862   3.300
  307    HA   TYR  41           HA       TYR  41   2.536  -8.140   5.673
  308   1HB   TYR  41          1HB       TYR  41   3.572  -5.983   5.671
  309   2HB   TYR  41          2HB       TYR  41   2.063  -5.182   5.237
  310    HD1  TYR  41           HD1      TYR  41   3.020  -7.706   7.852
  311    HD2  TYR  41           HD2      TYR  41   1.253  -3.888   6.985
  312    HE1  TYR  41           HE1      TYR  41   2.479  -7.410  10.255
  313    HE2  TYR  41           HE2      TYR  41   0.712  -3.592   9.387
  314    HH   TYR  41           HH       TYR  41   0.696  -4.543  11.395
  315    H    GLY  42           H        GLY  42   0.822  -9.253   6.567
  316   1HA   GLY  42          1HA       GLY  42  -1.331  -9.657   7.430
  317   2HA   GLY  42          2HA       GLY  42  -1.625  -7.918   7.324
  318    H    PHE  43           H        PHE  43  -0.771 -10.183   4.732
  319    HA   PHE  43           HA       PHE  43  -1.870 -10.693   2.714
  320   1HB   PHE  43          1HB       PHE  43  -4.157 -10.152   4.625
  321   2HB   PHE  43          2HB       PHE  43  -4.406 -10.763   2.989
  322    HD1  PHE  43           HD1      PHE  43  -2.271 -12.644   2.536
  323    HD2  PHE  43           HD2      PHE  43  -4.471 -11.892   6.150
  324    HE1  PHE  43           HE1      PHE  43  -1.773 -14.944   3.320
  325    HE2  PHE  43           HE2      PHE  43  -3.974 -14.192   6.931
  326    HZ   PHE  43           HZ       PHE  43  -2.625 -15.719   5.516
  327    H    GLY  44           H        GLY  44  -0.918  -7.990   3.036
  328   1HA   GLY  44          1HA       GLY  44  -2.366  -6.694   0.910
  329   2HA   GLY  44          2HA       GLY  44  -2.758  -5.941   2.456
  330    H    CYS  45           H        CYS  45  -1.190  -4.881   0.118
  331    HA   CYS  45           HA       CYS  45   1.606  -4.747   0.840
  332   1HB   CYS  45          1HB       CYS  45  -0.145  -3.894  -1.222
  333   2HB   CYS  45          2HB       CYS  45   0.652  -2.443  -0.618
  334    H    TYR  46           H        TYR  46   2.580  -3.456   2.360
  335    HA   TYR  46           HA       TYR  46   0.957  -1.235   3.555
  336   1HB   TYR  46          1HB       TYR  46   1.538  -3.435   4.846
  337   2HB   TYR  46          2HB       TYR  46   3.155  -2.739   4.960
  338    HD1  TYR  46           HD1      TYR  46  -0.445  -1.924   5.552
  339    HD2  TYR  46           HD2      TYR  46   3.638  -1.164   6.645
  340    HE1  TYR  46           HE1      TYR  46  -1.215  -0.471   7.406
  341    HE2  TYR  46           HE2      TYR  46   2.868   0.290   8.502
  342    HH   TYR  46           HH       TYR  46   0.091   1.659   8.730
  343    H    CYS  47           H        CYS  47   2.171   0.681   4.141
  344    HA   CYS  47           HA       CYS  47   4.852   0.883   2.803
  345   1HB   CYS  47          1HB       CYS  47   2.476   2.743   2.981
  346   2HB   CYS  47          2HB       CYS  47   4.074   3.326   2.517
  347    H    GLU  48           H        GLU  48   6.472   1.947   3.955
  348    HA   GLU  48           HA       GLU  48   5.767   3.046   6.653
  349   1HB   GLU  48          1HB       GLU  48   7.215   0.679   5.962
  350   2HB   GLU  48          2HB       GLU  48   8.364   1.830   6.648
  351   1HG   GLU  48          1HG       GLU  48   5.982   1.946   8.215
  352   2HG   GLU  48          2HG       GLU  48   6.415   0.246   8.022
  353    H    GLY  49           H        GLY  49   6.994   4.895   7.230
  354   1HA   GLY  49          1HA       GLY  49   8.340   6.785   6.852
  355   2HA   GLY  49          2HA       GLY  49   9.430   5.702   5.984
  356    H    LEU  50           H        LEU  50   6.053   6.393   5.231
  357    HA   LEU  50           HA       LEU  50   6.873   7.160   2.487
  358   1HB   LEU  50          1HB       LEU  50   4.303   6.992   2.203
  359   2HB   LEU  50          2HB       LEU  50   5.180   5.502   2.535
  360    HG   LEU  50           HG       LEU  50   4.255   7.013   4.917
  361   1HD1  LEU  50          1HD1      LEU  50   2.451   6.206   2.746
  362   2HD1  LEU  50          2HD1      LEU  50   2.028   5.494   4.304
  363   3HD1  LEU  50          3HD1      LEU  50   2.140   7.247   4.136
  364   1HD2  LEU  50          1HD2      LEU  50   5.134   4.396   4.220
  365   2HD2  LEU  50          2HD2      LEU  50   4.670   4.986   5.816
  366   3HD2  LEU  50          3HD2      LEU  50   3.462   4.252   4.761
  367    HA   PRO  51           HA       PRO  51   6.382  11.476   3.439
  368   1HB   PRO  51          1HB       PRO  51   5.766  12.036   0.684
  369   2HB   PRO  51          2HB       PRO  51   7.292  12.293   1.535
  370   1HG   PRO  51          1HG       PRO  51   6.708  10.317  -0.455
  371   2HG   PRO  51          2HG       PRO  51   8.221  10.554   0.423
  372   1HD   PRO  51          1HD       PRO  51   6.301   8.415   0.734
  373   2HD   PRO  51          2HD       PRO  51   7.841   8.642   1.599
  374    H    ASP  52           H        ASP  52   4.674  13.205   3.126
  375    HA   ASP  52           HA       ASP  52   2.028  12.180   3.631
  376   1HB   ASP  52          1HB       ASP  52   3.259  14.395   4.294
  377   2HB   ASP  52          2HB       ASP  52   2.668  14.986   2.741
  378    H    SER  53           H        SER  53   3.737  12.811   0.715
  379    HA   SER  53           HA       SER  53   1.415  13.458  -0.936
  380   1HB   SER  53          1HB       SER  53   3.150  14.134  -2.210
  381   2HB   SER  53          2HB       SER  53   4.276  13.380  -1.086
  382    HG   SER  53           HG       SER  53   2.903  12.107  -3.227
  383    H    THR  54           H        THR  54   2.813  10.549   0.300
  384    HA   THR  54           HA       THR  54   2.095   8.719  -1.793
  385    HB   THR  54           HB       THR  54   2.389   8.382   1.210
  386    HG1  THR  54           HG1      THR  54   4.159   9.194  -0.279
  387   1HG2  THR  54          1HG2      THR  54   1.821   6.500  -0.994
  388   2HG2  THR  54          2HG2      THR  54   3.140   6.017   0.072
  389   3HG2  THR  54          3HG2      THR  54   1.537   6.327   0.738
  390    H    GLN  55           H        GLN  55   0.116   7.866  -2.313
  391    HA   GLN  55           HA       GLN  55  -2.257   8.712  -0.737
  392   1HB   GLN  55          1HB       GLN  55  -1.686   8.642  -3.393
  393   2HB   GLN  55          2HB       GLN  55  -2.473   7.075  -3.211
  394   1HG   GLN  55          1HG       GLN  55  -3.602   9.813  -2.612
  395   2HG   GLN  55          2HG       GLN  55  -4.236   8.586  -3.708
  396   1HE2  GLN  55          2HE2      GLN  55  -3.951   9.493  -0.292
  397   2HE2  GLN  55          1HE2      GLN  55  -5.078   8.360   0.282
  398    H    THR  56           H        THR  56  -2.810   7.286   0.910
  399    HA   THR  56           HA       THR  56  -2.836   4.372   0.238
  400    HB   THR  56           HB       THR  56  -2.095   4.414   2.866
  401    HG1  THR  56           HG1      THR  56  -1.163   6.218   3.327
  402   1HG2  THR  56          1HG2      THR  56  -0.787   4.036   0.273
  403   2HG2  THR  56          2HG2      THR  56   0.337   4.502   1.548
  404   3HG2  THR  56          3HG2      THR  56  -0.667   3.067   1.742
  405    H    TRP  57           H        TRP  57  -3.934   3.220   2.273
  406    HA   TRP  57           HA       TRP  57  -6.613   4.413   2.579
  407   1HB   TRP  57          1HB       TRP  57  -5.569   1.925   2.152
  408   2HB   TRP  57          2HB       TRP  57  -5.789   1.881   3.896
  409    HD1  TRP  57           HD1      TRP  57  -7.922   3.174   0.925
  410    HE1  TRP  57           HE1      TRP  57 -10.349   2.381   1.282
  411    HE3  TRP  57           HE3      TRP  57  -7.380   0.615   5.312
  412    HZ2  TRP  57           HZ2      TRP  57 -11.860   0.862   3.175
  413    HZ3  TRP  57           HZ3      TRP  57  -9.330  -0.494   6.368
  414    HH2  TRP  57           HH2      TRP  57 -11.567  -0.373   5.306
  415    HA   PRO  58           HA       PRO  58  -8.239   3.913   3.927
  416   1HB   PRO  58          1HB       PRO  58  -9.683   5.512   5.708
  417   2HB   PRO  58          2HB       PRO  58  -9.457   3.765   5.836
  418   1HG   PRO  58          1HG       PRO  58  -8.352   5.855   7.518
  419   2HG   PRO  58          2HG       PRO  58  -8.267   4.105   7.737
  420   1HD   PRO  58          1HD       PRO  58  -6.178   5.906   6.816
  421   2HD   PRO  58          2HD       PRO  58  -6.064   4.158   7.144
  422    H    LEU  59           H        LEU  59  -9.936   5.472   3.055
  423    HA   LEU  59           HA       LEU  59  -8.626   7.941   2.052
  424   1HB   LEU  59          1HB       LEU  59 -10.818   6.076   1.298
  425   2HB   LEU  59          2HB       LEU  59 -11.048   7.755   0.819
  426    HG   LEU  59           HG       LEU  59  -9.842   6.317  -0.886
  427   1HD1  LEU  59          1HD1      LEU  59  -8.396   8.706   0.297
  428   2HD1  LEU  59          2HD1      LEU  59  -8.058   8.025  -1.295
  429   3HD1  LEU  59          3HD1      LEU  59  -9.634   8.744  -0.959
  430   1HD2  LEU  59          1HD2      LEU  59  -7.680   6.436   1.241
  431   2HD2  LEU  59          2HD2      LEU  59  -8.529   4.985   0.710
  432   3HD2  LEU  59          3HD2      LEU  59  -7.456   5.834  -0.402
  433    HA   PRO  60           HA       PRO  60 -10.923  10.904   4.375
  434   1HB   PRO  60          1HB       PRO  60 -12.536  11.894   2.166
  435   2HB   PRO  60          2HB       PRO  60 -11.177  12.675   2.980
  436   1HG   PRO  60          1HG       PRO  60 -11.187  11.547   0.373
  437   2HG   PRO  60          2HG       PRO  60  -9.795  12.184   1.254
  438   1HD   PRO  60          1HD       PRO  60 -10.386   9.429   0.616
  439   2HD   PRO  60          2HD       PRO  60  -8.966  10.071   1.473
  440    H    ASN  61           H        ASN  61 -13.526  11.814   4.241
  441    HA   ASN  61           HA       ASN  61 -15.094   9.817   5.422
  442   1HB   ASN  61          1HB       ASN  61 -15.505  12.304   5.306
  443   2HB   ASN  61          2HB       ASN  61 -16.071  12.079   3.650
  444   1HD2  ASN  61          2HD2      ASN  61 -18.242  11.477   3.385
  445   2HD2  ASN  61          1HD2      ASN  61 -19.259  10.974   4.647
  446    H    LYS  62           H        LYS  62 -14.422  10.394   2.047
  447    HA   LYS  62           HA       LYS  62 -16.574   8.609   1.099
  448   1HB   LYS  62          1HB       LYS  62 -15.655   9.207  -1.097
  449   2HB   LYS  62          2HB       LYS  62 -15.804  10.661  -0.108
  450   1HG   LYS  62          1HG       LYS  62 -13.586  11.031  -0.203
  451   2HG   LYS  62          2HG       LYS  62 -13.242   9.388   0.341
  452   1HD   LYS  62          1HD       LYS  62 -12.270   9.665  -1.861
  453   2HD   LYS  62          2HD       LYS  62 -13.667   8.597  -2.010
  454   1HE   LYS  62          1HE       LYS  62 -14.917  10.167  -3.160
  455   2HE   LYS  62          2HE       LYS  62 -14.132  11.536  -2.349
  456   1HZ   LYS  62          1HZ       LYS  62 -12.231   9.975  -3.775
  457   2HZ   LYS  62          2HZ       LYS  62 -13.470  10.486  -4.819
  458   3HZ   LYS  62          3HZ       LYS  62 -12.587  11.628  -3.931
  459    H    THR  63           H        THR  63 -15.240   7.039   2.779
  460    HA   THR  63           HA       THR  63 -12.864   5.760   1.757
  461    HB   THR  63           HB       THR  63 -15.010   4.830   3.690
  462    HG1  THR  63           HG1      THR  63 -12.799   5.604   4.889
  463   1HG2  THR  63          1HG2      THR  63 -12.183   3.889   3.164
  464   2HG2  THR  63          2HG2      THR  63 -13.088   3.470   4.618
  465   3HG2  THR  63          3HG2      THR  63 -13.668   2.947   3.037
  466    H    CYS  64           H        CYS  64 -12.933   3.309   1.288
  467    HA   CYS  64           HA       CYS  64 -14.431   2.809  -1.098
  468   1HB   CYS  64          1HB       CYS  64 -12.210   1.844  -0.136
  469   2HB   CYS  64          2HB       CYS  64 -13.251   0.704   0.715
  Start of MODEL   21
    1   1H    LYS   1          1H        LYS   1   5.880   7.209   9.782
    2   2H    LYS   1          2H        LYS   1   5.470   8.662  10.562
    3   3H    LYS   1          3H        LYS   1   4.512   7.277  10.783
    4    HA   LYS   1           HA       LYS   1   3.338   8.661   9.267
    5   1HB   LYS   1          1HB       LYS   1   4.532   9.591   7.321
    6   2HB   LYS   1          2HB       LYS   1   5.357  10.038   8.815
    7   1HG   LYS   1          1HG       LYS   1   6.923   8.133   8.496
    8   2HG   LYS   1          2HG       LYS   1   6.126   7.760   6.967
    9   1HD   LYS   1          1HD       LYS   1   7.642  10.286   7.673
   10   2HD   LYS   1          2HD       LYS   1   8.070   9.089   6.449
   11   1HE   LYS   1          1HE       LYS   1   5.533   9.757   5.654
   12   2HE   LYS   1          2HE       LYS   1   6.121  11.304   6.294
   13   1HZ   LYS   1          1HZ       LYS   1   8.287  10.568   5.046
   14   2HZ   LYS   1          2HZ       LYS   1   7.197   9.672   4.106
   15   3HZ   LYS   1          3HZ       LYS   1   7.037  11.360   4.213
   16    H    ASP   2           H        ASP   2   3.520   5.865   9.651
   17    HA   ASP   2           HA       ASP   2   4.013   4.511   7.105
   18   1HB   ASP   2          1HB       ASP   2   2.463   3.495   9.496
   19   2HB   ASP   2          2HB       ASP   2   3.450   2.567   8.367
   20    H    GLY   3           H        GLY   3   2.325   3.517   5.800
   21   1HA   GLY   3          1HA       GLY   3  -0.478   4.161   6.362
   22   2HA   GLY   3          2HA       GLY   3   0.196   5.035   4.988
   23    H    TYR   4           H        TYR   4  -1.847   3.436   4.398
   24    HA   TYR   4           HA       TYR   4  -0.656   0.931   3.251
   25   1HB   TYR   4          1HB       TYR   4  -3.155   1.648   4.649
   26   2HB   TYR   4          2HB       TYR   4  -3.398   0.662   3.209
   27    HD1  TYR   4           HD1      TYR   4  -1.728  -1.393   2.971
   28    HD2  TYR   4           HD2      TYR   4  -2.683   0.584   6.661
   29    HE1  TYR   4           HE1      TYR   4  -1.033  -3.412   4.233
   30    HE2  TYR   4           HE2      TYR   4  -1.985  -1.433   7.923
   31    HH   TYR   4           HH       TYR   4  -1.809  -4.303   6.833
   32    H    LEU   5           H        LEU   5  -0.347   1.189   1.033
   33    HA   LEU   5           HA       LEU   5  -1.495   3.321  -0.500
   34   1HB   LEU   5          1HB       LEU   5   0.320   1.137  -0.817
   35   2HB   LEU   5          2HB       LEU   5  -0.843   1.064  -2.141
   36    HG   LEU   5           HG       LEU   5   0.394   3.698  -1.392
   37   1HD1  LEU   5          1HD1      LEU   5   2.265   2.093  -1.672
   38   2HD1  LEU   5          2HD1      LEU   5   1.615   1.627  -3.243
   39   3HD1  LEU   5          3HD1      LEU   5   2.213   3.266  -2.987
   40   1HD2  LEU   5          1HD2      LEU   5  -0.845   2.431  -3.840
   41   2HD2  LEU   5          2HD2      LEU   5  -1.357   3.885  -2.983
   42   3HD2  LEU   5          3HD2      LEU   5   0.114   3.905  -3.954
   43    H    VAL   6           H        VAL   6  -3.158   3.161  -2.164
   44    HA   VAL   6           HA       VAL   6  -5.216   1.068  -1.550
   45    HB   VAL   6           HB       VAL   6  -6.820   2.760  -2.270
   46   1HG1  VAL   6          1HG1      VAL   6  -4.685   3.586  -0.321
   47   2HG1  VAL   6          2HG1      VAL   6  -6.033   4.669  -0.667
   48   3HG1  VAL   6          3HG1      VAL   6  -6.338   3.065   0.001
   49   1HG2  VAL   6          1HG2      VAL   6  -4.317   4.227  -3.111
   50   2HG2  VAL   6          2HG2      VAL   6  -5.750   3.867  -4.070
   51   3HG2  VAL   6          3HG2      VAL   6  -5.822   5.090  -2.802
   52    H    GLU   7           H        GLU   7  -6.799   1.196  -3.741
   53    HA   GLU   7           HA       GLU   7  -4.976   0.560  -6.044
   54   1HB   GLU   7          1HB       GLU   7  -7.303  -0.810  -4.783
   55   2HB   GLU   7          2HB       GLU   7  -7.202  -0.893  -6.539
   56   1HG   GLU   7          1HG       GLU   7  -4.594  -1.363  -5.419
   57   2HG   GLU   7          2HG       GLU   7  -5.761  -2.446  -4.659
   58    H    LYS   8           H        LYS   8  -6.121   0.847  -8.203
   59    HA   LYS   8           HA       LYS   8  -7.083   3.443  -8.615
   60   1HB   LYS   8          1HB       LYS   8  -6.862   0.923 -10.038
   61   2HB   LYS   8          2HB       LYS   8  -8.316   1.791 -10.534
   62   1HG   LYS   8          1HG       LYS   8  -7.017   3.102 -11.823
   63   2HG   LYS   8          2HG       LYS   8  -6.296   3.747 -10.350
   64   1HD   LYS   8          1HD       LYS   8  -4.352   2.683 -10.755
   65   2HD   LYS   8          2HD       LYS   8  -5.183   1.142 -10.973
   66   1HE   LYS   8          1HE       LYS   8  -5.166   1.323 -13.251
   67   2HE   LYS   8          2HE       LYS   8  -5.525   3.060 -13.205
   68   1HZ   LYS   8          1HZ       LYS   8  -3.172   3.200 -12.162
   69   2HZ   LYS   8          2HZ       LYS   8  -2.930   1.696 -12.914
   70   3HZ   LYS   8          3HZ       LYS   8  -3.324   3.060 -13.845
   71    H    THR   9           H        THR   9  -8.809   0.641  -7.431
   72    HA   THR   9           HA       THR   9 -11.470   1.862  -7.845
   73    HB   THR   9           HB       THR   9 -12.066  -0.296  -6.529
   74    HG1  THR   9           HG1      THR   9 -10.467  -1.565  -6.002
   75   1HG2  THR   9          1HG2      THR   9 -10.575  -0.448  -9.162
   76   2HG2  THR   9          2HG2      THR   9 -11.639  -1.704  -8.529
   77   3HG2  THR   9          3HG2      THR   9 -12.297  -0.124  -8.958
   78    H    GLY  10           H        GLY  10  -8.976   1.901  -5.501
   79   1HA   GLY  10          1HA       GLY  10  -9.032   3.393  -3.596
   80   2HA   GLY  10          2HA       GLY  10 -10.792   3.262  -3.583
   81    H    CYS  11           H        CYS  11 -10.357   0.238  -4.023
   82    HA   CYS  11           HA       CYS  11 -10.495  -0.493  -1.203
   83   1HB   CYS  11          1HB       CYS  11 -10.675  -1.815  -3.889
   84   2HB   CYS  11          2HB       CYS  11 -10.475  -2.830  -2.461
   85    H    LYS  12           H        LYS  12  -8.824  -1.287   0.049
   86    HA   LYS  12           HA       LYS  12  -6.101  -1.048  -0.727
   87   1HB   LYS  12          1HB       LYS  12  -5.749  -2.444   1.350
   88   2HB   LYS  12          2HB       LYS  12  -6.795  -1.050   1.583
   89   1HG   LYS  12          1HG       LYS  12  -8.772  -2.420   1.508
   90   2HG   LYS  12          2HG       LYS  12  -7.845  -3.823   0.975
   91   1HD   LYS  12          1HD       LYS  12  -6.500  -3.275   3.236
   92   2HD   LYS  12          2HD       LYS  12  -8.074  -2.625   3.692
   93   1HE   LYS  12          1HE       LYS  12  -8.462  -5.168   2.391
   94   2HE   LYS  12          2HE       LYS  12  -7.287  -5.349   3.709
   95   1HZ   LYS  12          1HZ       LYS  12  -9.721  -3.722   4.074
   96   2HZ   LYS  12          2HZ       LYS  12  -9.778  -5.406   4.291
   97   3HZ   LYS  12          3HZ       LYS  12  -8.748  -4.457   5.253
   98    H    LYS  13           H        LYS  13  -4.693  -3.249  -0.253
   99    HA   LYS  13           HA       LYS  13  -5.790  -5.419  -2.003
  100   1HB   LYS  13          1HB       LYS  13  -4.019  -3.537  -2.857
  101   2HB   LYS  13          2HB       LYS  13  -2.905  -4.749  -2.221
  102   1HG   LYS  13          1HG       LYS  13  -4.859  -6.197  -3.642
  103   2HG   LYS  13          2HG       LYS  13  -4.461  -4.815  -4.663
  104   1HD   LYS  13          1HD       LYS  13  -1.981  -5.633  -3.732
  105   2HD   LYS  13          2HD       LYS  13  -2.835  -7.156  -3.982
  106   1HE   LYS  13          1HE       LYS  13  -3.091  -6.794  -6.277
  107   2HE   LYS  13          2HE       LYS  13  -2.966  -5.031  -6.112
  108   1HZ   LYS  13          1HZ       LYS  13  -0.693  -6.576  -5.165
  109   2HZ   LYS  13          2HZ       LYS  13  -0.917  -6.563  -6.846
  110   3HZ   LYS  13          3HZ       LYS  13  -0.727  -5.099  -6.004
  111    H    THR  14           H        THR  14  -5.467  -7.419  -1.081
  112    HA   THR  14           HA       THR  14  -3.766  -7.581   1.358
  113    HB   THR  14           HB       THR  14  -5.883  -9.362   0.111
  114    HG1  THR  14           HG1      THR  14  -6.166  -8.240   2.618
  115   1HG2  THR  14          1HG2      THR  14  -4.144  -9.701   2.547
  116   2HG2  THR  14          2HG2      THR  14  -5.746 -10.435   2.473
  117   3HG2  THR  14          3HG2      THR  14  -4.519 -10.876   1.287
  118    H    CYS  15           H        CYS  15  -2.332  -9.463   1.592
  119    HA   CYS  15           HA       CYS  15  -1.530 -10.794  -0.956
  120   1HB   CYS  15          1HB       CYS  15   0.878 -10.276  -0.206
  121   2HB   CYS  15          2HB       CYS  15  -0.059  -8.916  -0.826
  122    H    TYR  16           H        TYR  16  -1.353 -12.958  -0.565
  123    HA   TYR  16           HA       TYR  16  -1.490 -14.019   2.150
  124   1HB   TYR  16          1HB       TYR  16  -1.829 -14.859  -0.601
  125   2HB   TYR  16          2HB       TYR  16  -0.850 -16.035   0.272
  126    HD1  TYR  16           HD1      TYR  16  -2.029 -15.566   3.047
  127    HD2  TYR  16           HD2      TYR  16  -3.865 -16.095  -0.803
  128    HE1  TYR  16           HE1      TYR  16  -4.070 -16.452   4.140
  129    HE2  TYR  16           HE2      TYR  16  -5.903 -16.984   0.293
  130    HH   TYR  16           HH       TYR  16  -6.846 -17.579   2.207
  131    H    LYS  17           H        LYS  17   1.005 -13.716  -0.356
  132    HA   LYS  17           HA       LYS  17   2.991 -15.325   1.000
  133   1HB   LYS  17          1HB       LYS  17   3.429 -13.079  -0.982
  134   2HB   LYS  17          2HB       LYS  17   4.407 -14.530  -0.762
  135   1HG   LYS  17          1HG       LYS  17   1.724 -15.363  -1.259
  136   2HG   LYS  17          2HG       LYS  17   2.149 -14.165  -2.481
  137   1HD   LYS  17          1HD       LYS  17   4.005 -15.421  -3.235
  138   2HD   LYS  17          2HD       LYS  17   4.020 -16.427  -1.786
  139   1HE   LYS  17          1HE       LYS  17   2.918 -17.908  -3.169
  140   2HE   LYS  17          2HE       LYS  17   1.503 -16.939  -2.711
  141   1HZ   LYS  17          1HZ       LYS  17   3.263 -16.075  -4.914
  142   2HZ   LYS  17          2HZ       LYS  17   2.037 -17.215  -5.202
  143   3HZ   LYS  17          3HZ       LYS  17   1.643 -15.666  -4.625
  144    H    LEU  18           H        LEU  18   2.843 -14.367   3.214
  145    HA   LEU  18           HA       LEU  18   3.404 -11.628   3.802
  146   1HB   LEU  18          1HB       LEU  18   3.558 -14.278   5.201
  147   2HB   LEU  18          2HB       LEU  18   4.244 -12.862   5.998
  148    HG   LEU  18           HG       LEU  18   1.404 -13.109   4.963
  149   1HD1  LEU  18          1HD1      LEU  18   1.860 -14.412   7.022
  150   2HD1  LEU  18          2HD1      LEU  18   2.497 -12.957   7.789
  151   3HD1  LEU  18          3HD1      LEU  18   0.793 -13.045   7.343
  152   1HD2  LEU  18          1HD2      LEU  18   3.070 -10.829   5.621
  153   2HD2  LEU  18          2HD2      LEU  18   1.429 -10.854   4.973
  154   3HD2  LEU  18          3HD2      LEU  18   1.691 -10.923   6.715
  155    H    GLY  19           H        GLY  19   5.323 -10.516   3.658
  156   1HA   GLY  19          1HA       GLY  19   7.806 -10.790   4.360
  157   2HA   GLY  19          2HA       GLY  19   7.802 -12.110   3.192
  158    H    GLU  20           H        GLU  20   9.558 -10.686   2.251
  159    HA   GLU  20           HA       GLU  20   9.049  -8.143   1.078
  160   1HB   GLU  20          1HB       GLU  20  11.043 -10.245   1.082
  161   2HB   GLU  20          2HB       GLU  20  10.871  -9.571  -0.539
  162   1HG   GLU  20          1HG       GLU  20  12.487  -8.187   0.507
  163   2HG   GLU  20          2HG       GLU  20  10.987  -7.263   0.604
  164    H    ASN  21           H        ASN  21   6.797  -8.539   0.202
  165    HA   ASN  21           HA       ASN  21   6.391 -10.377  -2.005
  166   1HB   ASN  21          1HB       ASN  21   4.833  -8.892  -0.298
  167   2HB   ASN  21          2HB       ASN  21   4.680  -7.977  -1.799
  168   1HD2  ASN  21          2HD2      ASN  21   3.334 -10.563  -0.120
  169   2HD2  ASN  21          1HD2      ASN  21   2.619 -11.380  -1.425
  170    H    ASP  22           H        ASP  22   8.079  -9.916  -3.513
  171    HA   ASP  22           HA       ASP  22   9.109  -7.610  -4.539
  172   1HB   ASP  22          1HB       ASP  22   9.130 -10.197  -5.242
  173   2HB   ASP  22          2HB       ASP  22   8.087  -9.588  -6.526
  174    H    PHE  23           H        PHE  23   6.117  -9.043  -5.916
  175    HA   PHE  23           HA       PHE  23   5.360  -7.166  -7.758
  176   1HB   PHE  23          1HB       PHE  23   4.155  -9.187  -6.209
  177   2HB   PHE  23          2HB       PHE  23   3.112  -7.774  -6.032
  178    HD1  PHE  23           HD1      PHE  23   4.812  -9.936  -8.548
  179    HD2  PHE  23           HD2      PHE  23   1.716  -7.051  -7.810
  180    HE1  PHE  23           HE1      PHE  23   3.912 -10.320 -10.827
  181    HE2  PHE  23           HE2      PHE  23   0.815  -7.436 -10.089
  182    HZ   PHE  23           HZ       PHE  23   1.912  -9.070 -11.597
  183    H    CYS  24           H        CYS  24   4.174  -6.883  -4.376
  184    HA   CYS  24           HA       CYS  24   3.365  -4.143  -4.679
  185   1HB   CYS  24          1HB       CYS  24   2.966  -6.143  -2.888
  186   2HB   CYS  24          2HB       CYS  24   4.147  -5.175  -2.005
  187    H    ASN  25           H        ASN  25   6.366  -5.653  -3.506
  188    HA   ASN  25           HA       ASN  25   7.662  -3.419  -2.383
  189   1HB   ASN  25          1HB       ASN  25   8.247  -6.045  -3.151
  190   2HB   ASN  25          2HB       ASN  25   9.378  -5.067  -4.086
  191   1HD2  ASN  25          2HD2      ASN  25   9.293  -6.717  -1.276
  192   2HD2  ASN  25          1HD2      ASN  25  10.283  -5.738  -0.306
  193    H    ARG  26           H        ARG  26   8.314  -4.587  -5.702
  194    HA   ARG  26           HA       ARG  26   9.611  -2.370  -6.748
  195   1HB   ARG  26          1HB       ARG  26   9.313  -4.446  -7.957
  196   2HB   ARG  26          2HB       ARG  26   7.561  -4.234  -7.983
  197   1HG   ARG  26          1HG       ARG  26   8.407  -1.888  -9.118
  198   2HG   ARG  26          2HG       ARG  26   9.628  -3.019  -9.700
  199   1HD   ARG  26          1HD       ARG  26   7.830  -4.517 -10.538
  200   2HD   ARG  26          2HD       ARG  26   6.619  -3.343  -9.989
  201    HE   ARG  26           HE       ARG  26   8.430  -1.853 -11.508
  202   1HH1  ARG  26          1HH1      ARG  26   6.446  -4.644 -11.974
  203   2HH1  ARG  26          2HH1      ARG  26   6.182  -4.332 -13.657
  204   1HH2  ARG  26          1HH2      ARG  26   8.093  -1.438 -13.698
  205   2HH2  ARG  26          2HH2      ARG  26   7.116  -2.520 -14.634
  206    H    GLU  27           H        GLU  27   6.068  -2.832  -6.501
  207    HA   GLU  27           HA       GLU  27   5.304  -0.442  -7.864
  208   1HB   GLU  27          1HB       GLU  27   4.046  -2.152  -5.708
  209   2HB   GLU  27          2HB       GLU  27   3.186  -0.826  -6.490
  210   1HG   GLU  27          1HG       GLU  27   3.840  -1.940  -8.717
  211   2HG   GLU  27          2HG       GLU  27   4.249  -3.356  -7.749
  212    H    CYS  28           H        CYS  28   5.210  -0.958  -4.306
  213    HA   CYS  28           HA       CYS  28   5.123   1.925  -3.816
  214   1HB   CYS  28          1HB       CYS  28   4.007   0.020  -2.522
  215   2HB   CYS  28          2HB       CYS  28   5.602  -0.327  -1.852
  216    H    LYS  29           H        LYS  29   7.654   0.243  -4.894
  217    HA   LYS  29           HA       LYS  29   9.627   1.239  -2.897
  218   1HB   LYS  29          1HB       LYS  29   9.770  -1.091  -3.606
  219   2HB   LYS  29          2HB       LYS  29   9.815  -0.604  -5.302
  220   1HG   LYS  29          1HG       LYS  29  11.859   0.807  -3.839
  221   2HG   LYS  29          2HG       LYS  29  12.010  -0.926  -3.542
  222   1HD   LYS  29          1HD       LYS  29  12.576  -1.383  -5.702
  223   2HD   LYS  29          2HD       LYS  29  11.473  -0.171  -6.353
  224   1HE   LYS  29          1HE       LYS  29  13.550   1.178  -4.888
  225   2HE   LYS  29          2HE       LYS  29  14.290   0.061  -6.051
  226   1HZ   LYS  29          1HZ       LYS  29  12.047   1.889  -6.716
  227   2HZ   LYS  29          2HZ       LYS  29  13.676   2.257  -7.016
  228   3HZ   LYS  29          3HZ       LYS  29  12.948   0.933  -7.794
  229    H    TRP  30           H        TRP  30   8.143   2.361  -5.695
  230    HA   TRP  30           HA       TRP  30  10.427   3.486  -7.066
  231   1HB   TRP  30          1HB       TRP  30   8.562   4.869  -8.152
  232   2HB   TRP  30          2HB       TRP  30   8.455   3.128  -8.308
  233    HD1  TRP  30           HD1      TRP  30   5.848   3.891  -8.824
  234    HE1  TRP  30           HE1      TRP  30   3.856   3.988  -7.205
  235    HE3  TRP  30           HE3      TRP  30   8.311   4.127  -4.317
  236    HZ2  TRP  30           HZ2      TRP  30   3.354   4.143  -4.416
  237    HZ3  TRP  30           HZ3      TRP  30   7.031   4.252  -2.216
  238    HH2  TRP  30           HH2      TRP  30   4.558   4.259  -2.255
  239    H    LYS  31           H        LYS  31   9.368   6.241  -7.335
  240    HA   LYS  31           HA       LYS  31   9.743   7.351  -4.597
  241   1HB   LYS  31          1HB       LYS  31  11.388   8.270  -6.964
  242   2HB   LYS  31          2HB       LYS  31  11.654   8.621  -5.258
  243   1HG   LYS  31          1HG       LYS  31  12.092   6.188  -4.873
  244   2HG   LYS  31          2HG       LYS  31  11.959   5.928  -6.614
  245   1HD   LYS  31          1HD       LYS  31  13.798   7.544  -6.988
  246   2HD   LYS  31          2HD       LYS  31  13.949   7.760  -5.243
  247   1HE   LYS  31          1HE       LYS  31  14.152   5.015  -6.500
  248   2HE   LYS  31          2HE       LYS  31  15.570   6.071  -6.331
  249   1HZ   LYS  31          1HZ       LYS  31  14.905   6.372  -3.964
  250   2HZ   LYS  31          2HZ       LYS  31  13.752   5.142  -4.176
  251   3HZ   LYS  31          3HZ       LYS  31  15.403   4.792  -4.346
  252    H    HIS  32           H        HIS  32   7.347   7.397  -6.064
  253    HA   HIS  32           HA       HIS  32   7.223  10.253  -6.985
  254   1HB   HIS  32          1HB       HIS  32   6.284   7.682  -8.099
  255   2HB   HIS  32          2HB       HIS  32   5.086   8.975  -8.145
  256    HD1  HIS  32           HD1      HIS  32   7.343   7.627 -10.365
  257    HD2  HIS  32           HD2      HIS  32   6.857  11.533  -8.991
  258    HE1  HIS  32           HE1      HIS  32   8.438   9.132 -12.083
  259    H    ILE  33           H        ILE  33   6.144   7.931  -4.729
  260    HA   ILE  33           HA       ILE  33   3.756   9.599  -4.025
  261    HB   ILE  33           HB       ILE  33   4.462   6.685  -3.896
  262   1HG1  ILE  33          1HG1      ILE  33   1.696   7.245  -4.289
  263   2HG1  ILE  33          2HG1      ILE  33   2.610   8.403  -5.257
  264   1HG2  ILE  33          1HG2      ILE  33   2.890   8.195  -1.862
  265   2HG2  ILE  33          2HG2      ILE  33   2.207   6.671  -2.427
  266   3HG2  ILE  33          3HG2      ILE  33   3.809   6.700  -1.689
  267   1HD1  ILE  33          1HD1      ILE  33   4.001   6.099  -5.740
  268   2HD1  ILE  33          2HD1      ILE  33   2.360   5.477  -5.565
  269   3HD1  ILE  33          3HD1      ILE  33   2.710   6.711  -6.774
  270    H    GLY  34           H        GLY  34   6.625   7.939  -2.700
  271   1HA   GLY  34          1HA       GLY  34   7.797   9.439  -0.965
  272   2HA   GLY  34          2HA       GLY  34   6.228   9.470  -0.161
  273    H    GLY  35           H        GLY  35   5.600   6.684  -0.729
  274   1HA   GLY  35          1HA       GLY  35   6.543   5.410   1.568
  275   2HA   GLY  35          2HA       GLY  35   6.014   4.533   0.132
  276    H    SER  36           H        SER  36   8.479   4.508   2.152
  277    HA   SER  36           HA       SER  36  10.714   4.600   0.215
  278   1HB   SER  36          1HB       SER  36  11.795   5.122   2.131
  279   2HB   SER  36          2HB       SER  36  10.295   4.898   3.024
  280    HG   SER  36           HG       SER  36  11.324   3.270   3.869
  281    H    TYR  37           H        TYR  37   9.760   2.161   2.655
  282    HA   TYR  37           HA       TYR  37  10.400   0.030   0.640
  283   1HB   TYR  37          1HB       TYR  37  11.398   0.612   3.239
  284   2HB   TYR  37          2HB       TYR  37  10.425  -0.851   3.388
  285    HD1  TYR  37           HD1      TYR  37  12.527   0.451   0.565
  286    HD2  TYR  37           HD2      TYR  37  11.882  -2.679   3.436
  287    HE1  TYR  37           HE1      TYR  37  14.352  -0.874  -0.470
  288    HE2  TYR  37           HE2      TYR  37  13.704  -4.005   2.402
  289    HH   TYR  37           HH       TYR  37  15.692  -2.670  -0.217
  290    H    GLY  38           H        GLY  38   8.650  -1.228   0.091
  291   1HA   GLY  38          1HA       GLY  38   6.384  -1.369   2.034
  292   2HA   GLY  38          2HA       GLY  38   6.093  -1.112   0.315
  293    H    TYR  39           H        TYR  39   5.094  -3.323   1.861
  294    HA   TYR  39           HA       TYR  39   5.742  -5.501   0.103
  295   1HB   TYR  39          1HB       TYR  39   7.013  -6.879   1.740
  296   2HB   TYR  39          2HB       TYR  39   7.869  -5.395   1.331
  297    HD1  TYR  39           HD1      TYR  39   5.686  -6.987   3.903
  298    HD2  TYR  39           HD2      TYR  39   8.364  -3.757   2.978
  299    HE1  TYR  39           HE1      TYR  39   5.748  -6.351   6.301
  300    HE2  TYR  39           HE2      TYR  39   8.426  -3.122   5.375
  301    HH   TYR  39           HH       TYR  39   6.486  -4.881   7.796
  302    H    CYS  40           H        CYS  40   5.198  -7.672   1.799
  303    HA   CYS  40           HA       CYS  40   2.341  -7.187   2.389
  304   1HB   CYS  40          1HB       CYS  40   3.329  -9.142   1.089
  305   2HB   CYS  40          2HB       CYS  40   3.979  -9.726   2.620
  306    H    TYR  41           H        TYR  41   1.827  -6.477   4.421
  307    HA   TYR  41           HA       TYR  41   3.359  -7.611   6.741
  308   1HB   TYR  41          1HB       TYR  41   4.053  -5.365   6.575
  309   2HB   TYR  41          2HB       TYR  41   2.466  -4.818   6.037
  310    HD1  TYR  41           HD1      TYR  41   0.603  -4.586   7.637
  311    HD2  TYR  41           HD2      TYR  41   4.547  -5.672   8.930
  312    HE1  TYR  41           HE1      TYR  41  -0.022  -4.055   9.977
  313    HE2  TYR  41           HE2      TYR  41   3.925  -5.143  11.272
  314    HH   TYR  41           HH       TYR  41   2.215  -4.674  12.657
  315    H    GLY  42           H        GLY  42   1.922  -8.990   7.747
  316   1HA   GLY  42          1HA       GLY  42  -0.041  -9.723   8.813
  317   2HA   GLY  42          2HA       GLY  42  -0.498  -8.022   8.933
  318    H    PHE  43           H        PHE  43   0.069 -10.069   6.073
  319    HA   PHE  43           HA       PHE  43  -1.326 -10.534   4.228
  320   1HB   PHE  43          1HB       PHE  43  -3.395 -10.090   6.407
  321   2HB   PHE  43          2HB       PHE  43  -3.722 -10.849   4.850
  322    HD1  PHE  43           HD1      PHE  43  -1.038 -12.319   4.605
  323    HD2  PHE  43           HD2      PHE  43  -3.868 -11.978   7.821
  324    HE1  PHE  43           HE1      PHE  43  -0.275 -14.496   5.507
  325    HE2  PHE  43           HE2      PHE  43  -3.104 -14.158   8.722
  326    HZ   PHE  43           HZ       PHE  43  -1.308 -15.417   7.565
  327    H    GLY  44           H        GLY  44  -0.391  -8.096   3.889
  328   1HA   GLY  44          1HA       GLY  44  -2.388  -6.669   2.461
  329   2HA   GLY  44          2HA       GLY  44  -2.205  -5.898   4.037
  330    H    CYS  45           H        CYS  45  -1.525  -4.580   1.623
  331    HA   CYS  45           HA       CYS  45   1.437  -4.698   1.429
  332   1HB   CYS  45          1HB       CYS  45  -0.878  -3.699  -0.144
  333   2HB   CYS  45          2HB       CYS  45   0.615  -2.772  -0.298
  334    H    TYR  46           H        TYR  46   2.282  -3.617   3.229
  335    HA   TYR  46           HA       TYR  46   1.145  -0.960   3.958
  336   1HB   TYR  46          1HB       TYR  46   1.711  -3.006   5.514
  337   2HB   TYR  46          2HB       TYR  46   3.364  -2.402   5.388
  338    HD1  TYR  46           HD1      TYR  46  -0.007  -0.767   5.659
  339    HD2  TYR  46           HD2      TYR  46   3.961  -1.151   7.259
  340    HE1  TYR  46           HE1      TYR  46  -0.516   0.982   7.343
  341    HE2  TYR  46           HE2      TYR  46   3.451   0.597   8.942
  342    HH   TYR  46           HH       TYR  46   0.549   2.505   8.787
  343    H    CYS  47           H        CYS  47   2.479   0.914   3.978
  344    HA   CYS  47           HA       CYS  47   5.172   0.640   2.681
  345   1HB   CYS  47          1HB       CYS  47   2.827   2.448   2.066
  346   2HB   CYS  47          2HB       CYS  47   4.462   2.851   1.542
  347    H    GLU  48           H        GLU  48   6.762   1.816   3.738
  348    HA   GLU  48           HA       GLU  48   5.886   3.531   6.027
  349   1HB   GLU  48          1HB       GLU  48   8.642   2.454   5.380
  350   2HB   GLU  48          2HB       GLU  48   8.038   2.999   6.944
  351   1HG   GLU  48          1HG       GLU  48   6.545   1.121   7.115
  352   2HG   GLU  48          2HG       GLU  48   6.858   0.649   5.445
  353    H    GLY  49           H        GLY  49   5.584   5.607   5.084
  354   1HA   GLY  49          1HA       GLY  49   7.591   7.419   4.820
  355   2HA   GLY  49          2HA       GLY  49   7.618   6.654   3.234
  356    H    LEU  50           H        LEU  50   4.501   6.338   3.751
  357    HA   LEU  50           HA       LEU  50   3.552   8.272   2.009
  358   1HB   LEU  50          1HB       LEU  50   2.216   7.194   4.507
  359   2HB   LEU  50          2HB       LEU  50   1.376   7.908   3.135
  360    HG   LEU  50           HG       LEU  50   1.214   5.754   2.431
  361   1HD1  LEU  50          1HD1      LEU  50   2.936   6.832   0.901
  362   2HD1  LEU  50          2HD1      LEU  50   4.167   5.968   1.823
  363   3HD1  LEU  50          3HD1      LEU  50   2.944   5.068   0.927
  364   1HD2  LEU  50          1HD2      LEU  50   2.921   5.371   4.671
  365   2HD2  LEU  50          2HD2      LEU  50   1.894   4.183   3.868
  366   3HD2  LEU  50          3HD2      LEU  50   3.561   4.411   3.337
  367    HA   PRO  51           HA       PRO  51   4.634  11.921   4.521
  368   1HB   PRO  51          1HB       PRO  51   3.627  13.484   2.315
  369   2HB   PRO  51          2HB       PRO  51   5.306  13.261   2.814
  370   1HG   PRO  51          1HG       PRO  51   3.999  12.169   0.505
  371   2HG   PRO  51          2HG       PRO  51   5.676  11.945   1.011
  372   1HD   PRO  51          1HD       PRO  51   3.551  10.004   1.074
  373   2HD   PRO  51          2HD       PRO  51   5.228   9.799   1.628
  374    H    ASP  52           H        ASP  52   3.183  13.969   4.967
  375    HA   ASP  52           HA       ASP  52   0.595  13.081   5.891
  376   1HB   ASP  52          1HB       ASP  52   1.647  15.902   5.538
  377   2HB   ASP  52          2HB       ASP  52   0.461  15.345   6.718
  378    H    SER  53           H        SER  53   1.671  14.332   2.853
  379    HA   SER  53           HA       SER  53  -1.057  15.291   2.141
  380   1HB   SER  53          1HB       SER  53   1.218  16.495   1.748
  381   2HB   SER  53          2HB       SER  53   1.410  15.361   0.413
  382    HG   SER  53           HG       SER  53   0.384  17.239  -0.302
  383    H    THR  54           H        THR  54   0.548  12.361   2.054
  384    HA   THR  54           HA       THR  54  -0.377  11.593  -0.656
  385    HB   THR  54           HB       THR  54   1.072  10.093   1.557
  386    HG1  THR  54           HG1      THR  54   1.817  11.529  -0.744
  387   1HG2  THR  54          1HG2      THR  54  -0.289   8.657  -0.015
  388   2HG2  THR  54          2HG2      THR  54   0.688   9.292  -1.339
  389   3HG2  THR  54          3HG2      THR  54   1.445   8.344  -0.059
  390    H    GLN  55           H        GLN  55  -2.171  10.341  -1.044
  391    HA   GLN  55           HA       GLN  55  -4.091   9.931   1.142
  392   1HB   GLN  55          1HB       GLN  55  -4.656  10.739  -1.161
  393   2HB   GLN  55          2HB       GLN  55  -4.153   9.173  -1.798
  394   1HG   GLN  55          1HG       GLN  55  -6.642   9.394  -1.414
  395   2HG   GLN  55          2HG       GLN  55  -5.891   8.034  -0.580
  396   1HE2  GLN  55          2HE2      GLN  55  -5.989  11.538   0.268
  397   2HE2  GLN  55          1HE2      GLN  55  -6.681  11.299   1.799
  398    H    THR  56           H        THR  56  -4.310   8.006   2.243
  399    HA   THR  56           HA       THR  56  -3.144   5.542   0.991
  400    HB   THR  56           HB       THR  56  -1.580   6.223   2.633
  401    HG1  THR  56           HG1      THR  56  -3.212   4.694   4.306
  402   1HG2  THR  56          1HG2      THR  56  -3.952   6.829   4.419
  403   2HG2  THR  56          2HG2      THR  56  -2.261   6.986   4.891
  404   3HG2  THR  56          3HG2      THR  56  -2.922   8.020   3.624
  405    H    TRP  57           H        TRP  57  -3.929   3.578   2.487
  406    HA   TRP  57           HA       TRP  57  -6.885   3.688   2.463
  407   1HB   TRP  57          1HB       TRP  57  -5.278   1.887   1.479
  408   2HB   TRP  57          2HB       TRP  57  -5.142   1.327   3.146
  409    HD1  TRP  57           HD1      TRP  57  -7.591   1.570   0.255
  410    HE1  TRP  57           HE1      TRP  57  -9.696   0.189   0.816
  411    HE3  TRP  57           HE3      TRP  57  -6.629   0.434   5.141
  412    HZ2  TRP  57           HZ2      TRP  57 -10.820  -1.214   3.040
  413    HZ3  TRP  57           HZ3      TRP  57  -8.231  -0.923   6.456
  414    HH2  TRP  57           HH2      TRP  57 -10.324  -1.748   5.413
  415    HA   PRO  58           HA       PRO  58  -8.537   2.838   3.202
  416   1HB   PRO  58          1HB       PRO  58 -10.463   3.983   4.928
  417   2HB   PRO  58          2HB       PRO  58 -10.200   2.259   4.645
  418   1HG   PRO  58          1HG       PRO  58  -9.619   3.798   7.028
  419   2HG   PRO  58          2HG       PRO  58  -9.486   2.054   6.785
  420   1HD   PRO  58          1HD       PRO  58  -7.347   4.000   6.940
  421   2HD   PRO  58          2HD       PRO  58  -7.214   2.235   6.738
  422    H    LEU  59           H        LEU  59 -10.194   4.621   2.417
  423    HA   LEU  59           HA       LEU  59  -8.715   7.190   2.266
  424   1HB   LEU  59          1HB       LEU  59 -10.459   5.584   0.612
  425   2HB   LEU  59          2HB       LEU  59 -11.108   7.219   0.745
  426    HG   LEU  59           HG       LEU  59  -8.659   7.977   0.281
  427   1HD1  LEU  59          1HD1      LEU  59  -8.260   5.225   0.328
  428   2HD1  LEU  59          2HD1      LEU  59  -8.283   5.608  -1.392
  429   3HD1  LEU  59          3HD1      LEU  59  -7.138   6.418  -0.323
  430   1HD2  LEU  59          1HD2      LEU  59 -10.709   8.099  -1.254
  431   2HD2  LEU  59          2HD2      LEU  59  -9.139   8.090  -2.055
  432   3HD2  LEU  59          3HD2      LEU  59 -10.109   6.618  -2.001
  433    HA   PRO  60           HA       PRO  60 -11.372   9.606   4.807
  434   1HB   PRO  60          1HB       PRO  60 -12.364  11.370   2.759
  435   2HB   PRO  60          2HB       PRO  60 -11.089  11.679   3.940
  436   1HG   PRO  60          1HG       PRO  60 -10.798  11.246   1.123
  437   2HG   PRO  60          2HG       PRO  60  -9.525  11.527   2.314
  438   1HD   PRO  60          1HD       PRO  60 -10.147   9.067   0.942
  439   2HD   PRO  60          2HD       PRO  60  -8.872   9.349   2.152
  440    H    ASN  61           H        ASN  61 -13.785  10.882   4.268
  441    HA   ASN  61           HA       ASN  61 -15.776   8.966   4.562
  442   1HB   ASN  61          1HB       ASN  61 -15.611  11.751   3.472
  443   2HB   ASN  61          2HB       ASN  61 -17.137  10.887   3.283
  444   1HD2  ASN  61          2HD2      ASN  61 -14.681  11.422   5.888
  445   2HD2  ASN  61          1HD2      ASN  61 -15.829  11.637   7.120
  446    H    LYS  62           H        LYS  62 -14.185  10.042   1.633
  447    HA   LYS  62           HA       LYS  62 -16.033   8.583  -0.150
  448   1HB   LYS  62          1HB       LYS  62 -13.539  10.266  -0.415
  449   2HB   LYS  62          2HB       LYS  62 -14.152   9.356  -1.796
  450   1HG   LYS  62          1HG       LYS  62 -15.599  11.036  -2.186
  451   2HG   LYS  62          2HG       LYS  62 -16.399  10.638  -0.664
  452   1HD   LYS  62          1HD       LYS  62 -15.505  12.427   0.405
  453   2HD   LYS  62          2HD       LYS  62 -13.917  12.174  -0.317
  454   1HE   LYS  62          1HE       LYS  62 -14.450  14.123  -1.431
  455   2HE   LYS  62          2HE       LYS  62 -15.308  13.005  -2.510
  456   1HZ   LYS  62          1HZ       LYS  62 -16.931  13.435  -0.280
  457   2HZ   LYS  62          2HZ       LYS  62 -16.401  14.964  -0.800
  458   3HZ   LYS  62          3HZ       LYS  62 -17.210  13.937  -1.879
  459    H    THR  63           H        THR  63 -15.397   6.554   1.290
  460    HA   THR  63           HA       THR  63 -12.816   5.348   1.038
  461    HB   THR  63           HB       THR  63 -14.539   4.749   2.700
  462    HG1  THR  63           HG1      THR  63 -13.474   2.956   2.663
  463   1HG2  THR  63          1HG2      THR  63 -16.206   4.675   0.422
  464   2HG2  THR  63          2HG2      THR  63 -16.139   3.022   1.029
  465   3HG2  THR  63          3HG2      THR  63 -16.663   4.329   2.090
  466    H    CYS  64           H        CYS  64 -13.264   2.815   0.073
  467    HA   CYS  64           HA       CYS  64 -12.913   3.140  -2.771
  468   1HB   CYS  64          1HB       CYS  64 -11.793   1.394  -1.570
  469   2HB   CYS  64          2HB       CYS  64 -13.301   0.806  -0.882
  Start of MODEL   22
    1   1H    LYS   1          1H        LYS   1   5.259   5.219  11.402
    2   2H    LYS   1          2H        LYS   1   6.558   6.210  10.936
    3   3H    LYS   1          3H        LYS   1   5.151   6.906  11.580
    4    HA   LYS   1           HA       LYS   1   4.034   6.823   9.632
    5   1HB   LYS   1          1HB       LYS   1   6.986   6.583   9.046
    6   2HB   LYS   1          2HB       LYS   1   5.822   6.822   7.742
    7   1HG   LYS   1          1HG       LYS   1   5.206   8.942   8.497
    8   2HG   LYS   1          2HG       LYS   1   5.717   8.610  10.152
    9   1HD   LYS   1          1HD       LYS   1   7.453   9.977   9.438
   10   2HD   LYS   1          2HD       LYS   1   8.104   8.388   9.035
   11   1HE   LYS   1          1HE       LYS   1   6.987   8.722   6.720
   12   2HE   LYS   1          2HE       LYS   1   6.877  10.434   7.179
   13   1HZ   LYS   1          1HZ       LYS   1   9.360   8.812   7.339
   14   2HZ   LYS   1          2HZ       LYS   1   8.994   9.869   6.061
   15   3HZ   LYS   1          3HZ       LYS   1   9.215  10.476   7.633
   16    H    ASP   2           H        ASP   2   2.923   4.728   9.948
   17    HA   ASP   2           HA       ASP   2   3.856   2.678   7.976
   18   1HB   ASP   2          1HB       ASP   2   2.719   1.944  10.678
   19   2HB   ASP   2          2HB       ASP   2   3.671   0.945   9.583
   20    H    GLY   3           H        GLY   3   2.168   2.211   6.617
   21   1HA   GLY   3          1HA       GLY   3  -0.535   1.830   7.587
   22   2HA   GLY   3          2HA       GLY   3  -0.372   3.350   6.704
   23    H    TYR   4           H        TYR   4  -2.043   1.820   5.443
   24    HA   TYR   4           HA       TYR   4  -0.619   0.024   3.551
   25   1HB   TYR   4          1HB       TYR   4  -3.533   0.687   4.073
   26   2HB   TYR   4          2HB       TYR   4  -2.986  -0.497   2.884
   27    HD1  TYR   4           HD1      TYR   4  -2.981   0.348   6.503
   28    HD2  TYR   4           HD2      TYR   4  -2.283  -2.680   3.539
   29    HE1  TYR   4           HE1      TYR   4  -2.802  -1.359   8.291
   30    HE2  TYR   4           HE2      TYR   4  -2.104  -4.390   5.328
   31    HH   TYR   4           HH       TYR   4  -2.039  -3.496   8.721
   32    H    LEU   5           H        LEU   5  -1.060   0.308   1.205
   33    HA   LEU   5           HA       LEU   5  -1.413   3.200   0.502
   34   1HB   LEU   5          1HB       LEU   5   0.534   1.121  -0.172
   35   2HB   LEU   5          2HB       LEU   5  -0.121   1.920  -1.602
   36    HG   LEU   5           HG       LEU   5   0.551   3.752   0.606
   37   1HD1  LEU   5          1HD1      LEU   5   2.352   1.751   0.344
   38   2HD1  LEU   5          2HD1      LEU   5   2.922   2.832  -0.926
   39   3HD1  LEU   5          3HD1      LEU   5   2.812   3.407   0.736
   40   1HD2  LEU   5          1HD2      LEU   5  -0.071   4.092  -1.960
   41   2HD2  LEU   5          2HD2      LEU   5   1.058   5.179  -1.152
   42   3HD2  LEU   5          3HD2      LEU   5   1.667   3.874  -2.172
   43    H    VAL   6           H        VAL   6  -2.839   3.684  -1.165
   44    HA   VAL   6           HA       VAL   6  -4.746   1.568  -1.934
   45    HB   VAL   6           HB       VAL   6  -6.058   3.448  -2.694
   46   1HG1  VAL   6          1HG1      VAL   6  -4.971   3.260  -0.098
   47   2HG1  VAL   6          2HG1      VAL   6  -4.954   4.976  -0.504
   48   3HG1  VAL   6          3HG1      VAL   6  -6.465   4.068  -0.571
   49   1HG2  VAL   6          1HG2      VAL   6  -3.415   4.917  -2.556
   50   2HG2  VAL   6          2HG2      VAL   6  -4.471   4.717  -3.954
   51   3HG2  VAL   6          3HG2      VAL   6  -4.958   5.767  -2.624
   52    H    GLU   7           H        GLU   7  -5.481   2.324  -4.462
   53    HA   GLU   7           HA       GLU   7  -2.968   2.048  -6.081
   54   1HB   GLU   7          1HB       GLU   7  -4.825   0.084  -5.552
   55   2HB   GLU   7          2HB       GLU   7  -5.401   0.726  -7.090
   56   1HG   GLU   7          1HG       GLU   7  -2.668   0.578  -7.481
   57   2HG   GLU   7          2HG       GLU   7  -3.002  -0.861  -6.515
   58    H    LYS   8           H        LYS   8  -3.502   2.536  -8.496
   59    HA   LYS   8           HA       LYS   8  -4.379   5.161  -8.867
   60   1HB   LYS   8          1HB       LYS   8  -4.514   4.542 -11.219
   61   2HB   LYS   8          2HB       LYS   8  -3.193   3.631 -10.487
   62   1HG   LYS   8          1HG       LYS   8  -4.740   1.704 -10.170
   63   2HG   LYS   8          2HG       LYS   8  -6.001   2.612 -11.002
   64   1HD   LYS   8          1HD       LYS   8  -4.309   2.846 -12.935
   65   2HD   LYS   8          2HD       LYS   8  -3.404   1.564 -12.127
   66   1HE   LYS   8          1HE       LYS   8  -6.189   0.819 -12.243
   67   2HE   LYS   8          2HE       LYS   8  -5.614   1.241 -13.868
   68   1HZ   LYS   8          1HZ       LYS   8  -3.784  -0.270 -12.181
   69   2HZ   LYS   8          2HZ       LYS   8  -5.133  -1.117 -12.763
   70   3HZ   LYS   8          3HZ       LYS   8  -4.060  -0.382 -13.854
   71    H    THR   9           H        THR   9  -6.298   2.178  -8.840
   72    HA   THR   9           HA       THR   9  -8.796   3.460  -9.602
   73    HB   THR   9           HB       THR   9  -9.696   1.233  -8.959
   74    HG1  THR   9           HG1      THR   9  -7.699  -0.190  -8.376
   75   1HG2  THR   9          1HG2      THR   9  -7.922   1.810 -10.997
   76   2HG2  THR   9          2HG2      THR   9  -7.215   0.372 -10.261
   77   3HG2  THR   9          3HG2      THR   9  -8.872   0.330 -10.863
   78    H    GLY  10           H        GLY  10  -7.021   3.031  -6.638
   79   1HA   GLY  10          1HA       GLY  10  -7.546   4.402  -4.687
   80   2HA   GLY  10          2HA       GLY  10  -9.246   4.353  -5.161
   81    H    CYS  11           H        CYS  11  -8.349   1.318  -5.749
   82    HA   CYS  11           HA       CYS  11  -9.254   0.376  -3.068
   83   1HB   CYS  11          1HB       CYS  11  -9.310  -0.588  -5.906
   84   2HB   CYS  11          2HB       CYS  11  -9.383  -1.789  -4.617
   85    H    LYS  12           H        LYS  12  -7.848  -0.751  -1.753
   86    HA   LYS  12           HA       LYS  12  -5.067  -0.817  -2.099
   87   1HB   LYS  12          1HB       LYS  12  -5.270  -2.733  -0.373
   88   2HB   LYS  12          2HB       LYS  12  -5.975  -1.179   0.057
   89   1HG   LYS  12          1HG       LYS  12  -7.443  -3.186   0.540
   90   2HG   LYS  12          2HG       LYS  12  -8.198  -1.953  -0.461
   91   1HD   LYS  12          1HD       LYS  12  -7.973  -3.240  -2.425
   92   2HD   LYS  12          2HD       LYS  12  -6.740  -4.277  -1.707
   93   1HE   LYS  12          1HE       LYS  12  -8.336  -5.719  -1.003
   94   2HE   LYS  12          2HE       LYS  12  -9.149  -4.414  -0.117
   95   1HZ   LYS  12          1HZ       LYS  12  -9.356  -4.813  -3.053
   96   2HZ   LYS  12          2HZ       LYS  12 -10.515  -5.363  -1.938
   97   3HZ   LYS  12          3HZ       LYS  12 -10.227  -3.700  -2.108
   98    H    LYS  13           H        LYS  13  -4.039  -3.311  -1.856
   99    HA   LYS  13           HA       LYS  13  -5.019  -4.904  -4.189
  100   1HB   LYS  13          1HB       LYS  13  -3.154  -3.148  -4.649
  101   2HB   LYS  13          2HB       LYS  13  -2.103  -4.254  -3.767
  102   1HG   LYS  13          1HG       LYS  13  -1.834  -5.022  -5.952
  103   2HG   LYS  13          2HG       LYS  13  -3.139  -6.061  -5.377
  104   1HD   LYS  13          1HD       LYS  13  -4.613  -5.181  -6.843
  105   2HD   LYS  13          2HD       LYS  13  -4.139  -3.530  -6.433
  106   1HE   LYS  13          1HE       LYS  13  -2.978  -3.380  -8.371
  107   2HE   LYS  13          2HE       LYS  13  -1.989  -4.775  -7.893
  108   1HZ   LYS  13          1HZ       LYS  13  -3.833  -6.225  -8.580
  109   2HZ   LYS  13          2HZ       LYS  13  -4.679  -4.867  -9.151
  110   3HZ   LYS  13          3HZ       LYS  13  -3.215  -5.320  -9.879
  111    H    THR  14           H        THR  14  -5.710  -6.428  -2.485
  112    HA   THR  14           HA       THR  14  -3.904  -7.544  -0.538
  113    HB   THR  14           HB       THR  14  -6.495  -8.422  -1.840
  114    HG1  THR  14           HG1      THR  14  -5.830  -6.763   0.127
  115   1HG2  THR  14          1HG2      THR  14  -4.742  -9.835   0.137
  116   2HG2  THR  14          2HG2      THR  14  -6.493  -9.976   0.290
  117   3HG2  THR  14          3HG2      THR  14  -5.691 -10.502  -1.191
  118    H    CYS  15           H        CYS  15  -3.026  -9.785  -0.602
  119    HA   CYS  15           HA       CYS  15  -2.594 -10.865  -3.362
  120   1HB   CYS  15          1HB       CYS  15  -0.202 -11.043  -2.859
  121   2HB   CYS  15          2HB       CYS  15  -0.725  -9.376  -2.628
  122    H    TYR  16           H        TYR  16  -2.391 -13.154  -3.416
  123    HA   TYR  16           HA       TYR  16  -3.419 -14.588  -1.075
  124   1HB   TYR  16          1HB       TYR  16  -2.394 -15.549  -3.765
  125   2HB   TYR  16          2HB       TYR  16  -3.392 -16.477  -2.646
  126    HD1  TYR  16           HD1      TYR  16  -5.478 -14.827  -1.742
  127    HD2  TYR  16           HD2      TYR  16  -3.597 -14.796  -5.604
  128    HE1  TYR  16           HE1      TYR  16  -7.522 -13.827  -2.728
  129    HE2  TYR  16           HE2      TYR  16  -5.642 -13.796  -6.591
  130    HH   TYR  16           HH       TYR  16  -8.326 -12.739  -4.570
  131    H    LYS  17           H        LYS  17  -0.427 -13.421  -1.584
  132    HA   LYS  17           HA       LYS  17   0.855 -15.722  -0.170
  133   1HB   LYS  17          1HB       LYS  17   1.901 -14.196  -2.580
  134   2HB   LYS  17          2HB       LYS  17   2.830 -15.388  -1.669
  135   1HG   LYS  17          1HG       LYS  17   1.102 -17.101  -2.180
  136   2HG   LYS  17          2HG       LYS  17   0.229 -15.907  -3.143
  137   1HD   LYS  17          1HD       LYS  17   2.542 -15.628  -4.369
  138   2HD   LYS  17          2HD       LYS  17   2.863 -17.230  -3.706
  139   1HE   LYS  17          1HE       LYS  17   0.190 -17.001  -4.918
  140   2HE   LYS  17          2HE       LYS  17   1.519 -16.774  -6.073
  141   1HZ   LYS  17          1HZ       LYS  17   1.953 -18.863  -4.121
  142   2HZ   LYS  17          2HZ       LYS  17   0.679 -19.174  -5.200
  143   3HZ   LYS  17          3HZ       LYS  17   2.236 -18.867  -5.797
  144    H    LEU  18           H        LEU  18   0.986 -14.599   1.797
  145    HA   LEU  18           HA       LEU  18   1.708 -11.822   2.052
  146   1HB   LEU  18          1HB       LEU  18   1.861 -14.155   3.988
  147   2HB   LEU  18          2HB       LEU  18   1.888 -12.450   4.442
  148    HG   LEU  18           HG       LEU  18  -0.373 -13.708   2.868
  149   1HD1  LEU  18          1HD1      LEU  18  -0.039 -13.284   5.849
  150   2HD1  LEU  18          2HD1      LEU  18  -1.601 -13.573   5.079
  151   3HD1  LEU  18          3HD1      LEU  18  -0.342 -14.807   5.011
  152   1HD2  LEU  18          1HD2      LEU  18   0.352 -11.043   3.378
  153   2HD2  LEU  18          2HD2      LEU  18  -1.211 -11.610   2.792
  154   3HD2  LEU  18          3HD2      LEU  18  -0.947 -11.383   4.520
  155    H    GLY  19           H        GLY  19   3.719 -11.318   3.561
  156   1HA   GLY  19          1HA       GLY  19   6.051 -11.563   4.011
  157   2HA   GLY  19          2HA       GLY  19   6.070 -12.991   2.986
  158    H    GLU  20           H        GLU  20   8.055 -11.940   2.136
  159    HA   GLU  20           HA       GLU  20   8.221  -9.491   0.777
  160   1HB   GLU  20          1HB       GLU  20   9.422 -12.147  -0.073
  161   2HB   GLU  20          2HB       GLU  20  10.077 -10.543  -0.397
  162   1HG   GLU  20          1HG       GLU  20   9.883 -11.972   2.259
  163   2HG   GLU  20          2HG       GLU  20  11.321 -11.342   1.462
  164    H    ASN  21           H        ASN  21   6.108  -9.173  -0.259
  165    HA   ASN  21           HA       ASN  21   6.078  -9.986  -3.042
  166   1HB   ASN  21          1HB       ASN  21   5.328 -12.051  -1.831
  167   2HB   ASN  21          2HB       ASN  21   3.968 -11.131  -1.188
  168   1HD2  ASN  21          2HD2      ASN  21   2.160 -11.837  -2.338
  169   2HD2  ASN  21          1HD2      ASN  21   2.077 -11.961  -4.028
  170    H    ASP  22           H        ASP  22   6.038  -7.463  -1.995
  171    HA   ASP  22           HA       ASP  22   3.197  -6.574  -2.154
  172   1HB   ASP  22          1HB       ASP  22   4.582  -6.234  -0.095
  173   2HB   ASP  22          2HB       ASP  22   5.562  -5.122  -1.036
  174    H    PHE  23           H        PHE  23   3.203  -6.569  -4.519
  175    HA   PHE  23           HA       PHE  23   4.986  -5.197  -6.199
  176   1HB   PHE  23          1HB       PHE  23   2.528  -6.385  -6.404
  177   2HB   PHE  23          2HB       PHE  23   2.085  -4.689  -6.603
  178    HD1  PHE  23           HD1      PHE  23   5.150  -6.594  -7.623
  179    HD2  PHE  23           HD2      PHE  23   1.751  -4.290  -8.886
  180    HE1  PHE  23           HE1      PHE  23   5.987  -6.637  -9.958
  181    HE2  PHE  23           HE2      PHE  23   2.586  -4.335 -11.221
  182    HZ   PHE  23           HZ       PHE  23   4.706  -5.509 -11.757
  183    H    CYS  24           H        CYS  24   2.781  -4.055  -3.777
  184    HA   CYS  24           HA       CYS  24   2.650  -1.270  -4.502
  185   1HB   CYS  24          1HB       CYS  24   2.292  -2.872  -1.952
  186   2HB   CYS  24          2HB       CYS  24   1.943  -1.146  -2.056
  187    H    ASN  25           H        ASN  25   4.695  -3.130  -2.184
  188    HA   ASN  25           HA       ASN  25   6.198  -0.861  -1.257
  189   1HB   ASN  25          1HB       ASN  25   7.356  -2.461  -0.092
  190   2HB   ASN  25          2HB       ASN  25   6.041  -3.491  -0.624
  191   1HD2  ASN  25          2HD2      ASN  25   6.485  -4.866  -2.585
  192   2HD2  ASN  25          1HD2      ASN  25   8.072  -5.306  -2.954
  193    H    ARG  26           H        ARG  26   6.636  -3.113  -3.941
  194    HA   ARG  26           HA       ARG  26   9.140  -2.268  -4.938
  195   1HB   ARG  26          1HB       ARG  26   6.989  -3.874  -5.712
  196   2HB   ARG  26          2HB       ARG  26   7.117  -2.681  -7.007
  197   1HG   ARG  26          1HG       ARG  26   9.754  -3.536  -6.248
  198   2HG   ARG  26          2HG       ARG  26   8.759  -4.953  -6.590
  199   1HD   ARG  26          1HD       ARG  26   8.020  -3.698  -8.723
  200   2HD   ARG  26          2HD       ARG  26   9.407  -2.636  -8.420
  201    HE   ARG  26           HE       ARG  26  10.396  -5.237  -8.120
  202   1HH1  ARG  26          1HH1      ARG  26   8.785  -3.387 -10.553
  203   2HH1  ARG  26          2HH1      ARG  26   9.518  -4.242 -11.868
  204   1HH2  ARG  26          1HH2      ARG  26  11.355  -6.356  -9.827
  205   2HH2  ARG  26          2HH2      ARG  26  10.973  -5.919 -11.458
  206    H    GLU  27           H        GLU  27   5.904  -0.942  -5.746
  207    HA   GLU  27           HA       GLU  27   6.965   1.264  -7.313
  208   1HB   GLU  27          1HB       GLU  27   4.335   0.370  -6.181
  209   2HB   GLU  27          2HB       GLU  27   4.470   2.021  -6.786
  210   1HG   GLU  27          1HG       GLU  27   4.999   1.299  -8.975
  211   2HG   GLU  27          2HG       GLU  27   5.393  -0.333  -8.431
  212    H    CYS  28           H        CYS  28   5.916   0.832  -3.950
  213    HA   CYS  28           HA       CYS  28   5.725   3.408  -2.947
  214   1HB   CYS  28          1HB       CYS  28   6.139   0.800  -2.023
  215   2HB   CYS  28          2HB       CYS  28   7.479   1.716  -1.339
  216    H    LYS  29           H        LYS  29   8.797   1.574  -3.032
  217    HA   LYS  29           HA       LYS  29  10.521   3.782  -2.487
  218   1HB   LYS  29          1HB       LYS  29  10.639   1.002  -3.025
  219   2HB   LYS  29          2HB       LYS  29  11.710   1.771  -4.195
  220   1HG   LYS  29          1HG       LYS  29  12.916   2.911  -2.417
  221   2HG   LYS  29          2HG       LYS  29  11.787   2.293  -1.210
  222   1HD   LYS  29          1HD       LYS  29  12.932   0.173  -2.874
  223   2HD   LYS  29          2HD       LYS  29  14.157   1.069  -1.975
  224   1HE   LYS  29          1HE       LYS  29  11.887   0.564  -0.258
  225   2HE   LYS  29          2HE       LYS  29  12.472  -0.958  -0.958
  226   1HZ   LYS  29          1HZ       LYS  29  14.782   0.033  -0.470
  227   2HZ   LYS  29          2HZ       LYS  29  13.958   1.044   0.619
  228   3HZ   LYS  29          3HZ       LYS  29  13.905  -0.642   0.816
  229    H    TRP  30           H        TRP  30   9.566   2.270  -5.579
  230    HA   TRP  30           HA       TRP  30  11.074   3.886  -7.346
  231   1HB   TRP  30          1HB       TRP  30  10.047   1.993  -8.253
  232   2HB   TRP  30          2HB       TRP  30   8.528   2.296  -7.421
  233    HD1  TRP  30           HD1      TRP  30   6.703   3.004  -8.989
  234    HE1  TRP  30           HE1      TRP  30   6.541   4.317 -11.200
  235    HE3  TRP  30           HE3      TRP  30  11.627   4.137  -9.687
  236    HZ2  TRP  30           HZ2      TRP  30   8.282   5.673 -13.029
  237    HZ3  TRP  30           HZ3      TRP  30  12.351   5.438 -11.668
  238    HH2  TRP  30           HH2      TRP  30  10.687   6.205 -13.341
  239    H    LYS  31           H        LYS  31   7.703   4.365  -6.199
  240    HA   LYS  31           HA       LYS  31   7.525   6.988  -7.495
  241   1HB   LYS  31          1HB       LYS  31   5.791   5.009  -6.605
  242   2HB   LYS  31          2HB       LYS  31   5.543   6.317  -5.446
  243   1HG   LYS  31          1HG       LYS  31   5.745   7.289  -8.194
  244   2HG   LYS  31          2HG       LYS  31   4.406   6.162  -7.976
  245   1HD   LYS  31          1HD       LYS  31   4.110   7.653  -5.740
  246   2HD   LYS  31          2HD       LYS  31   4.814   8.863  -6.815
  247   1HE   LYS  31          1HE       LYS  31   2.987   8.864  -8.233
  248   2HE   LYS  31          2HE       LYS  31   2.606   7.162  -7.910
  249   1HZ   LYS  31          1HZ       LYS  31   2.170   7.959  -5.539
  250   2HZ   LYS  31          2HZ       LYS  31   2.092   9.520  -6.201
  251   3HZ   LYS  31          3HZ       LYS  31   0.998   8.323  -6.708
  252    H    HIS  32           H        HIS  32   6.844   8.921  -6.099
  253    HA   HIS  32           HA       HIS  32   8.786   9.196  -3.887
  254   1HB   HIS  32          1HB       HIS  32   7.542  10.834  -5.889
  255   2HB   HIS  32          2HB       HIS  32   7.208  11.532  -4.304
  256    HD1  HIS  32           HD1      HIS  32   9.641  11.765  -6.841
  257    HD2  HIS  32           HD2      HIS  32   9.891  11.387  -2.695
  258    HE1  HIS  32           HE1      HIS  32  11.965  12.531  -6.188
  259    H    ILE  33           H        ILE  33   7.112   7.481  -2.823
  260    HA   ILE  33           HA       ILE  33   4.932   8.971  -1.426
  261    HB   ILE  33           HB       ILE  33   5.603   6.028  -1.749
  262   1HG1  ILE  33          1HG1      ILE  33   4.792   6.952  -3.814
  263   2HG1  ILE  33          2HG1      ILE  33   3.431   6.111  -3.073
  264   1HG2  ILE  33          1HG2      ILE  33   4.343   6.903   0.405
  265   2HG2  ILE  33          2HG2      ILE  33   2.983   7.056  -0.706
  266   3HG2  ILE  33          3HG2      ILE  33   3.745   5.485  -0.455
  267   1HD1  ILE  33          1HD1      ILE  33   3.113   8.565  -1.966
  268   2HD1  ILE  33          2HD1      ILE  33   3.849   9.017  -3.503
  269   3HD1  ILE  33          3HD1      ILE  33   2.352   8.088  -3.484
  270    H    GLY  34           H        GLY  34   8.098   7.705  -0.988
  271   1HA   GLY  34          1HA       GLY  34   9.467   8.121   0.931
  272   2HA   GLY  34          2HA       GLY  34   8.010   8.443   1.871
  273    H    GLY  35           H        GLY  35   7.587   5.648   0.050
  274   1HA   GLY  35          1HA       GLY  35   7.644   3.985   2.433
  275   2HA   GLY  35          2HA       GLY  35   7.280   3.434   0.800
  276    H    SER  36           H        SER  36   9.869   4.035   3.102
  277    HA   SER  36           HA       SER  36  12.042   3.277   1.337
  278   1HB   SER  36          1HB       SER  36  13.335   3.548   3.283
  279   2HB   SER  36          2HB       SER  36  11.956   4.595   3.602
  280    HG   SER  36           HG       SER  36  11.012   2.749   4.689
  281    H    TYR  37           H        TYR  37   9.627   1.526   3.073
  282    HA   TYR  37           HA       TYR  37  10.595  -1.029   2.055
  283   1HB   TYR  37          1HB       TYR  37  12.112  -0.556   3.975
  284   2HB   TYR  37          2HB       TYR  37  10.701  -0.474   5.034
  285    HD1  TYR  37           HD1      TYR  37   9.208  -2.500   5.258
  286    HD2  TYR  37           HD2      TYR  37  13.036  -2.646   3.316
  287    HE1  TYR  37           HE1      TYR  37   9.231  -4.971   5.491
  288    HE2  TYR  37           HE2      TYR  37  13.060  -5.117   3.547
  289    HH   TYR  37           HH       TYR  37  12.043  -6.887   4.448
  290    H    GLY  38           H        GLY  38   8.705  -2.061   1.591
  291   1HA   GLY  38          1HA       GLY  38   6.533  -2.052   3.608
  292   2HA   GLY  38          2HA       GLY  38   6.139  -1.472   1.989
  293    H    TYR  39           H        TYR  39   4.976  -3.825   3.202
  294    HA   TYR  39           HA       TYR  39   5.750  -5.781   1.118
  295   1HB   TYR  39          1HB       TYR  39   5.967  -7.552   2.907
  296   2HB   TYR  39          2HB       TYR  39   7.223  -6.314   2.974
  297    HD1  TYR  39           HD1      TYR  39   6.961  -4.383   4.595
  298    HD2  TYR  39           HD2      TYR  39   4.471  -7.882   4.725
  299    HE1  TYR  39           HE1      TYR  39   6.284  -3.814   6.912
  300    HE2  TYR  39           HE2      TYR  39   3.796  -7.311   7.043
  301    HH   TYR  39           HH       TYR  39   4.981  -4.341   8.623
  302    H    CYS  40           H        CYS  40   4.131  -7.646   1.076
  303    HA   CYS  40           HA       CYS  40   1.424  -6.621   1.367
  304   1HB   CYS  40          1HB       CYS  40   2.574  -8.405  -0.245
  305   2HB   CYS  40          2HB       CYS  40   2.063  -9.530   1.015
  306    H    TYR  41           H        TYR  41   0.585  -6.403   3.418
  307    HA   TYR  41           HA       TYR  41   1.028  -8.665   5.346
  308   1HB   TYR  41          1HB       TYR  41   2.216  -6.589   5.927
  309   2HB   TYR  41          2HB       TYR  41   0.707  -5.683   5.813
  310    HD1  TYR  41           HD1      TYR  41   1.157  -9.096   7.223
  311    HD2  TYR  41           HD2      TYR  41   0.428  -4.947   8.060
  312    HE1  TYR  41           HE1      TYR  41   0.635  -9.663   9.579
  313    HE2  TYR  41           HE2      TYR  41  -0.091  -5.514  10.417
  314    HH   TYR  41           HH       TYR  41   0.077  -8.885  11.575
  315    H    GLY  42           H        GLY  42  -0.793  -9.276   6.616
  316   1HA   GLY  42          1HA       GLY  42  -3.082  -9.757   6.867
  317   2HA   GLY  42          2HA       GLY  42  -3.246  -8.001   6.914
  318    H    PHE  43           H        PHE  43  -2.178 -10.009   4.184
  319    HA   PHE  43           HA       PHE  43  -3.040 -10.148   1.988
  320   1HB   PHE  43          1HB       PHE  43  -5.456  -9.971   3.792
  321   2HB   PHE  43          2HB       PHE  43  -5.638 -10.153   2.049
  322    HD1  PHE  43           HD1      PHE  43  -3.303 -11.861   1.411
  323    HD2  PHE  43           HD2      PHE  43  -6.104 -12.081   4.655
  324    HE1  PHE  43           HE1      PHE  43  -2.876 -14.292   1.608
  325    HE2  PHE  43           HE2      PHE  43  -5.676 -14.517   4.856
  326    HZ   PHE  43           HZ       PHE  43  -4.062 -15.622   3.330
  327    H    GLY  44           H        GLY  44  -1.994  -7.711   2.322
  328   1HA   GLY  44          1HA       GLY  44  -3.596  -6.014   0.630
  329   2HA   GLY  44          2HA       GLY  44  -3.598  -5.421   2.290
  330    H    CYS  45           H        CYS  45  -2.467  -3.613   0.871
  331    HA   CYS  45           HA       CYS  45   0.446  -4.174   0.572
  332   1HB   CYS  45          1HB       CYS  45  -1.497  -2.077  -0.393
  333   2HB   CYS  45          2HB       CYS  45   0.243  -1.835  -0.526
  334    H    TYR  46           H        TYR  46   1.820  -3.447   2.155
  335    HA   TYR  46           HA       TYR  46   0.886  -1.181   3.881
  336   1HB   TYR  46          1HB       TYR  46   0.767  -3.554   4.837
  337   2HB   TYR  46          2HB       TYR  46   2.531  -3.556   4.782
  338    HD1  TYR  46           HD1      TYR  46  -0.405  -1.679   6.117
  339    HD2  TYR  46           HD2      TYR  46   3.800  -2.481   6.463
  340    HE1  TYR  46           HE1      TYR  46  -0.342  -0.405   8.242
  341    HE2  TYR  46           HE2      TYR  46   3.867  -1.203   8.589
  342    HH   TYR  46           HH       TYR  46   0.972   0.456   9.826
  343    H    CYS  47           H        CYS  47   2.299   0.505   3.713
  344    HA   CYS  47           HA       CYS  47   5.165  -0.101   3.050
  345   1HB   CYS  47          1HB       CYS  47   3.140   1.803   2.045
  346   2HB   CYS  47          2HB       CYS  47   4.711   2.532   2.370
  347    H    GLU  48           H        GLU  48   6.690   0.756   4.479
  348    HA   GLU  48           HA       GLU  48   5.605   2.252   6.828
  349   1HB   GLU  48          1HB       GLU  48   7.186  -0.013   6.556
  350   2HB   GLU  48          2HB       GLU  48   8.356   1.249   6.939
  351   1HG   GLU  48          1HG       GLU  48   6.369   1.846   8.708
  352   2HG   GLU  48          2HG       GLU  48   6.217   0.091   8.620
  353    H    GLY  49           H        GLY  49   5.669   4.282   5.475
  354   1HA   GLY  49          1HA       GLY  49   7.826   5.944   6.101
  355   2HA   GLY  49          2HA       GLY  49   8.183   5.297   4.504
  356    H    LEU  50           H        LEU  50   4.841   5.883   5.474
  357    HA   LEU  50           HA       LEU  50   4.520   7.726   3.225
  358   1HB   LEU  50          1HB       LEU  50   2.559   6.999   5.412
  359   2HB   LEU  50          2HB       LEU  50   2.187   7.541   3.780
  360    HG   LEU  50           HG       LEU  50   1.915   5.313   3.397
  361   1HD1  LEU  50          1HD1      LEU  50   4.240   6.096   2.375
  362   2HD1  LEU  50          2HD1      LEU  50   4.866   4.880   3.487
  363   3HD1  LEU  50          3HD1      LEU  50   3.704   4.422   2.244
  364   1HD2  LEU  50          1HD2      LEU  50   2.838   5.140   6.016
  365   2HD2  LEU  50          2HD2      LEU  50   2.164   3.824   5.057
  366   3HD2  LEU  50          3HD2      LEU  50   3.905   4.077   5.105
  367    HA   PRO  51           HA       PRO  51   5.669  11.258   5.796
  368   1HB   PRO  51          1HB       PRO  51   4.404  12.906   3.771
  369   2HB   PRO  51          2HB       PRO  51   6.123  12.731   4.134
  370   1HG   PRO  51          1HG       PRO  51   4.696  11.681   1.881
  371   2HG   PRO  51          2HG       PRO  51   6.409  11.484   2.266
  372   1HD   PRO  51          1HD       PRO  51   4.365   9.473   2.368
  373   2HD   PRO  51          2HD       PRO  51   6.068   9.310   2.860
  374    H    ASP  52           H        ASP  52   4.310  13.248   6.570
  375    HA   ASP  52           HA       ASP  52   1.877  12.321   7.768
  376   1HB   ASP  52          1HB       ASP  52   3.584  14.174   8.415
  377   2HB   ASP  52          2HB       ASP  52   2.635  15.208   7.349
  378    H    SER  53           H        SER  53   2.509  14.293   4.878
  379    HA   SER  53           HA       SER  53  -0.357  14.817   4.451
  380   1HB   SER  53          1HB       SER  53   0.438  16.352   2.911
  381   2HB   SER  53          2HB       SER  53   1.863  16.201   3.935
  382    HG   SER  53           HG       SER  53   2.209  15.954   1.613
  383    H    THR  54           H        THR  54   1.126  12.017   4.217
  384    HA   THR  54           HA       THR  54   0.334  11.329   1.427
  385    HB   THR  54           HB       THR  54   1.896   9.973   3.639
  386    HG1  THR  54           HG1      THR  54   2.768  11.692   2.230
  387   1HG2  THR  54          1HG2      THR  54   1.160   8.913   0.895
  388   2HG2  THR  54          2HG2      THR  54   2.341   8.174   1.977
  389   3HG2  THR  54          3HG2      THR  54   0.642   8.248   2.445
  390    H    GLN  55           H        GLN  55  -1.497  10.120   1.028
  391    HA   GLN  55           HA       GLN  55  -3.292   9.486   3.274
  392   1HB   GLN  55          1HB       GLN  55  -4.033  10.497   1.121
  393   2HB   GLN  55          2HB       GLN  55  -3.521   9.033   0.279
  394   1HG   GLN  55          1HG       GLN  55  -5.963   9.032   0.775
  395   2HG   GLN  55          2HG       GLN  55  -5.118   7.695   1.556
  396   1HE2  GLN  55          2HE2      GLN  55  -5.253  11.147   2.565
  397   2HE2  GLN  55          1HE2      GLN  55  -5.956  10.831   4.078
  398    H    THR  56           H        THR  56  -3.711   7.411   4.037
  399    HA   THR  56           HA       THR  56  -2.269   5.148   2.687
  400    HB   THR  56           HB       THR  56  -2.611   4.622   5.457
  401    HG1  THR  56           HG1      THR  56  -2.614   6.559   6.244
  402   1HG2  THR  56          1HG2      THR  56  -0.431   5.051   3.508
  403   2HG2  THR  56          2HG2      THR  56   0.011   5.303   5.195
  404   3HG2  THR  56          3HG2      THR  56  -0.655   3.754   4.681
  405    H    TRP  57           H        TRP  57  -3.514   3.349   2.298
  406    HA   TRP  57           HA       TRP  57  -6.337   3.388   2.409
  407   1HB   TRP  57          1HB       TRP  57  -4.609   1.915   1.136
  408   2HB   TRP  57          2HB       TRP  57  -4.653   0.892   2.567
  409    HD1  TRP  57           HD1      TRP  57  -6.770   2.017  -0.384
  410    HE1  TRP  57           HE1      TRP  57  -8.876   0.534  -0.516
  411    HE3  TRP  57           HE3      TRP  57  -6.319  -0.552   4.007
  412    HZ2  TRP  57           HZ2      TRP  57 -10.198  -1.473   1.038
  413    HZ3  TRP  57           HZ3      TRP  57  -8.013  -2.240   4.655
  414    HH2  TRP  57           HH2      TRP  57  -9.950  -2.703   3.178
  415    HA   PRO  58           HA       PRO  58  -8.052   2.443   2.648
  416   1HB   PRO  58          1HB       PRO  58 -10.215   3.045   4.355
  417   2HB   PRO  58          2HB       PRO  58  -9.862   1.472   3.631
  418   1HG   PRO  58          1HG       PRO  58  -9.645   2.264   6.411
  419   2HG   PRO  58          2HG       PRO  58  -9.442   0.658   5.705
  420   1HD   PRO  58          1HD       PRO  58  -7.386   2.453   6.681
  421   2HD   PRO  58          2HD       PRO  58  -7.189   0.809   6.024
  422    H    LEU  59           H        LEU  59  -9.563   4.403   2.163
  423    HA   LEU  59           HA       LEU  59  -8.169   6.890   2.916
  424   1HB   LEU  59          1HB       LEU  59 -10.575   6.333   1.144
  425   2HB   LEU  59          2HB       LEU  59  -9.580   7.782   1.117
  426    HG   LEU  59           HG       LEU  59  -8.576   4.989   0.519
  427   1HD1  LEU  59          1HD1      LEU  59 -10.163   6.046  -1.176
  428   2HD1  LEU  59          2HD1      LEU  59  -8.945   7.303  -1.397
  429   3HD1  LEU  59          3HD1      LEU  59  -8.564   5.627  -1.792
  430   1HD2  LEU  59          1HD2      LEU  59  -7.303   7.636   0.922
  431   2HD2  LEU  59          2HD2      LEU  59  -6.620   6.022   1.108
  432   3HD2  LEU  59          3HD2      LEU  59  -6.751   6.745  -0.495
  433    HA   PRO  60           HA       PRO  60 -10.918   8.526   5.962
  434   1HB   PRO  60          1HB       PRO  60 -11.946  10.643   4.223
  435   2HB   PRO  60          2HB       PRO  60 -10.926  10.777   5.661
  436   1HG   PRO  60          1HG       PRO  60 -10.102  11.140   2.987
  437   2HG   PRO  60          2HG       PRO  60  -9.052  11.003   4.400
  438   1HD   PRO  60          1HD       PRO  60  -9.398   9.108   2.242
  439   2HD   PRO  60          2HD       PRO  60  -8.292   8.995   3.629
  440    H    ASN  61           H        ASN  61 -13.414   9.721   5.746
  441    HA   ASN  61           HA       ASN  61 -15.261   7.674   5.567
  442   1HB   ASN  61          1HB       ASN  61 -15.298  10.371   5.991
  443   2HB   ASN  61          2HB       ASN  61 -16.135  10.275   4.442
  444   1HD2  ASN  61          2HD2      ASN  61 -18.220   9.215   4.382
  445   2HD2  ASN  61          1HD2      ASN  61 -19.036   8.750   5.797
  446    H    LYS  62           H        LYS  62 -14.020   9.680   2.935
  447    HA   LYS  62           HA       LYS  62 -15.691   8.333   0.913
  448   1HB   LYS  62          1HB       LYS  62 -14.433   9.815  -0.623
  449   2HB   LYS  62          2HB       LYS  62 -15.050  10.719   0.759
  450   1HG   LYS  62          1HG       LYS  62 -12.645   9.980   1.747
  451   2HG   LYS  62          2HG       LYS  62 -12.247  10.054   0.030
  452   1HD   LYS  62          1HD       LYS  62 -13.460  12.344   0.055
  453   2HD   LYS  62          2HD       LYS  62 -13.291  12.255   1.809
  454   1HE   LYS  62          1HE       LYS  62 -10.778  11.741   1.310
  455   2HE   LYS  62          2HE       LYS  62 -11.127  12.437  -0.283
  456   1HZ   LYS  62          1HZ       LYS  62 -12.368  14.025   1.666
  457   2HZ   LYS  62          2HZ       LYS  62 -10.754  13.799   2.141
  458   3HZ   LYS  62          3HZ       LYS  62 -11.104  14.452   0.617
  459    H    THR  63           H        THR  63 -15.104   6.149   0.812
  460    HA   THR  63           HA       THR  63 -12.227   5.426   0.647
  461    HB   THR  63           HB       THR  63 -13.746   4.246   2.179
  462    HG1  THR  63           HG1      THR  63 -12.050   3.096   1.102
  463   1HG2  THR  63          1HG2      THR  63 -15.334   3.954  -0.341
  464   2HG2  THR  63          2HG2      THR  63 -15.423   2.671   0.865
  465   3HG2  THR  63          3HG2      THR  63 -15.886   4.317   1.294
  466    H    CYS  64           H        CYS  64 -12.368   3.140  -0.845
  467    HA   CYS  64           HA       CYS  64 -12.290   4.124  -3.567
  468   1HB   CYS  64          1HB       CYS  64 -10.858   2.350  -2.491
  469   2HB   CYS  64          2HB       CYS  64 -12.265   1.290  -2.474
  Start of MODEL   23
    1   1H    LYS   1          1H        LYS   1   5.911   6.377  10.747
    2   2H    LYS   1          2H        LYS   1   5.481   7.956  11.191
    3   3H    LYS   1          3H        LYS   1   4.467   6.655  11.599
    4    HA   LYS   1           HA       LYS   1   3.448   7.710   9.751
    5   1HB   LYS   1          1HB       LYS   1   6.331   7.792   8.909
    6   2HB   LYS   1          2HB       LYS   1   5.071   7.886   7.677
    7   1HG   LYS   1          1HG       LYS   1   4.043   9.787   8.882
    8   2HG   LYS   1          2HG       LYS   1   5.331   9.710  10.086
    9   1HD   LYS   1          1HD       LYS   1   5.725  11.439   8.300
   10   2HD   LYS   1          2HD       LYS   1   7.007  10.232   8.410
   11   1HE   LYS   1          1HE       LYS   1   6.076   9.003   6.510
   12   2HE   LYS   1          2HE       LYS   1   4.697  10.116   6.442
   13   1HZ   LYS   1          1HZ       LYS   1   6.416  11.942   6.292
   14   2HZ   LYS   1          2HZ       LYS   1   7.556  10.727   5.965
   15   3HZ   LYS   1          3HZ       LYS   1   6.248  10.965   4.911
   16    H    ASP   2           H        ASP   2   2.310   5.733   9.683
   17    HA   ASP   2           HA       ASP   2   3.419   3.690   7.789
   18   1HB   ASP   2          1HB       ASP   2   1.761   3.033  10.230
   19   2HB   ASP   2          2HB       ASP   2   2.790   1.955   9.288
   20    H    GLY   3           H        GLY   3   1.863   2.934   6.305
   21   1HA   GLY   3          1HA       GLY   3  -0.991   3.455   6.836
   22   2HA   GLY   3          2HA       GLY   3  -0.299   4.329   5.469
   23    H    TYR   4           H        TYR   4  -2.053   2.969   4.402
   24    HA   TYR   4           HA       TYR   4  -0.939   0.304   3.596
   25   1HB   TYR   4          1HB       TYR   4  -3.465   1.142   4.738
   26   2HB   TYR   4          2HB       TYR   4  -3.732   0.416   3.154
   27    HD1  TYR   4           HD1      TYR   4  -2.357  -1.804   2.694
   28    HD2  TYR   4           HD2      TYR   4  -3.287  -0.257   6.592
   29    HE1  TYR   4           HE1      TYR   4  -2.027  -4.060   3.668
   30    HE2  TYR   4           HE2      TYR   4  -2.957  -2.515   7.566
   31    HH   TYR   4           HH       TYR   4  -1.512  -5.078   5.808
   32    H    LEU   5           H        LEU   5  -1.899  -0.332   1.364
   33    HA   LEU   5           HA       LEU   5  -1.748   2.055  -0.424
   34   1HB   LEU   5          1HB       LEU   5  -1.192  -0.902  -0.679
   35   2HB   LEU   5          2HB       LEU   5  -1.391   0.100  -2.118
   36    HG   LEU   5           HG       LEU   5   0.506   0.880   0.098
   37   1HD1  LEU   5          1HD1      LEU   5   0.906  -1.031  -2.198
   38   2HD1  LEU   5          2HD1      LEU   5   2.254  -0.077  -1.580
   39   3HD1  LEU   5          3HD1      LEU   5   1.411  -1.205  -0.517
   40   1HD2  LEU   5          1HD2      LEU   5  -0.257   1.853  -2.571
   41   2HD2  LEU   5          2HD2      LEU   5   0.513   2.715  -1.239
   42   3HD2  LEU   5          3HD2      LEU   5   1.486   1.732  -2.334
   43    H    VAL   6           H        VAL   6  -3.347   2.278  -2.112
   44    HA   VAL   6           HA       VAL   6  -5.887   0.773  -1.574
   45    HB   VAL   6           HB       VAL   6  -7.012   2.824  -2.262
   46   1HG1  VAL   6          1HG1      VAL   6  -5.870   2.557   0.077
   47   2HG1  VAL   6          2HG1      VAL   6  -4.765   3.795  -0.517
   48   3HG1  VAL   6          3HG1      VAL   6  -6.490   4.138  -0.398
   49   1HG2  VAL   6          1HG2      VAL   6  -4.204   3.670  -2.993
   50   2HG2  VAL   6          2HG2      VAL   6  -5.633   3.635  -4.025
   51   3HG2  VAL   6          3HG2      VAL   6  -5.496   4.844  -2.750
   52    H    GLU   7           H        GLU   7  -7.323   1.351  -3.780
   53    HA   GLU   7           HA       GLU   7  -5.678   0.268  -6.047
   54   1HB   GLU   7          1HB       GLU   7  -7.953  -0.708  -4.699
   55   2HB   GLU   7          2HB       GLU   7  -8.548  -0.116  -6.250
   56   1HG   GLU   7          1HG       GLU   7  -6.048  -1.768  -6.200
   57   2HG   GLU   7          2HG       GLU   7  -7.607  -2.578  -6.042
   58    H    LYS   8           H        LYS   8  -6.456   0.981  -8.226
   59    HA   LYS   8           HA       LYS   8  -6.572   3.705  -8.662
   60   1HB   LYS   8          1HB       LYS   8  -7.404   3.130 -10.842
   61   2HB   LYS   8          2HB       LYS   8  -6.432   1.759 -10.306
   62   1HG   LYS   8          1HG       LYS   8  -8.577   0.714  -9.441
   63   2HG   LYS   8          2HG       LYS   8  -9.449   1.997 -10.281
   64   1HD   LYS   8          1HD       LYS   8  -9.307  -0.004 -11.701
   65   2HD   LYS   8          2HD       LYS   8  -8.377   1.318 -12.408
   66   1HE   LYS   8          1HE       LYS   8  -6.336   0.306 -11.959
   67   2HE   LYS   8          2HE       LYS   8  -6.967  -0.571 -10.551
   68   1HZ   LYS   8          1HZ       LYS   8  -8.269  -1.170 -13.069
   69   2HZ   LYS   8          2HZ       LYS   8  -6.652  -1.682 -12.967
   70   3HZ   LYS   8          3HZ       LYS   8  -7.789  -2.215 -11.823
   71    H    THR   9           H        THR   9  -9.305   1.582  -7.854
   72    HA   THR   9           HA       THR   9 -11.270   3.749  -8.099
   73    HB   THR   9           HB       THR   9 -12.762   1.913  -7.213
   74    HG1  THR   9           HG1      THR   9 -11.660   0.519  -6.090
   75   1HG2  THR   9          1HG2      THR   9 -12.261   2.231  -9.644
   76   2HG2  THR   9          2HG2      THR   9 -10.940   1.073  -9.482
   77   3HG2  THR   9          3HG2      THR   9 -12.606   0.554  -9.219
   78    H    GLY  10           H        GLY  10  -9.499   2.096  -5.529
   79   1HA   GLY  10          1HA       GLY  10  -9.127   3.857  -3.610
   80   2HA   GLY  10          2HA       GLY  10 -10.885   3.769  -3.492
   81    H    CYS  11           H        CYS  11 -10.593   0.796  -4.294
   82    HA   CYS  11           HA       CYS  11 -10.833  -0.340  -1.711
   83   1HB   CYS  11          1HB       CYS  11 -10.248  -1.332  -4.485
   84   2HB   CYS  11          2HB       CYS  11 -10.196  -2.467  -3.136
   85    H    LYS  12           H        LYS  12  -9.245  -2.204  -0.988
   86    HA   LYS  12           HA       LYS  12  -6.645  -0.959  -0.487
   87   1HB   LYS  12          1HB       LYS  12  -6.415  -2.746   1.079
   88   2HB   LYS  12          2HB       LYS  12  -8.119  -2.310   1.107
   89   1HG   LYS  12          1HG       LYS  12  -8.037  -4.179  -0.915
   90   2HG   LYS  12          2HG       LYS  12  -6.839  -4.804   0.218
   91   1HD   LYS  12          1HD       LYS  12  -8.710  -4.253   2.008
   92   2HD   LYS  12          2HD       LYS  12  -9.780  -4.385   0.613
   93   1HE   LYS  12          1HE       LYS  12  -9.691  -6.602   1.478
   94   2HE   LYS  12          2HE       LYS  12  -8.521  -6.627   0.142
   95   1HZ   LYS  12          1HZ       LYS  12  -6.849  -5.855   1.867
   96   2HZ   LYS  12          2HZ       LYS  12  -7.987  -6.324   3.038
   97   3HZ   LYS  12          3HZ       LYS  12  -7.348  -7.475   1.969
   98    H    LYS  13           H        LYS  13  -4.982  -3.129  -0.377
   99    HA   LYS  13           HA       LYS  13  -4.864  -4.295  -3.123
  100   1HB   LYS  13          1HB       LYS  13  -3.331  -2.097  -2.084
  101   2HB   LYS  13          2HB       LYS  13  -2.246  -3.467  -2.328
  102   1HG   LYS  13          1HG       LYS  13  -4.178  -3.046  -4.517
  103   2HG   LYS  13          2HG       LYS  13  -3.017  -1.735  -4.310
  104   1HD   LYS  13          1HD       LYS  13  -1.713  -4.318  -4.073
  105   2HD   LYS  13          2HD       LYS  13  -2.563  -4.177  -5.612
  106   1HE   LYS  13          1HE       LYS  13  -0.689  -2.038  -4.548
  107   2HE   LYS  13          2HE       LYS  13  -0.194  -3.303  -5.690
  108   1HZ   LYS  13          1HZ       LYS  13  -2.603  -1.656  -6.166
  109   2HZ   LYS  13          2HZ       LYS  13  -1.068  -1.128  -6.668
  110   3HZ   LYS  13          3HZ       LYS  13  -1.708  -2.572  -7.282
  111    H    THR  14           H        THR  14  -5.362  -6.304  -1.990
  112    HA   THR  14           HA       THR  14  -3.619  -7.248   0.164
  113    HB   THR  14           HB       THR  14  -5.892  -8.372  -1.480
  114    HG1  THR  14           HG1      THR  14  -6.234  -6.812   0.226
  115   1HG2  THR  14          1HG2      THR  14  -4.181  -9.722   0.611
  116   2HG2  THR  14          2HG2      THR  14  -5.818 -10.264   0.236
  117   3HG2  THR  14          3HG2      THR  14  -4.570 -10.296  -1.010
  118    H    CYS  15           H        CYS  15  -2.055  -8.892  -0.002
  119    HA   CYS  15           HA       CYS  15  -1.196  -9.576  -2.792
  120   1HB   CYS  15          1HB       CYS  15   1.038  -9.627  -1.918
  121   2HB   CYS  15          2HB       CYS  15   0.288  -8.187  -1.235
  122    H    TYR  16           H        TYR  16  -0.108 -11.807  -2.893
  123    HA   TYR  16           HA       TYR  16  -1.729 -13.718  -1.261
  124   1HB   TYR  16          1HB       TYR  16  -0.382 -13.818  -3.968
  125   2HB   TYR  16          2HB       TYR  16  -1.058 -15.254  -3.198
  126    HD1  TYR  16           HD1      TYR  16  -3.489 -15.404  -2.727
  127    HD2  TYR  16           HD2      TYR  16  -1.802 -12.089  -4.878
  128    HE1  TYR  16           HE1      TYR  16  -5.751 -14.768  -3.521
  129    HE2  TYR  16           HE2      TYR  16  -4.066 -11.454  -5.670
  130    HH   TYR  16           HH       TYR  16  -6.498 -11.829  -4.784
  131    H    LYS  17           H        LYS  17   0.867 -12.432  -0.400
  132    HA   LYS  17           HA       LYS  17   2.156 -14.874   0.568
  133   1HB   LYS  17          1HB       LYS  17   2.894 -14.072  -1.928
  134   2HB   LYS  17          2HB       LYS  17   4.042 -13.157  -0.950
  135   1HG   LYS  17          1HG       LYS  17   5.262 -15.078  -0.981
  136   2HG   LYS  17          2HG       LYS  17   4.134 -15.612   0.266
  137   1HD   LYS  17          1HD       LYS  17   2.876 -16.888  -1.230
  138   2HD   LYS  17          2HD       LYS  17   3.411 -15.957  -2.629
  139   1HE   LYS  17          1HE       LYS  17   4.841 -17.707  -2.978
  140   2HE   LYS  17          2HE       LYS  17   5.792 -16.987  -1.664
  141   1HZ   LYS  17          1HZ       LYS  17   3.479 -18.651  -0.972
  142   2HZ   LYS  17          2HZ       LYS  17   4.901 -19.433  -1.477
  143   3HZ   LYS  17          3HZ       LYS  17   4.930 -18.413  -0.122
  144    H    LEU  18           H        LEU  18   2.614 -14.299   2.647
  145    HA   LEU  18           HA       LEU  18   2.833 -11.520   3.484
  146   1HB   LEU  18          1HB       LEU  18   3.260 -14.204   4.825
  147   2HB   LEU  18          2HB       LEU  18   3.292 -12.668   5.691
  148    HG   LEU  18           HG       LEU  18   0.958 -13.698   4.051
  149   1HD1  LEU  18          1HD1      LEU  18   1.517 -13.616   7.022
  150   2HD1  LEU  18          2HD1      LEU  18  -0.114 -13.776   6.369
  151   3HD1  LEU  18          3HD1      LEU  18   1.095 -15.017   6.037
  152   1HD2  LEU  18          1HD2      LEU  18   1.671 -11.077   4.936
  153   2HD2  LEU  18          2HD2      LEU  18   0.174 -11.588   4.155
  154   3HD2  LEU  18          3HD2      LEU  18   0.306 -11.620   5.913
  155    H    GLY  19           H        GLY  19   4.756 -10.734   4.732
  156   1HA   GLY  19          1HA       GLY  19   7.114 -10.742   5.218
  157   2HA   GLY  19          2HA       GLY  19   7.329 -12.024   4.032
  158    H    GLU  20           H        GLU  20   9.136 -10.433   3.439
  159    HA   GLU  20           HA       GLU  20   8.605  -7.913   2.210
  160   1HB   GLU  20          1HB       GLU  20  10.762 -10.012   2.069
  161   2HB   GLU  20          2HB       GLU  20  10.857  -8.570   1.058
  162   1HG   GLU  20          1HG       GLU  20  11.522  -7.312   2.803
  163   2HG   GLU  20          2HG       GLU  20  10.153  -7.854   3.776
  164    H    ASN  21           H        ASN  21   6.594  -8.578   0.954
  165    HA   ASN  21           HA       ASN  21   6.976 -10.288  -1.398
  166   1HB   ASN  21          1HB       ASN  21   4.872  -9.810   0.106
  167   2HB   ASN  21          2HB       ASN  21   4.681  -8.396  -0.930
  168   1HD2  ASN  21          2HD2      ASN  21   2.957 -10.858  -0.807
  169   2HD2  ASN  21          1HD2      ASN  21   2.962 -11.492  -2.381
  170    H    ASP  22           H        ASP  22   8.618  -9.202  -2.628
  171    HA   ASP  22           HA       ASP  22   9.044  -6.571  -3.252
  172   1HB   ASP  22          1HB       ASP  22  10.259  -8.524  -4.165
  173   2HB   ASP  22          2HB       ASP  22   8.882  -8.889  -5.205
  174    H    PHE  23           H        PHE  23   6.322  -8.530  -4.362
  175    HA   PHE  23           HA       PHE  23   5.263  -6.995  -6.442
  176   1HB   PHE  23          1HB       PHE  23   4.494  -9.113  -4.875
  177   2HB   PHE  23          2HB       PHE  23   3.333  -7.879  -4.385
  178    HD1  PHE  23           HD1      PHE  23   4.972  -8.983  -7.585
  179    HD2  PHE  23           HD2      PHE  23   1.337  -7.882  -5.577
  180    HE1  PHE  23           HE1      PHE  23   3.704  -9.335  -9.687
  181    HE2  PHE  23           HE2      PHE  23   0.069  -8.237  -7.678
  182    HZ   PHE  23           HZ       PHE  23   1.253  -8.962  -9.733
  183    H    CYS  24           H        CYS  24   4.619  -6.543  -2.937
  184    HA   CYS  24           HA       CYS  24   3.199  -4.037  -3.337
  185   1HB   CYS  24          1HB       CYS  24   4.477  -5.319  -0.895
  186   2HB   CYS  24          2HB       CYS  24   3.313  -3.998  -0.857
  187    H    ASN  25           H        ASN  25   6.455  -4.908  -2.130
  188    HA   ASN  25           HA       ASN  25   7.462  -2.344  -1.559
  189   1HB   ASN  25          1HB       ASN  25   8.845  -4.712  -2.866
  190   2HB   ASN  25          2HB       ASN  25   9.651  -3.412  -1.988
  191   1HD2  ASN  25          2HD2      ASN  25  10.445  -4.860  -0.306
  192   2HD2  ASN  25          1HD2      ASN  25   9.397  -5.554   0.834
  193    H    ARG  26           H        ARG  26   7.808  -4.118  -4.661
  194    HA   ARG  26           HA       ARG  26   8.967  -2.036  -6.178
  195   1HB   ARG  26          1HB       ARG  26   8.890  -4.217  -7.099
  196   2HB   ARG  26          2HB       ARG  26   7.165  -4.385  -6.774
  197   1HG   ARG  26          1HG       ARG  26   6.555  -3.170  -8.631
  198   2HG   ARG  26          2HG       ARG  26   8.005  -2.173  -8.589
  199   1HD   ARG  26          1HD       ARG  26   9.336  -4.171  -9.334
  200   2HD   ARG  26          2HD       ARG  26   7.816  -5.058  -9.535
  201    HE   ARG  26           HE       ARG  26   8.896  -3.067 -11.335
  202   1HH1  ARG  26          1HH1      ARG  26   5.931  -4.153  -9.939
  203   2HH1  ARG  26          2HH1      ARG  26   4.942  -3.222 -11.011
  204   1HH2  ARG  26          1HH2      ARG  26   7.619  -1.882 -12.753
  205   2HH2  ARG  26          2HH2      ARG  26   5.894  -1.951 -12.612
  206    H    GLU  27           H        GLU  27   5.513  -2.822  -5.683
  207    HA   GLU  27           HA       GLU  27   4.496  -0.655  -7.289
  208   1HB   GLU  27          1HB       GLU  27   3.101  -2.528  -6.823
  209   2HB   GLU  27          2HB       GLU  27   3.418  -2.428  -5.089
  210   1HG   GLU  27          1HG       GLU  27   2.175  -0.066  -6.444
  211   2HG   GLU  27          2HG       GLU  27   1.162  -1.471  -6.113
  212    H    CYS  28           H        CYS  28   5.422  -0.958  -3.887
  213    HA   CYS  28           HA       CYS  28   4.247   1.510  -2.971
  214   1HB   CYS  28          1HB       CYS  28   5.131  -0.540  -1.677
  215   2HB   CYS  28          2HB       CYS  28   6.734   0.162  -1.899
  216    H    LYS  29           H        LYS  29   7.614   0.676  -3.886
  217    HA   LYS  29           HA       LYS  29   8.734   3.268  -3.628
  218   1HB   LYS  29          1HB       LYS  29   9.291   0.810  -5.283
  219   2HB   LYS  29          2HB       LYS  29  10.288   2.252  -5.482
  220   1HG   LYS  29          1HG       LYS  29  10.782   2.242  -3.061
  221   2HG   LYS  29          2HG       LYS  29   9.797   0.791  -2.870
  222   1HD   LYS  29          1HD       LYS  29  11.884  -0.179  -3.109
  223   2HD   LYS  29          2HD       LYS  29  11.386  -0.116  -4.800
  224   1HE   LYS  29          1HE       LYS  29  13.290   1.068  -5.182
  225   2HE   LYS  29          2HE       LYS  29  12.516   2.407  -4.311
  226   1HZ   LYS  29          1HZ       LYS  29  13.675   0.224  -2.743
  227   2HZ   LYS  29          2HZ       LYS  29  14.743   1.344  -3.443
  228   3HZ   LYS  29          3HZ       LYS  29  13.542   1.872  -2.364
  229    H    TRP  30           H        TRP  30   8.707   2.051  -6.905
  230    HA   TRP  30           HA       TRP  30   8.129   3.152  -8.921
  231   1HB   TRP  30          1HB       TRP  30   5.882   3.022  -7.043
  232   2HB   TRP  30          2HB       TRP  30   5.687   4.299  -8.243
  233    HD1  TRP  30           HD1      TRP  30   4.464   1.094  -7.905
  234    HE1  TRP  30           HE1      TRP  30   4.314  -0.228 -10.113
  235    HE3  TRP  30           HE3      TRP  30   7.604   3.878 -10.814
  236    HZ2  TRP  30           HZ2      TRP  30   5.387  -0.121 -12.761
  237    HZ3  TRP  30           HZ3      TRP  30   8.021   3.245 -13.174
  238    HH2  TRP  30           HH2      TRP  30   6.918   1.251 -14.149
  239    H    LYS  31           H        LYS  31   9.478   4.793  -6.626
  240    HA   LYS  31           HA       LYS  31  10.013   7.067  -6.222
  241   1HB   LYS  31          1HB       LYS  31   9.944   6.427  -9.031
  242   2HB   LYS  31          2HB       LYS  31   9.425   8.099  -8.812
  243   1HG   LYS  31          1HG       LYS  31  11.677   8.501  -8.808
  244   2HG   LYS  31          2HG       LYS  31  11.532   8.044  -7.111
  245   1HD   LYS  31          1HD       LYS  31  13.108   6.485  -7.606
  246   2HD   LYS  31          2HD       LYS  31  11.768   5.594  -8.328
  247   1HE   LYS  31          1HE       LYS  31  13.349   5.670 -10.084
  248   2HE   LYS  31          2HE       LYS  31  12.303   7.056 -10.456
  249   1HZ   LYS  31          1HZ       LYS  31  13.955   8.168  -8.714
  250   2HZ   LYS  31          2HZ       LYS  31  15.010   7.013  -9.377
  251   3HZ   LYS  31          3HZ       LYS  31  14.263   8.160 -10.382
  252    H    HIS  32           H        HIS  32   7.172   6.181  -5.887
  253    HA   HIS  32           HA       HIS  32   5.316   8.097  -6.887
  254   1HB   HIS  32          1HB       HIS  32   4.696   5.963  -5.866
  255   2HB   HIS  32          2HB       HIS  32   5.397   6.469  -4.327
  256    HD1  HIS  32           HD1      HIS  32   3.618   9.131  -6.148
  257    HD2  HIS  32           HD2      HIS  32   2.658   6.265  -3.278
  258    HE1  HIS  32           HE1      HIS  32   1.390   9.824  -5.163
  259    H    ILE  33           H        ILE  33   6.446   7.936  -3.493
  260    HA   ILE  33           HA       ILE  33   6.668  10.918  -3.506
  261    HB   ILE  33           HB       ILE  33   4.448   9.764  -2.669
  262   1HG1  ILE  33          1HG1      ILE  33   4.395  11.530  -0.769
  263   2HG1  ILE  33          2HG1      ILE  33   6.015  11.957  -1.322
  264   1HG2  ILE  33          1HG2      ILE  33   6.303   9.427  -0.294
  265   2HG2  ILE  33          2HG2      ILE  33   4.547   9.283  -0.223
  266   3HG2  ILE  33          3HG2      ILE  33   5.486   8.138  -1.178
  267   1HD1  ILE  33          1HD1      ILE  33   3.772  11.720  -3.310
  268   2HD1  ILE  33          2HD1      ILE  33   3.948  13.194  -2.357
  269   3HD1  ILE  33          3HD1      ILE  33   5.256  12.669  -3.417
  270    H    GLY  34           H        GLY  34   7.270   7.918  -1.663
  271   1HA   GLY  34          1HA       GLY  34   9.932   7.947  -1.261
  272   2HA   GLY  34          2HA       GLY  34   9.441   9.234  -0.157
  273    H    GLY  35           H        GLY  35   9.866   5.891  -0.456
  274   1HA   GLY  35          1HA       GLY  35   8.242   5.445   2.018
  275   2HA   GLY  35          2HA       GLY  35   8.440   4.209   0.775
  276    H    SER  36           H        SER  36   9.375   4.717   3.772
  277    HA   SER  36           HA       SER  36  12.283   4.377   3.560
  278   1HB   SER  36          1HB       SER  36  12.074   5.111   5.689
  279   2HB   SER  36          2HB       SER  36  10.325   5.097   5.493
  280    HG   SER  36           HG       SER  36  10.305   3.461   6.796
  281    H    TYR  37           H        TYR  37   9.493   2.330   4.439
  282    HA   TYR  37           HA       TYR  37  11.055  -0.077   3.643
  283   1HB   TYR  37          1HB       TYR  37  10.571   0.825   6.318
  284   2HB   TYR  37          2HB       TYR  37   9.615  -0.633   6.060
  285    HD1  TYR  37           HD1      TYR  37  11.484  -1.876   3.946
  286    HD2  TYR  37           HD2      TYR  37  12.216  -0.122   7.800
  287    HE1  TYR  37           HE1      TYR  37  13.532  -3.256   4.188
  288    HE2  TYR  37           HE2      TYR  37  14.262  -1.500   8.039
  289    HH   TYR  37           HH       TYR  37  15.038  -3.825   7.013
  290    H    GLY  38           H        GLY  38   9.685  -1.636   2.693
  291   1HA   GLY  38          1HA       GLY  38   6.756  -1.315   3.091
  292   2HA   GLY  38          2HA       GLY  38   7.382  -1.243   1.447
  293    H    TYR  39           H        TYR  39   5.693  -3.226   3.142
  294    HA   TYR  39           HA       TYR  39   6.541  -5.623   1.753
  295   1HB   TYR  39          1HB       TYR  39   7.117  -6.870   3.875
  296   2HB   TYR  39          2HB       TYR  39   8.270  -5.602   3.465
  297    HD1  TYR  39           HD1      TYR  39   8.084  -3.352   4.606
  298    HD2  TYR  39           HD2      TYR  39   5.879  -6.803   5.901
  299    HE1  TYR  39           HE1      TYR  39   7.679  -2.266   6.799
  300    HE2  TYR  39           HE2      TYR  39   5.477  -5.718   8.097
  301    HH   TYR  39           HH       TYR  39   5.630  -3.802   9.257
  302    H    CYS  40           H        CYS  40   4.960  -7.391   2.165
  303    HA   CYS  40           HA       CYS  40   2.311  -6.345   2.767
  304   1HB   CYS  40          1HB       CYS  40   3.310  -8.298   1.189
  305   2HB   CYS  40          2HB       CYS  40   2.811  -9.271   2.575
  306    H    TYR  41           H        TYR  41   1.205  -6.463   4.664
  307    HA   TYR  41           HA       TYR  41   2.131  -8.340   6.801
  308   1HB   TYR  41          1HB       TYR  41   3.018  -5.892   6.897
  309   2HB   TYR  41          2HB       TYR  41   1.366  -5.468   7.339
  310    HD1  TYR  41           HD1      TYR  41   1.046  -8.366   8.734
  311    HD2  TYR  41           HD2      TYR  41   3.776  -5.069   9.129
  312    HE1  TYR  41           HE1      TYR  41   1.503  -9.024  11.076
  313    HE2  TYR  41           HE2      TYR  41   4.233  -5.733  11.473
  314    HH   TYR  41           HH       TYR  41   2.315  -8.052  13.131
  315    H    GLY  42           H        GLY  42   0.239  -9.609   6.556
  316   1HA   GLY  42          1HA       GLY  42  -1.962 -10.049   7.455
  317   2HA   GLY  42          2HA       GLY  42  -2.266  -8.309   7.481
  318    H    PHE  43           H        PHE  43  -0.930 -10.179   4.793
  319    HA   PHE  43           HA       PHE  43  -1.700 -10.429   2.577
  320   1HB   PHE  43          1HB       PHE  43  -4.211 -10.407   4.259
  321   2HB   PHE  43          2HB       PHE  43  -4.276 -10.654   2.514
  322    HD1  PHE  43           HD1      PHE  43  -1.872 -12.213   1.959
  323    HD2  PHE  43           HD2      PHE  43  -4.612 -12.499   5.255
  324    HE1  PHE  43           HE1      PHE  43  -1.244 -14.591   2.273
  325    HE2  PHE  43           HE2      PHE  43  -3.984 -14.877   5.570
  326    HZ   PHE  43           HZ       PHE  43  -2.299 -15.923   4.080
  327    H    GLY  44           H        GLY  44  -0.909  -7.858   3.172
  328   1HA   GLY  44          1HA       GLY  44  -2.491  -6.296   1.296
  329   2HA   GLY  44          2HA       GLY  44  -2.622  -5.700   2.951
  330    H    CYS  45           H        CYS  45  -1.163  -4.747   0.361
  331    HA   CYS  45           HA       CYS  45   1.660  -4.787   0.965
  332   1HB   CYS  45          1HB       CYS  45  -0.050  -2.899  -0.688
  333   2HB   CYS  45          2HB       CYS  45   1.704  -3.034  -0.789
  334    H    TYR  46           H        TYR  46   2.068  -4.028   3.083
  335    HA   TYR  46           HA       TYR  46   0.957  -1.391   3.900
  336   1HB   TYR  46          1HB       TYR  46   1.159  -3.647   5.252
  337   2HB   TYR  46          2HB       TYR  46   2.824  -3.121   5.504
  338    HD1  TYR  46           HD1      TYR  46  -0.677  -1.780   5.673
  339    HD2  TYR  46           HD2      TYR  46   3.295  -1.722   7.305
  340    HE1  TYR  46           HE1      TYR  46  -1.433  -0.233   7.457
  341    HE2  TYR  46           HE2      TYR  46   2.539  -0.176   9.090
  342    HH   TYR  46           HH       TYR  46  -0.132   1.598   8.979
  343    H    CYS  47           H        CYS  47   2.320   0.423   4.261
  344    HA   CYS  47           HA       CYS  47   5.230   0.042   3.663
  345   1HB   CYS  47          1HB       CYS  47   3.162   1.662   2.226
  346   2HB   CYS  47          2HB       CYS  47   4.802   2.305   2.324
  347    H    GLU  48           H        GLU  48   6.523   1.241   5.014
  348    HA   GLU  48           HA       GLU  48   5.190   3.082   6.937
  349   1HB   GLU  48          1HB       GLU  48   7.923   1.765   6.813
  350   2HB   GLU  48          2HB       GLU  48   7.378   2.797   8.135
  351   1HG   GLU  48          1HG       GLU  48   5.294   1.089   8.041
  352   2HG   GLU  48          2HG       GLU  48   6.563   0.021   7.440
  353    H    GLY  49           H        GLY  49   6.323   5.160   7.417
  354   1HA   GLY  49          1HA       GLY  49   7.563   7.084   6.813
  355   2HA   GLY  49          2HA       GLY  49   8.292   6.155   5.502
  356    H    LEU  50           H        LEU  50   4.817   6.358   5.946
  357    HA   LEU  50           HA       LEU  50   4.583   7.581   3.259
  358   1HB   LEU  50          1HB       LEU  50   2.483   6.534   5.177
  359   2HB   LEU  50          2HB       LEU  50   2.282   6.824   3.449
  360    HG   LEU  50           HG       LEU  50   3.983   4.714   4.790
  361   1HD1  LEU  50          1HD1      LEU  50   1.502   4.378   4.271
  362   2HD1  LEU  50          2HD1      LEU  50   1.948   4.473   2.568
  363   3HD1  LEU  50          3HD1      LEU  50   2.603   3.187   3.580
  364   1HD2  LEU  50          1HD2      LEU  50   5.275   5.827   2.973
  365   2HD2  LEU  50          2HD2      LEU  50   4.855   4.165   2.560
  366   3HD2  LEU  50          3HD2      LEU  50   3.948   5.504   1.858
  367    HA   PRO  51           HA       PRO  51   4.228  11.574   5.393
  368   1HB   PRO  51          1HB       PRO  51   3.339  12.500   2.761
  369   2HB   PRO  51          2HB       PRO  51   4.778  12.962   3.677
  370   1HG   PRO  51          1HG       PRO  51   4.723  11.330   1.379
  371   2HG   PRO  51          2HG       PRO  51   6.093  11.562   2.467
  372   1HD   PRO  51          1HD       PRO  51   4.459   9.185   2.117
  373   2HD   PRO  51          2HD       PRO  51   5.909   9.389   3.130
  374    H    ASP  52           H        ASP  52   2.378  12.786   6.075
  375    HA   ASP  52           HA       ASP  52  -0.148  11.441   6.095
  376   1HB   ASP  52          1HB       ASP  52   0.979  14.096   6.879
  377   2HB   ASP  52          2HB       ASP  52  -0.778  13.946   6.816
  378    H    SER  53           H        SER  53   1.315  13.356   3.661
  379    HA   SER  53           HA       SER  53  -1.277  14.256   2.522
  380   1HB   SER  53          1HB       SER  53   1.541  15.001   2.428
  381   2HB   SER  53          2HB       SER  53   0.830  14.942   0.818
  382    HG   SER  53           HG       SER  53  -0.050  16.408   3.084
  383    H    THR  54           H        THR  54   1.154  11.780   2.046
  384    HA   THR  54           HA       THR  54   0.639  11.157  -0.706
  385    HB   THR  54           HB       THR  54   1.495   9.365   1.592
  386    HG1  THR  54           HG1      THR  54   2.874  11.056   1.557
  387   1HG2  THR  54          1HG2      THR  54   1.486   9.127  -1.382
  388   2HG2  THR  54          2HG2      THR  54   2.880   8.481  -0.516
  389   3HG2  THR  54          3HG2      THR  54   1.262   7.880  -0.155
  390    H    GLN  55           H        GLN  55  -0.589   9.274  -1.516
  391    HA   GLN  55           HA       GLN  55  -3.240   9.063  -0.299
  392   1HB   GLN  55          1HB       GLN  55  -1.838   8.394  -2.791
  393   2HB   GLN  55          2HB       GLN  55  -3.050   7.196  -2.334
  394   1HG   GLN  55          1HG       GLN  55  -4.301   9.632  -1.829
  395   2HG   GLN  55          2HG       GLN  55  -3.423   9.913  -3.333
  396   1HE2  GLN  55          2HE2      GLN  55  -6.090   8.171  -1.878
  397   2HE2  GLN  55          1HE2      GLN  55  -6.647   7.439  -3.304
  398    H    THR  56           H        THR  56  -3.993   7.370   0.953
  399    HA   THR  56           HA       THR  56  -2.616   4.777   1.013
  400    HB   THR  56           HB       THR  56  -2.622   5.547   3.704
  401    HG1  THR  56           HG1      THR  56  -1.323   7.507   3.496
  402   1HG2  THR  56          1HG2      THR  56  -0.802   4.702   1.674
  403   2HG2  THR  56          2HG2      THR  56  -0.048   6.015   2.580
  404   3HG2  THR  56          3HG2      THR  56  -0.621   4.576   3.424
  405    H    TRP  57           H        TRP  57  -3.878   3.185   2.186
  406    HA   TRP  57           HA       TRP  57  -6.741   3.790   2.320
  407   1HB   TRP  57          1HB       TRP  57  -5.350   1.635   1.617
  408   2HB   TRP  57          2HB       TRP  57  -5.455   1.275   3.338
  409    HD1  TRP  57           HD1      TRP  57  -7.632   1.758   0.236
  410    HE1  TRP  57           HE1      TRP  57  -9.964   0.759   0.692
  411    HE3  TRP  57           HE3      TRP  57  -7.154   0.633   5.191
  412    HZ2  TRP  57           HZ2      TRP  57 -11.433  -0.370   2.870
  413    HZ3  TRP  57           HZ3      TRP  57  -9.032  -0.401   6.432
  414    HH2  TRP  57           HH2      TRP  57 -11.170  -0.906   5.279
  415    HA   PRO  58           HA       PRO  58  -8.462   3.129   3.223
  416   1HB   PRO  58          1HB       PRO  58 -10.260   4.625   4.782
  417   2HB   PRO  58          2HB       PRO  58 -10.067   2.869   4.814
  418   1HG   PRO  58          1HG       PRO  58  -9.314   4.813   6.841
  419   2HG   PRO  58          2HG       PRO  58  -9.321   3.051   6.948
  420   1HD   PRO  58          1HD       PRO  58  -7.038   4.803   6.672
  421   2HD   PRO  58          2HD       PRO  58  -7.045   3.025   6.790
  422    H    LEU  59           H        LEU  59 -10.076   4.858   2.283
  423    HA   LEU  59           HA       LEU  59  -8.501   7.283   1.605
  424   1HB   LEU  59          1HB       LEU  59 -10.874   5.774   0.523
  425   2HB   LEU  59          2HB       LEU  59 -10.549   7.413  -0.035
  426    HG   LEU  59           HG       LEU  59  -8.450   5.237  -0.044
  427   1HD1  LEU  59          1HD1      LEU  59 -10.640   5.869  -1.969
  428   2HD1  LEU  59          2HD1      LEU  59  -9.053   5.501  -2.643
  429   3HD1  LEU  59          3HD1      LEU  59  -9.869   4.323  -1.614
  430   1HD2  LEU  59          1HD2      LEU  59  -7.769   7.671  -0.109
  431   2HD2  LEU  59          2HD2      LEU  59  -7.273   6.747  -1.528
  432   3HD2  LEU  59          3HD2      LEU  59  -8.669   7.821  -1.618
  433    HA   PRO  60           HA       PRO  60 -10.821  10.271   3.853
  434   1HB   PRO  60          1HB       PRO  60 -11.944  11.540   1.482
  435   2HB   PRO  60          2HB       PRO  60 -10.707  12.149   2.586
  436   1HG   PRO  60          1HG       PRO  60 -10.315  11.190  -0.061
  437   2HG   PRO  60          2HG       PRO  60  -9.068  11.649   1.102
  438   1HD   PRO  60          1HD       PRO  60  -9.701   9.006   0.149
  439   2HD   PRO  60          2HD       PRO  60  -8.459   9.467   1.336
  440    H    ASN  61           H        ASN  61 -13.271  11.455   3.359
  441    HA   ASN  61           HA       ASN  61 -15.214   9.656   4.178
  442   1HB   ASN  61          1HB       ASN  61 -15.811  11.920   4.184
  443   2HB   ASN  61          2HB       ASN  61 -15.214  12.182   2.546
  444   1HD2  ASN  61          2HD2      ASN  61 -17.857  10.519   4.333
  445   2HD2  ASN  61          1HD2      ASN  61 -18.979  10.615   3.063
  446    H    LYS  62           H        LYS  62 -13.913  10.122   0.965
  447    HA   LYS  62           HA       LYS  62 -15.966   8.443  -0.330
  448   1HB   LYS  62          1HB       LYS  62 -14.649   8.966  -2.336
  449   2HB   LYS  62          2HB       LYS  62 -14.893  10.432  -1.388
  450   1HG   LYS  62          1HG       LYS  62 -12.652  10.695  -1.477
  451   2HG   LYS  62          2HG       LYS  62 -12.563   9.364  -0.322
  452   1HD   LYS  62          1HD       LYS  62 -11.387   8.247  -1.891
  453   2HD   LYS  62          2HD       LYS  62 -12.908   8.088  -2.772
  454   1HE   LYS  62          1HE       LYS  62 -12.463  10.108  -4.042
  455   2HE   LYS  62          2HE       LYS  62 -11.025  10.458  -3.061
  456   1HZ   LYS  62          1HZ       LYS  62 -11.281   7.831  -4.355
  457   2HZ   LYS  62          2HZ       LYS  62 -10.782   9.153  -5.291
  458   3HZ   LYS  62          3HZ       LYS  62  -9.877   8.688  -3.931
  459    H    THR  63           H        THR  63 -15.741   6.334   0.540
  460    HA   THR  63           HA       THR  63 -13.047   5.062   0.436
  461    HB   THR  63           HB       THR  63 -15.489   3.740   1.524
  462    HG1  THR  63           HG1      THR  63 -14.195   5.881   2.846
  463   1HG2  THR  63          1HG2      THR  63 -12.669   3.483   1.725
  464   2HG2  THR  63          2HG2      THR  63 -13.255   3.964   3.316
  465   3HG2  THR  63          3HG2      THR  63 -13.898   2.517   2.540
  466    H    CYS  64           H        CYS  64 -13.159   2.659  -0.286
  467    HA   CYS  64           HA       CYS  64 -14.316   2.534  -2.962
  468   1HB   CYS  64          1HB       CYS  64 -12.111   1.549  -1.971
  469   2HB   CYS  64          2HB       CYS  64 -13.141   0.233  -1.408
  Start of MODEL   24
    1   1H    LYS   1          1H        LYS   1   5.027   6.506   8.434
    2   2H    LYS   1          2H        LYS   1   5.275   7.245   9.943
    3   3H    LYS   1          3H        LYS   1   6.256   5.947   9.467
    4    HA   LYS   1           HA       LYS   1   4.771   4.941  10.930
    5   1HB   LYS   1          1HB       LYS   1   2.451   5.651  11.043
    6   2HB   LYS   1          2HB       LYS   1   3.462   7.095  11.017
    7   1HG   LYS   1          1HG       LYS   1   2.793   7.697   8.898
    8   2HG   LYS   1          2HG       LYS   1   2.552   6.029   8.382
    9   1HD   LYS   1          1HD       LYS   1   0.718   6.633  10.515
   10   2HD   LYS   1          2HD       LYS   1   0.578   7.860   9.257
   11   1HE   LYS   1          1HE       LYS   1   0.770   5.484   7.813
   12   2HE   LYS   1          2HE       LYS   1  -0.265   5.062   9.192
   13   1HZ   LYS   1          1HZ       LYS   1  -1.533   7.108   8.777
   14   2HZ   LYS   1          2HZ       LYS   1  -0.594   7.405   7.392
   15   3HZ   LYS   1          3HZ       LYS   1  -1.606   6.042   7.460
   16    H    ASP   2           H        ASP   2   3.320   3.079  10.479
   17    HA   ASP   2           HA       ASP   2   3.777   1.948   7.832
   18   1HB   ASP   2          1HB       ASP   2   1.907   0.949   9.995
   19   2HB   ASP   2          2HB       ASP   2   2.806   0.001   8.812
   20    H    GLY   3           H        GLY   3   2.242   1.717   6.162
   21   1HA   GLY   3          1HA       GLY   3  -0.489   2.805   6.674
   22   2HA   GLY   3          2HA       GLY   3   0.451   3.418   5.318
   23    H    TYR   4           H        TYR   4  -1.527   2.573   4.159
   24    HA   TYR   4           HA       TYR   4  -1.031  -0.262   3.337
   25   1HB   TYR   4          1HB       TYR   4  -3.297   0.899   4.722
   26   2HB   TYR   4          2HB       TYR   4  -3.802   0.241   3.165
   27    HD1  TYR   4           HD1      TYR   4  -2.612  -2.120   2.586
   28    HD2  TYR   4           HD2      TYR   4  -3.301  -0.561   6.527
   29    HE1  TYR   4           HE1      TYR   4  -2.481  -4.416   3.518
   30    HE2  TYR   4           HE2      TYR   4  -3.167  -2.852   7.460
   31    HH   TYR   4           HH       TYR   4  -1.951  -5.116   6.610
   32    H    LEU   5           H        LEU   5  -0.162   0.306   1.327
   33    HA   LEU   5           HA       LEU   5  -0.697   2.366  -0.411
   34   1HB   LEU   5          1HB       LEU   5  -0.303  -0.593  -0.922
   35   2HB   LEU   5          2HB       LEU   5  -0.215   0.621  -2.199
   36    HG   LEU   5           HG       LEU   5   1.396   1.038   0.291
   37   1HD1  LEU   5          1HD1      LEU   5   1.742  -1.344  -0.506
   38   2HD1  LEU   5          2HD1      LEU   5   2.333  -0.671  -2.026
   39   3HD1  LEU   5          3HD1      LEU   5   3.191  -0.340  -0.522
   40   1HD2  LEU   5          1HD2      LEU   5   1.058   2.378  -2.119
   41   2HD2  LEU   5          2HD2      LEU   5   2.395   2.615  -0.994
   42   3HD2  LEU   5          3HD2      LEU   5   2.574   1.506  -2.354
   43    H    VAL   6           H        VAL   6  -2.346   2.948  -1.833
   44    HA   VAL   6           HA       VAL   6  -4.866   1.336  -1.695
   45    HB   VAL   6           HB       VAL   6  -5.994   3.407  -2.054
   46   1HG1  VAL   6          1HG1      VAL   6  -4.124   3.125   0.022
   47   2HG1  VAL   6          2HG1      VAL   6  -3.931   4.781  -0.556
   48   3HG1  VAL   6          3HG1      VAL   6  -5.511   4.215  -0.013
   49   1HG2  VAL   6          1HG2      VAL   6  -3.412   4.149  -3.311
   50   2HG2  VAL   6          2HG2      VAL   6  -5.057   4.604  -3.760
   51   3HG2  VAL   6          3HG2      VAL   6  -4.236   5.447  -2.445
   52    H    GLU   7           H        GLU   7  -6.138   2.275  -3.940
   53    HA   GLU   7           HA       GLU   7  -4.338   1.405  -6.184
   54   1HB   GLU   7          1HB       GLU   7  -6.326  -0.055  -5.186
   55   2HB   GLU   7          2HB       GLU   7  -7.304   0.989  -6.219
   56   1HG   GLU   7          1HG       GLU   7  -4.906   0.028  -7.582
   57   2HG   GLU   7          2HG       GLU   7  -5.938  -1.295  -7.040
   58    H    LYS   8           H        LYS   8  -5.408   2.102  -8.373
   59    HA   LYS   8           HA       LYS   8  -5.360   4.844  -8.738
   60   1HB   LYS   8          1HB       LYS   8  -5.616   2.781 -10.344
   61   2HB   LYS   8          2HB       LYS   8  -7.341   3.133 -10.224
   62   1HG   LYS   8          1HG       LYS   8  -7.065   4.725 -11.789
   63   2HG   LYS   8          2HG       LYS   8  -6.077   5.620 -10.634
   64   1HD   LYS   8          1HD       LYS   8  -4.162   4.025 -11.400
   65   2HD   LYS   8          2HD       LYS   8  -5.193   3.730 -12.801
   66   1HE   LYS   8          1HE       LYS   8  -5.315   6.443 -12.701
   67   2HE   LYS   8          2HE       LYS   8  -3.683   6.175 -12.060
   68   1HZ   LYS   8          1HZ       LYS   8  -3.935   4.358 -14.092
   69   2HZ   LYS   8          2HZ       LYS   8  -4.669   5.759 -14.713
   70   3HZ   LYS   8          3HZ       LYS   8  -3.065   5.812 -14.156
   71    H    THR   9           H        THR   9  -8.301   2.898  -8.099
   72    HA   THR   9           HA       THR   9 -10.009   5.265  -7.918
   73    HB   THR   9           HB       THR   9 -11.597   3.389  -7.065
   74    HG1  THR   9           HG1      THR   9 -10.631   1.308  -7.808
   75   1HG2  THR   9          1HG2      THR   9 -10.982   4.273  -9.544
   76   2HG2  THR   9          2HG2      THR   9 -10.513   2.582  -9.708
   77   3HG2  THR   9          3HG2      THR   9 -12.163   2.998  -9.246
   78    H    GLY  10           H        GLY  10  -7.928   3.565  -5.760
   79   1HA   GLY  10          1HA       GLY  10  -7.395   4.627  -3.601
   80   2HA   GLY  10          2HA       GLY  10  -9.090   5.101  -3.476
   81    H    CYS  11           H        CYS  11  -8.819   1.977  -4.728
   82    HA   CYS  11           HA       CYS  11  -9.921   0.808  -2.281
   83   1HB   CYS  11          1HB       CYS  11  -9.005  -0.546  -4.833
   84   2HB   CYS  11          2HB       CYS  11 -10.231  -1.114  -3.700
   85    H    LYS  12           H        LYS  12  -8.922  -1.345  -1.499
   86    HA   LYS  12           HA       LYS  12  -6.063  -0.896  -0.926
   87   1HB   LYS  12          1HB       LYS  12  -7.862  -3.161  -0.037
   88   2HB   LYS  12          2HB       LYS  12  -6.458  -2.500   0.797
   89   1HG   LYS  12          1HG       LYS  12  -7.820  -1.106   1.917
   90   2HG   LYS  12          2HG       LYS  12  -8.235  -0.333   0.385
   91   1HD   LYS  12          1HD       LYS  12  -9.637  -2.845   0.622
   92   2HD   LYS  12          2HD       LYS  12  -9.941  -1.853   2.049
   93   1HE   LYS  12          1HE       LYS  12 -10.215   0.051   0.158
   94   2HE   LYS  12          2HE       LYS  12 -10.715  -1.367  -0.786
   95   1HZ   LYS  12          1HZ       LYS  12 -12.192  -2.001   1.029
   96   2HZ   LYS  12          2HZ       LYS  12 -11.741  -0.618   1.902
   97   3HZ   LYS  12          3HZ       LYS  12 -12.591  -0.458   0.440
   98    H    LYS  13           H        LYS  13  -4.948  -3.339  -0.747
   99    HA   LYS  13           HA       LYS  13  -5.455  -4.778  -3.315
  100   1HB   LYS  13          1HB       LYS  13  -3.729  -2.987  -3.602
  101   2HB   LYS  13          2HB       LYS  13  -2.761  -3.771  -2.353
  102   1HG   LYS  13          1HG       LYS  13  -1.840  -4.765  -4.226
  103   2HG   LYS  13          2HG       LYS  13  -3.144  -5.907  -3.896
  104   1HD   LYS  13          1HD       LYS  13  -4.112  -3.682  -5.482
  105   2HD   LYS  13          2HD       LYS  13  -2.741  -4.462  -6.271
  106   1HE   LYS  13          1HE       LYS  13  -4.735  -6.322  -5.098
  107   2HE   LYS  13          2HE       LYS  13  -5.292  -5.384  -6.497
  108   1HZ   LYS  13          1HZ       LYS  13  -2.711  -6.851  -6.381
  109   2HZ   LYS  13          2HZ       LYS  13  -4.113  -7.447  -7.132
  110   3HZ   LYS  13          3HZ       LYS  13  -3.358  -6.044  -7.725
  111    H    THR  14           H        THR  14  -5.353  -6.969  -3.006
  112    HA   THR  14           HA       THR  14  -4.179  -7.971  -0.439
  113    HB   THR  14           HB       THR  14  -6.356  -8.886  -2.324
  114    HG1  THR  14           HG1      THR  14  -6.109  -8.009   0.316
  115   1HG2  THR  14          1HG2      THR  14  -4.932 -10.846  -1.752
  116   2HG2  THR  14          2HG2      THR  14  -5.165 -10.486  -0.041
  117   3HG2  THR  14          3HG2      THR  14  -6.542 -10.957  -1.039
  118    H    CYS  15           H        CYS  15  -3.111 -10.161  -0.629
  119    HA   CYS  15           HA       CYS  15  -2.021 -10.804  -3.326
  120   1HB   CYS  15          1HB       CYS  15   0.286 -10.707  -2.358
  121   2HB   CYS  15          2HB       CYS  15  -0.515  -9.135  -2.352
  122    H    TYR  16           H        TYR  16  -1.302 -12.999  -3.463
  123    HA   TYR  16           HA       TYR  16  -2.322 -14.773  -1.334
  124   1HB   TYR  16          1HB       TYR  16  -1.565 -14.888  -4.181
  125   2HB   TYR  16          2HB       TYR  16  -1.132 -16.335  -3.270
  126    HD1  TYR  16           HD1      TYR  16  -3.963 -14.117  -2.401
  127    HD2  TYR  16           HD2      TYR  16  -2.786 -17.815  -4.243
  128    HE1  TYR  16           HE1      TYR  16  -6.331 -14.851  -2.436
  129    HE2  TYR  16           HE2      TYR  16  -5.156 -18.551  -4.278
  130    HH   TYR  16           HH       TYR  16  -7.494 -17.220  -4.296
  131    H    LYS  17           H        LYS  17   0.787 -13.801  -2.743
  132    HA   LYS  17           HA       LYS  17   2.266 -15.650  -0.958
  133   1HB   LYS  17          1HB       LYS  17   2.973 -13.715  -3.177
  134   2HB   LYS  17          2HB       LYS  17   4.206 -14.557  -2.238
  135   1HG   LYS  17          1HG       LYS  17   2.008 -15.852  -3.877
  136   2HG   LYS  17          2HG       LYS  17   3.728 -15.829  -4.268
  137   1HD   LYS  17          1HD       LYS  17   4.060 -16.946  -1.953
  138   2HD   LYS  17          2HD       LYS  17   2.332 -17.292  -2.031
  139   1HE   LYS  17          1HE       LYS  17   2.705 -19.024  -3.442
  140   2HE   LYS  17          2HE       LYS  17   3.597 -17.966  -4.554
  141   1HZ   LYS  17          1HZ       LYS  17   4.692 -19.128  -2.046
  142   2HZ   LYS  17          2HZ       LYS  17   5.033 -19.694  -3.611
  143   3HZ   LYS  17          3HZ       LYS  17   5.537 -18.145  -3.143
  144    H    LEU  18           H        LEU  18   2.189 -14.829   1.140
  145    HA   LEU  18           HA       LEU  18   2.405 -11.964   1.696
  146   1HB   LEU  18          1HB       LEU  18   2.530 -14.414   3.483
  147   2HB   LEU  18          2HB       LEU  18   2.226 -12.760   4.015
  148    HG   LEU  18           HG       LEU  18   0.489 -14.319   2.082
  149   1HD1  LEU  18          1HD1      LEU  18   0.577 -14.167   4.988
  150   2HD1  LEU  18          2HD1      LEU  18  -0.971 -13.604   4.358
  151   3HD1  LEU  18          3HD1      LEU  18  -0.390 -15.219   3.955
  152   1HD2  LEU  18          1HD2      LEU  18   0.760 -11.509   2.650
  153   2HD2  LEU  18          2HD2      LEU  18  -0.346 -12.302   1.528
  154   3HD2  LEU  18          3HD2      LEU  18  -0.818 -12.065   3.209
  155    H    GLY  19           H        GLY  19   4.111 -11.331   3.446
  156   1HA   GLY  19          1HA       GLY  19   6.380 -11.639   4.314
  157   2HA   GLY  19          2HA       GLY  19   6.722 -12.676   2.930
  158    H    GLU  20           H        GLU  20   8.614 -11.184   2.725
  159    HA   GLU  20           HA       GLU  20   8.387  -8.415   2.081
  160   1HB   GLU  20          1HB       GLU  20  10.357 -10.590   1.316
  161   2HB   GLU  20          2HB       GLU  20  10.634  -8.879   0.986
  162   1HG   GLU  20          1HG       GLU  20  11.509  -8.732   3.060
  163   2HG   GLU  20          2HG       GLU  20   9.869  -8.942   3.672
  164    H    ASN  21           H        ASN  21   6.324  -8.726   0.687
  165    HA   ASN  21           HA       ASN  21   6.792  -9.744  -2.046
  166   1HB   ASN  21          1HB       ASN  21   4.680  -9.885  -0.477
  167   2HB   ASN  21          2HB       ASN  21   4.351  -8.266  -1.097
  168   1HD2  ASN  21          2HD2      ASN  21   2.625 -10.460  -1.742
  169   2HD2  ASN  21          1HD2      ASN  21   2.776 -10.791  -3.400
  170    H    ASP  22           H        ASP  22   8.302  -8.222  -2.918
  171    HA   ASP  22           HA       ASP  22   8.398  -5.465  -2.742
  172   1HB   ASP  22          1HB       ASP  22   8.877  -7.467  -4.925
  173   2HB   ASP  22          2HB       ASP  22   9.050  -5.750  -5.291
  174    H    PHE  23           H        PHE  23   5.953  -7.391  -4.384
  175    HA   PHE  23           HA       PHE  23   4.765  -5.705  -6.219
  176   1HB   PHE  23          1HB       PHE  23   4.043  -7.992  -5.311
  177   2HB   PHE  23          2HB       PHE  23   3.228  -7.111  -4.019
  178    HD1  PHE  23           HD1      PHE  23   3.476  -7.287  -7.754
  179    HD2  PHE  23           HD2      PHE  23   1.063  -6.264  -4.350
  180    HE1  PHE  23           HE1      PHE  23   1.544  -6.867  -9.249
  181    HE2  PHE  23           HE2      PHE  23  -0.868  -5.843  -5.846
  182    HZ   PHE  23           HZ       PHE  23  -0.628  -6.145  -8.296
  183    H    CYS  24           H        CYS  24   4.140  -5.613  -2.700
  184    HA   CYS  24           HA       CYS  24   2.546  -3.215  -2.773
  185   1HB   CYS  24          1HB       CYS  24   4.222  -4.353  -0.516
  186   2HB   CYS  24          2HB       CYS  24   2.759  -3.378  -0.367
  187    H    ASN  25           H        ASN  25   5.993  -3.834  -2.044
  188    HA   ASN  25           HA       ASN  25   6.776  -1.184  -1.411
  189   1HB   ASN  25          1HB       ASN  25   8.277  -3.010  -1.054
  190   2HB   ASN  25          2HB       ASN  25   8.144  -3.542  -2.731
  191   1HD2  ASN  25          2HD2      ASN  25  10.461  -3.316  -3.121
  192   2HD2  ASN  25          1HD2      ASN  25  11.196  -1.790  -3.222
  193    H    ARG  26           H        ARG  26   6.857  -2.854  -4.585
  194    HA   ARG  26           HA       ARG  26   7.751  -0.780  -6.228
  195   1HB   ARG  26          1HB       ARG  26   6.173  -3.227  -6.425
  196   2HB   ARG  26          2HB       ARG  26   5.655  -2.032  -7.615
  197   1HG   ARG  26          1HG       ARG  26   7.858  -1.851  -8.532
  198   2HG   ARG  26          2HG       ARG  26   8.564  -2.748  -7.187
  199   1HD   ARG  26          1HD       ARG  26   8.391  -4.285  -9.056
  200   2HD   ARG  26          2HD       ARG  26   7.115  -4.729  -7.907
  201    HE   ARG  26           HE       ARG  26   5.984  -2.776  -9.579
  202   1HH1  ARG  26          1HH1      ARG  26   7.446  -5.889  -9.892
  203   2HH1  ARG  26          2HH1      ARG  26   6.541  -6.314 -11.306
  204   1HH2  ARG  26          1HH2      ARG  26   4.809  -3.316 -11.430
  205   2HH2  ARG  26          2HH2      ARG  26   5.053  -4.859 -12.178
  206    H    GLU  27           H        GLU  27   4.396  -1.393  -5.129
  207    HA   GLU  27           HA       GLU  27   3.279   0.951  -6.416
  208   1HB   GLU  27          1HB       GLU  27   2.490  -1.244  -4.632
  209   2HB   GLU  27          2HB       GLU  27   1.645   0.262  -4.273
  210   1HG   GLU  27          1HG       GLU  27   0.331  -0.019  -6.074
  211   2HG   GLU  27          2HG       GLU  27   1.751  -0.072  -7.120
  212    H    CYS  28           H        CYS  28   5.068   0.418  -3.495
  213    HA   CYS  28           HA       CYS  28   4.097   2.700  -1.993
  214   1HB   CYS  28          1HB       CYS  28   5.588   0.465  -1.509
  215   2HB   CYS  28          2HB       CYS  28   6.853   1.693  -1.575
  216    H    LYS  29           H        LYS  29   6.769   2.166  -4.275
  217    HA   LYS  29           HA       LYS  29   8.089   4.685  -3.849
  218   1HB   LYS  29          1HB       LYS  29   8.700   2.414  -5.099
  219   2HB   LYS  29          2HB       LYS  29   8.082   3.289  -6.500
  220   1HG   LYS  29          1HG       LYS  29   9.646   5.124  -6.085
  221   2HG   LYS  29          2HG       LYS  29  10.234   4.319  -4.629
  222   1HD   LYS  29          1HD       LYS  29  10.688   2.311  -6.263
  223   2HD   LYS  29          2HD       LYS  29  10.647   3.564  -7.505
  224   1HE   LYS  29          1HE       LYS  29  12.363   3.809  -5.017
  225   2HE   LYS  29          2HE       LYS  29  12.960   3.099  -6.530
  226   1HZ   LYS  29          1HZ       LYS  29  11.545   5.441  -7.145
  227   2HZ   LYS  29          2HZ       LYS  29  12.651   5.816  -5.910
  228   3HZ   LYS  29          3HZ       LYS  29  13.198   5.129  -7.363
  229    H    TRP  30           H        TRP  30   6.328   3.757  -6.822
  230    HA   TRP  30           HA       TRP  30   5.171   5.132  -8.363
  231   1HB   TRP  30          1HB       TRP  30   4.072   5.246  -5.664
  232   2HB   TRP  30          2HB       TRP  30   3.647   6.678  -6.601
  233    HD1  TRP  30           HD1      TRP  30   1.904   3.863  -5.790
  234    HE1  TRP  30           HE1      TRP  30   0.507   2.858  -7.708
  235    HE3  TRP  30           HE3      TRP  30   4.179   6.075  -9.792
  236    HZ2  TRP  30           HZ2      TRP  30   0.373   2.973 -10.564
  237    HZ3  TRP  30           HZ3      TRP  30   3.398   5.611 -12.098
  238    HH2  TRP  30           HH2      TRP  30   1.499   4.065 -12.489
  239    H    LYS  31           H        LYS  31   5.030   7.638  -5.885
  240    HA   LYS  31           HA       LYS  31   6.786   9.341  -7.624
  241   1HB   LYS  31          1HB       LYS  31   4.365   9.950  -5.902
  242   2HB   LYS  31          2HB       LYS  31   5.343  11.193  -6.683
  243   1HG   LYS  31          1HG       LYS  31   4.186   8.907  -8.271
  244   2HG   LYS  31          2HG       LYS  31   3.239  10.358  -7.944
  245   1HD   LYS  31          1HD       LYS  31   5.029  11.744  -8.946
  246   2HD   LYS  31          2HD       LYS  31   5.950  10.282  -9.297
  247   1HE   LYS  31          1HE       LYS  31   4.007   9.461 -10.678
  248   2HE   LYS  31          2HE       LYS  31   3.244  11.046 -10.445
  249   1HZ   LYS  31          1HZ       LYS  31   5.228  12.101 -11.327
  250   2HZ   LYS  31          2HZ       LYS  31   5.963  10.589 -11.556
  251   3HZ   LYS  31          3HZ       LYS  31   4.590  11.012 -12.465
  252    H    HIS  32           H        HIS  32   8.116   7.841  -5.707
  253    HA   HIS  32           HA       HIS  32   9.396   7.989  -3.707
  254   1HB   HIS  32          1HB       HIS  32  10.604   9.435  -5.200
  255   2HB   HIS  32          2HB       HIS  32   9.429  10.734  -4.991
  256    HD1  HIS  32           HD1      HIS  32  10.047  12.451  -3.298
  257    HD2  HIS  32           HD2      HIS  32  11.960   8.822  -2.558
  258    HE1  HIS  32           HE1      HIS  32  11.584  12.842  -1.325
  259    H    ILE  33           H        ILE  33   6.939   7.869  -2.747
  260    HA   ILE  33           HA       ILE  33   6.148  10.318  -1.312
  261    HB   ILE  33           HB       ILE  33   5.123   7.461  -1.230
  262   1HG1  ILE  33          1HG1      ILE  33   5.021   8.372  -3.496
  263   2HG1  ILE  33          2HG1      ILE  33   3.396   8.329  -2.809
  264   1HG2  ILE  33          1HG2      ILE  33   4.546   9.211   0.633
  265   2HG2  ILE  33          2HG2      ILE  33   3.530   9.936  -0.615
  266   3HG2  ILE  33          3HG2      ILE  33   3.243   8.273  -0.101
  267   1HD1  ILE  33          1HD1      ILE  33   4.475  10.816  -2.042
  268   2HD1  ILE  33          2HD1      ILE  33   4.913  10.609  -3.737
  269   3HD1  ILE  33          3HD1      ILE  33   3.221  10.529  -3.248
  270    H    GLY  34           H        GLY  34   7.956   7.390  -0.689
  271   1HA   GLY  34          1HA       GLY  34   9.520   7.683   1.314
  272   2HA   GLY  34          2HA       GLY  34   8.061   8.100   2.214
  273    H    GLY  35           H        GLY  35   9.765   5.479   0.600
  274   1HA   GLY  35          1HA       GLY  35   8.152   3.571   2.225
  275   2HA   GLY  35          2HA       GLY  35   8.358   3.271   0.501
  276    H    SER  36           H        SER  36  10.068   3.497   3.576
  277    HA   SER  36           HA       SER  36  12.623   2.627   2.439
  278   1HB   SER  36          1HB       SER  36  13.353   3.378   4.452
  279   2HB   SER  36          2HB       SER  36  11.698   3.912   4.734
  280    HG   SER  36           HG       SER  36  13.099   1.858   5.851
  281    H    TYR  37           H        TYR  37   9.732   1.085   3.466
  282    HA   TYR  37           HA       TYR  37  10.907  -1.569   3.006
  283   1HB   TYR  37          1HB       TYR  37  11.399  -0.818   5.419
  284   2HB   TYR  37          2HB       TYR  37   9.662  -0.966   5.697
  285    HD1  TYR  37           HD1      TYR  37  12.636  -2.859   4.455
  286    HD2  TYR  37           HD2      TYR  37   8.686  -3.069   6.135
  287    HE1  TYR  37           HE1      TYR  37  12.885  -5.310   4.736
  288    HE2  TYR  37           HE2      TYR  37   8.936  -5.520   6.414
  289    HH   TYR  37           HH       TYR  37  12.001  -7.147   5.710
  290    H    GLY  38           H        GLY  38   9.317  -2.271   1.602
  291   1HA   GLY  38          1HA       GLY  38   6.489  -2.002   2.539
  292   2HA   GLY  38          2HA       GLY  38   6.926  -1.741   0.853
  293    H    TYR  39           H        TYR  39   5.279  -3.840   2.435
  294    HA   TYR  39           HA       TYR  39   6.001  -6.093   0.702
  295   1HB   TYR  39          1HB       TYR  39   6.651  -7.590   2.443
  296   2HB   TYR  39          2HB       TYR  39   7.527  -6.100   2.780
  297    HD1  TYR  39           HD1      TYR  39   6.236  -4.362   4.308
  298    HD2  TYR  39           HD2      TYR  39   5.421  -8.574   4.164
  299    HE1  TYR  39           HE1      TYR  39   5.171  -4.231   6.542
  300    HE2  TYR  39           HE2      TYR  39   4.353  -8.446   6.399
  301    HH   TYR  39           HH       TYR  39   4.767  -5.982   8.492
  302    H    CYS  40           H        CYS  40   4.513  -8.088   1.946
  303    HA   CYS  40           HA       CYS  40   1.788  -6.851   1.982
  304   1HB   CYS  40          1HB       CYS  40   2.978  -8.969   0.550
  305   2HB   CYS  40          2HB       CYS  40   1.875  -9.731   1.696
  306    H    TYR  41           H        TYR  41   0.654  -6.929   3.856
  307    HA   TYR  41           HA       TYR  41   1.392  -8.969   5.924
  308   1HB   TYR  41          1HB       TYR  41   2.445  -7.046   6.739
  309   2HB   TYR  41          2HB       TYR  41   1.251  -5.969   6.020
  310    HD1  TYR  41           HD1      TYR  41   0.847  -8.963   8.243
  311    HD2  TYR  41           HD2      TYR  41   0.289  -4.733   7.754
  312    HE1  TYR  41           HE1      TYR  41  -0.379  -8.874  10.398
  313    HE2  TYR  41           HE2      TYR  41  -0.937  -4.643   9.908
  314    HH   TYR  41           HH       TYR  41  -0.777  -6.743  12.199
  315    H    GLY  42           H        GLY  42  -0.444 -10.137   6.376
  316   1HA   GLY  42          1HA       GLY  42  -2.707 -10.572   6.884
  317   2HA   GLY  42          2HA       GLY  42  -2.984  -8.829   6.911
  318    H    PHE  43           H        PHE  43  -1.867 -11.077   4.369
  319    HA   PHE  43           HA       PHE  43  -2.518 -11.187   2.097
  320   1HB   PHE  43          1HB       PHE  43  -4.989 -11.169   3.808
  321   2HB   PHE  43          2HB       PHE  43  -5.158 -11.222   2.055
  322    HD1  PHE  43           HD1      PHE  43  -2.633 -12.833   1.438
  323    HD2  PHE  43           HD2      PHE  43  -5.733 -13.367   4.365
  324    HE1  PHE  43           HE1      PHE  43  -2.178 -15.264   1.474
  325    HE2  PHE  43           HE2      PHE  43  -5.278 -15.804   4.396
  326    HZ   PHE  43           HZ       PHE  43  -3.501 -16.752   2.950
  327    H    GLY  44           H        GLY  44  -1.840  -8.534   3.011
  328   1HA   GLY  44          1HA       GLY  44  -3.282  -6.984   0.964
  329   2HA   GLY  44          2HA       GLY  44  -3.427  -6.380   2.615
  330    H    CYS  45           H        CYS  45  -2.147  -4.860   0.596
  331    HA   CYS  45           HA       CYS  45   0.756  -5.246   0.903
  332   1HB   CYS  45          1HB       CYS  45  -1.134  -3.554  -0.673
  333   2HB   CYS  45          2HB       CYS  45   0.510  -2.950  -0.456
  334    H    TYR  46           H        TYR  46   1.832  -4.411   2.628
  335    HA   TYR  46           HA       TYR  46   0.733  -1.944   3.933
  336   1HB   TYR  46          1HB       TYR  46   0.724  -4.363   5.007
  337   2HB   TYR  46          2HB       TYR  46   2.418  -3.995   5.325
  338    HD1  TYR  46           HD1      TYR  46  -0.774  -2.024   5.388
  339    HD2  TYR  46           HD2      TYR  46   2.761  -3.232   7.509
  340    HE1  TYR  46           HE1      TYR  46  -1.447  -0.613   7.312
  341    HE2  TYR  46           HE2      TYR  46   2.084  -1.821   9.434
  342    HH   TYR  46           HH       TYR  46   0.146  -0.806  10.376
  343    H    CYS  47           H        CYS  47   2.232  -0.296   4.321
  344    HA   CYS  47           HA       CYS  47   5.091  -0.849   3.579
  345   1HB   CYS  47          1HB       CYS  47   3.087   1.000   2.545
  346   2HB   CYS  47          2HB       CYS  47   4.532   1.853   3.088
  347    H    GLU  48           H        GLU  48   6.617   0.729   4.618
  348    HA   GLU  48           HA       GLU  48   5.554   1.821   7.202
  349   1HB   GLU  48          1HB       GLU  48   8.047   0.198   6.609
  350   2HB   GLU  48          2HB       GLU  48   7.771   1.024   8.145
  351   1HG   GLU  48          1HG       GLU  48   5.404  -0.291   7.863
  352   2HG   GLU  48          2HG       GLU  48   6.498  -1.422   7.065
  353    H    GLY  49           H        GLY  49   5.958   3.985   7.304
  354   1HA   GLY  49          1HA       GLY  49   7.878   5.658   7.365
  355   2HA   GLY  49          2HA       GLY  49   8.282   5.057   5.755
  356    H    LEU  50           H        LEU  50   5.081   4.861   5.660
  357    HA   LEU  50           HA       LEU  50   4.556   6.912   3.862
  358   1HB   LEU  50          1HB       LEU  50   2.791   5.646   5.981
  359   2HB   LEU  50          2HB       LEU  50   2.182   6.558   4.605
  360    HG   LEU  50           HG       LEU  50   2.076   4.487   3.655
  361   1HD1  LEU  50          1HD1      LEU  50   5.045   5.014   3.383
  362   2HD1  LEU  50          2HD1      LEU  50   4.121   3.882   2.394
  363   3HD1  LEU  50          3HD1      LEU  50   3.780   5.611   2.308
  364   1HD2  LEU  50          1HD2      LEU  50   3.139   3.657   5.989
  365   2HD2  LEU  50          2HD2      LEU  50   2.877   2.578   4.618
  366   3HD2  LEU  50          3HD2      LEU  50   4.474   3.272   4.902
  367    HA   PRO  51           HA       PRO  51   5.280  10.401   6.696
  368   1HB   PRO  51          1HB       PRO  51   4.380  12.049   4.478
  369   2HB   PRO  51          2HB       PRO  51   6.004  11.913   5.160
  370   1HG   PRO  51          1HG       PRO  51   5.078  10.880   2.664
  371   2HG   PRO  51          2HG       PRO  51   6.676  10.675   3.387
  372   1HD   PRO  51          1HD       PRO  51   4.625   8.681   3.053
  373   2HD   PRO  51          2HD       PRO  51   6.223   8.483   3.817
  374    H    ASP  52           H        ASP  52   3.766  11.934   7.688
  375    HA   ASP  52           HA       ASP  52   1.173  11.072   8.183
  376   1HB   ASP  52          1HB       ASP  52   2.508  13.773   8.131
  377   2HB   ASP  52          2HB       ASP  52   0.829  13.611   8.645
  378    H    SER  53           H        SER  53   2.287  12.986   5.410
  379    HA   SER  53           HA       SER  53  -0.514  13.309   4.462
  380   1HB   SER  53          1HB       SER  53   0.358  15.089   3.239
  381   2HB   SER  53          2HB       SER  53   1.448  15.069   4.618
  382    HG   SER  53           HG       SER  53   2.957  14.775   3.193
  383    H    THR  54           H        THR  54   0.696  10.617   4.359
  384    HA   THR  54           HA       THR  54   1.534  10.177   1.577
  385    HB   THR  54           HB       THR  54   0.741   8.213   3.751
  386    HG1  THR  54           HG1      THR  54   2.389   9.494   4.487
  387   1HG2  THR  54          1HG2      THR  54   1.623   7.932   1.015
  388   2HG2  THR  54          2HG2      THR  54   2.815   7.235   2.111
  389   3HG2  THR  54          3HG2      THR  54   1.143   6.680   2.158
  390    H    GLN  55           H        GLN  55   0.279   9.130  -0.021
  391    HA   GLN  55           HA       GLN  55  -2.626   9.505   0.196
  392   1HB   GLN  55          1HB       GLN  55  -2.538   8.895  -2.184
  393   2HB   GLN  55          2HB       GLN  55  -1.268  10.061  -1.814
  394   1HG   GLN  55          1HG       GLN  55  -0.145   8.423  -3.085
  395   2HG   GLN  55          2HG       GLN  55   0.238   7.976  -1.424
  396   1HE2  GLN  55          2HE2      GLN  55  -0.011   5.775  -1.058
  397   2HE2  GLN  55          1HE2      GLN  55  -1.142   4.775  -1.835
  398    H    THR  56           H        THR  56  -1.033   7.241   1.684
  399    HA   THR  56           HA       THR  56  -1.895   4.749   0.518
  400    HB   THR  56           HB       THR  56  -0.029   5.110   2.155
  401    HG1  THR  56           HG1      THR  56  -0.304   3.108   2.657
  402   1HG2  THR  56          1HG2      THR  56  -2.378   5.674   3.960
  403   2HG2  THR  56          2HG2      THR  56  -0.823   5.140   4.599
  404   3HG2  THR  56          3HG2      THR  56  -0.936   6.657   3.706
  405    H    TRP  57           H        TRP  57  -3.313   3.237   1.913
  406    HA   TRP  57           HA       TRP  57  -6.000   4.362   2.106
  407   1HB   TRP  57          1HB       TRP  57  -5.053   2.016   1.368
  408   2HB   TRP  57          2HB       TRP  57  -5.095   1.661   3.092
  409    HD1  TRP  57           HD1      TRP  57  -7.407   2.600   0.179
  410    HE1  TRP  57           HE1      TRP  57  -9.815   1.905   0.792
  411    HE3  TRP  57           HE3      TRP  57  -6.692   1.108   5.010
  412    HZ2  TRP  57           HZ2      TRP  57 -11.246   0.851   3.033
  413    HZ3  TRP  57           HZ3      TRP  57  -8.592   0.263   6.359
  414    HH2  TRP  57           HH2      TRP  57 -10.866   0.132   5.378
  415    HA   PRO  58           HA       PRO  58  -7.745   4.015   2.933
  416   1HB   PRO  58          1HB       PRO  58  -9.514   5.323   4.637
  417   2HB   PRO  58          2HB       PRO  58  -9.325   3.569   4.520
  418   1HG   PRO  58          1HG       PRO  58  -8.564   5.339   6.709
  419   2HG   PRO  58          2HG       PRO  58  -8.607   3.573   6.676
  420   1HD   PRO  58          1HD       PRO  58  -6.288   5.316   6.503
  421   2HD   PRO  58          2HD       PRO  58  -6.327   3.536   6.565
  422    H    LEU  59           H        LEU  59  -8.967   5.829   1.900
  423    HA   LEU  59           HA       LEU  59  -7.433   8.378   1.992
  424   1HB   LEU  59          1HB       LEU  59  -8.907   6.777   0.063
  425   2HB   LEU  59          2HB       LEU  59  -9.469   8.449   0.045
  426    HG   LEU  59           HG       LEU  59  -7.140   9.229  -0.213
  427   1HD1  LEU  59          1HD1      LEU  59  -6.183   7.187   0.977
  428   2HD1  LEU  59          2HD1      LEU  59  -6.405   6.311  -0.539
  429   3HD1  LEU  59          3HD1      LEU  59  -5.315   7.696  -0.472
  430   1HD2  LEU  59          1HD2      LEU  59  -8.597   8.623  -2.199
  431   2HD2  LEU  59          2HD2      LEU  59  -6.865   8.560  -2.516
  432   3HD2  LEU  59          3HD2      LEU  59  -7.767   7.070  -2.247
  433    HA   PRO  60           HA       PRO  60 -10.460  10.946   3.904
  434   1HB   PRO  60          1HB       PRO  60 -11.395  12.260   1.472
  435   2HB   PRO  60          2HB       PRO  60 -10.428  12.924   2.792
  436   1HG   PRO  60          1HG       PRO  60  -9.519  12.258   0.186
  437   2HG   PRO  60          2HG       PRO  60  -8.531  12.750   1.564
  438   1HD   PRO  60          1HD       PRO  60  -8.682  10.138   0.334
  439   2HD   PRO  60          2HD       PRO  60  -7.676  10.642   1.716
  440    H    ASN  61           H        ASN  61 -12.974  11.788   3.283
  441    HA   ASN  61           HA       ASN  61 -14.658   9.568   3.526
  442   1HB   ASN  61          1HB       ASN  61 -16.415  11.134   3.046
  443   2HB   ASN  61          2HB       ASN  61 -15.123  12.067   3.802
  444   1HD2  ASN  61          2HD2      ASN  61 -16.367  11.141   0.557
  445   2HD2  ASN  61          1HD2      ASN  61 -15.849  12.560  -0.216
  446    H    LYS  62           H        LYS  62 -13.139  10.874   0.683
  447    HA   LYS  62           HA       LYS  62 -14.855   9.438  -1.222
  448   1HB   LYS  62          1HB       LYS  62 -13.389  11.671  -1.359
  449   2HB   LYS  62          2HB       LYS  62 -12.152  10.533  -1.892
  450   1HG   LYS  62          1HG       LYS  62 -13.075  10.555  -3.943
  451   2HG   LYS  62          2HG       LYS  62 -14.526   9.821  -3.259
  452   1HD   LYS  62          1HD       LYS  62 -14.958  12.356  -2.494
  453   2HD   LYS  62          2HD       LYS  62 -13.983  12.673  -3.928
  454   1HE   LYS  62          1HE       LYS  62 -15.699  12.120  -5.304
  455   2HE   LYS  62          2HE       LYS  62 -15.986  10.604  -4.428
  456   1HZ   LYS  62          1HZ       LYS  62 -16.654  12.984  -2.936
  457   2HZ   LYS  62          2HZ       LYS  62 -17.610  12.756  -4.319
  458   3HZ   LYS  62          3HZ       LYS  62 -17.534  11.543  -3.133
  459    H    THR  63           H        THR  63 -14.111   7.455   0.399
  460    HA   THR  63           HA       THR  63 -11.553   6.247  -0.449
  461    HB   THR  63           HB       THR  63 -13.650   4.898   1.219
  462    HG1  THR  63           HG1      THR  63 -12.386   6.293   2.905
  463   1HG2  THR  63          1HG2      THR  63 -10.697   4.932   0.919
  464   2HG2  THR  63          2HG2      THR  63 -11.313   4.716   2.557
  465   3HG2  THR  63          3HG2      THR  63 -11.776   3.587   1.286
  466    H    CYS  64           H        CYS  64 -12.078   3.601  -0.620
  467    HA   CYS  64           HA       CYS  64 -13.611   3.386  -3.151
  468   1HB   CYS  64          1HB       CYS  64 -11.289   2.517  -2.901
  469   2HB   CYS  64          2HB       CYS  64 -11.854   1.423  -1.638
  Start of MODEL   25
    1   1H    LYS   1          1H        LYS   1   4.852   7.874   7.640
    2   2H    LYS   1          2H        LYS   1   3.396   8.674   7.296
    3   3H    LYS   1          3H        LYS   1   4.381   9.214   8.572
    4    HA   LYS   1           HA       LYS   1   3.841   7.421   9.939
    5   1HB   LYS   1          1HB       LYS   1   1.495   7.731  10.095
    6   2HB   LYS   1          2HB       LYS   1   2.059   9.186   9.276
    7   1HG   LYS   1          1HG       LYS   1   1.607   7.307   7.226
    8   2HG   LYS   1          2HG       LYS   1   0.232   7.152   8.319
    9   1HD   LYS   1          1HD       LYS   1  -0.536   9.257   7.867
   10   2HD   LYS   1          2HD       LYS   1   1.089   9.924   7.705
   11   1HE   LYS   1          1HE       LYS   1   1.220   8.529   5.511
   12   2HE   LYS   1          2HE       LYS   1  -0.549   8.451   5.640
   13   1HZ   LYS   1          1HZ       LYS   1  -0.374  10.947   6.104
   14   2HZ   LYS   1          2HZ       LYS   1   1.181  10.838   5.427
   15   3HZ   LYS   1          3HZ       LYS   1  -0.184  10.429   4.500
   16    H    ASP   2           H        ASP   2   1.721   5.596   9.629
   17    HA   ASP   2           HA       ASP   2   2.819   3.705   7.571
   18   1HB   ASP   2          1HB       ASP   2   1.424   3.001  10.166
   19   2HB   ASP   2          2HB       ASP   2   2.447   1.964   9.171
   20    H    GLY   3           H        GLY   3   1.302   2.865   6.139
   21   1HA   GLY   3          1HA       GLY   3  -1.549   2.839   6.840
   22   2HA   GLY   3          2HA       GLY   3  -1.124   3.967   5.553
   23    H    TYR   4           H        TYR   4  -2.818   2.046   4.794
   24    HA   TYR   4           HA       TYR   4  -1.235  -0.184   3.610
   25   1HB   TYR   4          1HB       TYR   4  -4.128   0.388   4.203
   26   2HB   TYR   4          2HB       TYR   4  -3.704  -0.862   3.033
   27    HD1  TYR   4           HD1      TYR   4  -2.416  -2.848   3.714
   28    HD2  TYR   4           HD2      TYR   4  -3.634   0.125   6.566
   29    HE1  TYR   4           HE1      TYR   4  -1.911  -4.419   5.566
   30    HE2  TYR   4           HE2      TYR   4  -3.131  -1.446   8.418
   31    HH   TYR   4           HH       TYR   4  -2.958  -4.505   8.236
   32    H    LEU   5           H        LEU   5  -0.545   0.091   1.537
   33    HA   LEU   5           HA       LEU   5  -1.132   2.276  -0.147
   34   1HB   LEU   5          1HB       LEU   5   0.243  -0.263  -0.209
   35   2HB   LEU   5          2HB       LEU   5  -0.566   0.015  -1.751
   36    HG   LEU   5           HG       LEU   5   1.063   2.185  -0.438
   37   1HD1  LEU   5          1HD1      LEU   5   2.316  -0.071  -0.845
   38   2HD1  LEU   5          2HD1      LEU   5   2.177   0.355  -2.551
   39   3HD1  LEU   5          3HD1      LEU   5   3.038   1.422  -1.442
   40   1HD2  LEU   5          1HD2      LEU   5   0.064   1.564  -3.225
   41   2HD2  LEU   5          2HD2      LEU   5  -0.290   2.979  -2.235
   42   3HD2  LEU   5          3HD2      LEU   5   1.318   2.768  -2.926
   43    H    VAL   6           H        VAL   6  -2.565   2.505  -1.935
   44    HA   VAL   6           HA       VAL   6  -4.905   0.629  -1.911
   45    HB   VAL   6           HB       VAL   6  -6.196   2.575  -2.601
   46   1HG1  VAL   6          1HG1      VAL   6  -4.633   2.462  -0.183
   47   2HG1  VAL   6          2HG1      VAL   6  -4.872   4.145  -0.651
   48   3HG1  VAL   6          3HG1      VAL   6  -6.265   3.090  -0.413
   49   1HG2  VAL   6          1HG2      VAL   6  -4.300   3.486  -4.039
   50   2HG2  VAL   6          2HG2      VAL   6  -5.193   4.695  -3.116
   51   3HG2  VAL   6          3HG2      VAL   6  -3.610   4.152  -2.558
   52    H    GLU   7           H        GLU   7  -6.065   1.258  -4.287
   53    HA   GLU   7           HA       GLU   7  -3.949   0.630  -6.324
   54   1HB   GLU   7          1HB       GLU   7  -6.475  -0.638  -5.516
   55   2HB   GLU   7          2HB       GLU   7  -6.345  -0.398  -7.258
   56   1HG   GLU   7          1HG       GLU   7  -4.161  -1.662  -5.585
   57   2HG   GLU   7          2HG       GLU   7  -5.398  -2.593  -6.430
   58    H    LYS   8           H        LYS   8  -4.639   1.293  -8.589
   59    HA   LYS   8           HA       LYS   8  -5.175   3.989  -8.917
   60   1HB   LYS   8          1HB       LYS   8  -5.708   3.409 -11.198
   61   2HB   LYS   8          2HB       LYS   8  -4.541   2.214 -10.631
   62   1HG   LYS   8          1HG       LYS   8  -6.381   0.651 -10.121
   63   2HG   LYS   8          2HG       LYS   8  -7.551   1.844 -10.686
   64   1HD   LYS   8          1HD       LYS   8  -6.545   1.792 -12.931
   65   2HD   LYS   8          2HD       LYS   8  -5.348   0.620 -12.375
   66   1HE   LYS   8          1HE       LYS   8  -6.878  -0.907 -13.160
   67   2HE   LYS   8          2HE       LYS   8  -7.673  -0.609 -11.601
   68   1HZ   LYS   8          1HZ       LYS   8  -8.818   1.296 -12.671
   69   2HZ   LYS   8          2HZ       LYS   8  -8.186   0.801 -14.165
   70   3HZ   LYS   8          3HZ       LYS   8  -9.262  -0.210 -13.323
   71    H    THR   9           H        THR   9  -7.520   1.384  -8.428
   72    HA   THR   9           HA       THR   9  -9.837   3.162  -8.792
   73    HB   THR   9           HB       THR   9 -11.002   1.011  -8.049
   74    HG1  THR   9           HG1      THR   9  -9.784  -0.697  -7.595
   75   1HG2  THR   9          1HG2      THR   9 -10.094   1.742 -10.466
   76   2HG2  THR   9          2HG2      THR   9  -9.137   0.277 -10.250
   77   3HG2  THR   9          3HG2      THR   9 -10.898   0.196 -10.193
   78    H    GLY  10           H        GLY  10  -7.896   1.838  -6.182
   79   1HA   GLY  10          1HA       GLY  10  -7.914   3.279  -4.095
   80   2HA   GLY  10          2HA       GLY  10  -9.674   3.223  -4.213
   81    H    CYS  11           H        CYS  11  -9.412   0.341  -5.174
   82    HA   CYS  11           HA       CYS  11  -9.927  -0.980  -2.714
   83   1HB   CYS  11          1HB       CYS  11  -9.238  -1.741  -5.529
   84   2HB   CYS  11          2HB       CYS  11  -9.254  -3.007  -4.301
   85    H    LYS  12           H        LYS  12  -8.593  -2.521  -1.547
   86    HA   LYS  12           HA       LYS  12  -5.856  -1.683  -1.135
   87   1HB   LYS  12          1HB       LYS  12  -7.857  -3.301   0.078
   88   2HB   LYS  12          2HB       LYS  12  -6.425  -4.306  -0.116
   89   1HG   LYS  12          1HG       LYS  12  -5.123  -2.960   1.257
   90   2HG   LYS  12          2HG       LYS  12  -6.096  -1.522   0.941
   91   1HD   LYS  12          1HD       LYS  12  -7.885  -2.328   2.332
   92   2HD   LYS  12          2HD       LYS  12  -7.126  -3.913   2.484
   93   1HE   LYS  12          1HE       LYS  12  -5.252  -1.875   3.313
   94   2HE   LYS  12          2HE       LYS  12  -6.773  -1.702   4.212
   95   1HZ   LYS  12          1HZ       LYS  12  -5.822  -4.416   3.744
   96   2HZ   LYS  12          2HZ       LYS  12  -4.942  -3.495   4.868
   97   3HZ   LYS  12          3HZ       LYS  12  -6.603  -3.762   5.098
   98    H    LYS  13           H        LYS  13  -4.513  -4.086  -0.843
   99    HA   LYS  13           HA       LYS  13  -4.523  -5.440  -3.492
  100   1HB   LYS  13          1HB       LYS  13  -3.029  -3.290  -3.303
  101   2HB   LYS  13          2HB       LYS  13  -1.964  -4.328  -2.354
  102   1HG   LYS  13          1HG       LYS  13  -1.095  -4.965  -4.346
  103   2HG   LYS  13          2HG       LYS  13  -2.566  -5.920  -4.527
  104   1HD   LYS  13          1HD       LYS  13  -3.135  -3.199  -5.248
  105   2HD   LYS  13          2HD       LYS  13  -1.707  -3.738  -6.132
  106   1HE   LYS  13          1HE       LYS  13  -3.962  -5.679  -5.988
  107   2HE   LYS  13          2HE       LYS  13  -4.203  -4.251  -7.015
  108   1HZ   LYS  13          1HZ       LYS  13  -1.853  -4.717  -7.831
  109   2HZ   LYS  13          2HZ       LYS  13  -2.036  -6.261  -7.145
  110   3HZ   LYS  13          3HZ       LYS  13  -3.079  -5.757  -8.383
  111    H    THR  14           H        THR  14  -5.349  -6.639  -1.187
  112    HA   THR  14           HA       THR  14  -3.646  -7.806   0.644
  113    HB   THR  14           HB       THR  14  -5.938  -8.959  -0.959
  114    HG1  THR  14           HG1      THR  14  -6.298  -7.159   0.451
  115   1HG2  THR  14          1HG2      THR  14  -4.528 -10.067   1.480
  116   2HG2  THR  14          2HG2      THR  14  -6.098 -10.632   0.906
  117   3HG2  THR  14          3HG2      THR  14  -4.665 -10.833  -0.102
  118    H    CYS  15           H        CYS  15  -2.703 -10.047   0.661
  119    HA   CYS  15           HA       CYS  15  -1.846 -11.103  -1.977
  120   1HB   CYS  15          1HB       CYS  15   0.478 -10.797  -1.506
  121   2HB   CYS  15          2HB       CYS  15  -0.282  -9.260  -1.099
  122    H    TYR  16           H        TYR  16  -1.254 -13.336  -1.838
  123    HA   TYR  16           HA       TYR  16  -2.230 -14.721   0.569
  124   1HB   TYR  16          1HB       TYR  16  -1.327 -15.421  -2.209
  125   2HB   TYR  16          2HB       TYR  16  -1.458 -16.698  -0.999
  126    HD1  TYR  16           HD1      TYR  16  -3.369 -13.890  -2.564
  127    HD2  TYR  16           HD2      TYR  16  -3.552 -17.630  -0.456
  128    HE1  TYR  16           HE1      TYR  16  -5.826 -13.955  -2.892
  129    HE2  TYR  16           HE2      TYR  16  -6.009 -17.695  -0.787
  130    HH   TYR  16           HH       TYR  16  -7.816 -16.444  -1.376
  131    H    LYS  17           H        LYS  17   0.834 -13.704  -0.700
  132    HA   LYS  17           HA       LYS  17   2.289 -15.645   1.045
  133   1HB   LYS  17          1HB       LYS  17   2.632 -14.833  -1.561
  134   2HB   LYS  17          2HB       LYS  17   3.787 -13.807  -0.709
  135   1HG   LYS  17          1HG       LYS  17   4.053 -16.371   0.437
  136   2HG   LYS  17          2HG       LYS  17   3.969 -16.630  -1.306
  137   1HD   LYS  17          1HD       LYS  17   5.633 -14.335  -0.703
  138   2HD   LYS  17          2HD       LYS  17   6.209 -15.763   0.160
  139   1HE   LYS  17          1HE       LYS  17   5.739 -16.893  -2.245
  140   2HE   LYS  17          2HE       LYS  17   6.116 -15.241  -2.771
  141   1HZ   LYS  17          1HZ       LYS  17   7.994 -15.462  -1.009
  142   2HZ   LYS  17          2HZ       LYS  17   7.784 -17.131  -1.252
  143   3HZ   LYS  17          3HZ       LYS  17   8.213 -16.127  -2.554
  144    H    LEU  18           H        LEU  18   2.169 -14.659   3.104
  145    HA   LEU  18           HA       LEU  18   2.531 -11.825   3.557
  146   1HB   LEU  18          1HB       LEU  18   2.460 -14.363   5.169
  147   2HB   LEU  18          2HB       LEU  18   2.947 -12.858   5.950
  148    HG   LEU  18           HG       LEU  18   0.364 -13.299   4.425
  149   1HD1  LEU  18          1HD1      LEU  18   0.851 -14.262   6.866
  150   2HD1  LEU  18          2HD1      LEU  18   0.500 -12.596   7.326
  151   3HD1  LEU  18          3HD1      LEU  18  -0.707 -13.544   6.456
  152   1HD2  LEU  18          1HD2      LEU  18   1.827 -10.926   5.063
  153   2HD2  LEU  18          2HD2      LEU  18   0.234 -11.054   4.319
  154   3HD2  LEU  18          3HD2      LEU  18   0.383 -10.964   6.074
  155    H    GLY  19           H        GLY  19   4.412 -10.930   4.799
  156   1HA   GLY  19          1HA       GLY  19   6.739 -11.025   5.479
  157   2HA   GLY  19          2HA       GLY  19   6.941 -12.452   4.463
  158    H    GLU  20           H        GLU  20   8.849 -11.158   3.700
  159    HA   GLU  20           HA       GLU  20   8.746  -8.726   2.292
  160   1HB   GLU  20          1HB       GLU  20  10.582 -10.677   2.855
  161   2HB   GLU  20          2HB       GLU  20  10.391 -10.884   1.113
  162   1HG   GLU  20          1HG       GLU  20  10.515  -8.123   1.434
  163   2HG   GLU  20          2HG       GLU  20  11.702  -8.730   2.588
  164    H    ASN  21           H        ASN  21   6.683  -8.696   1.157
  165    HA   ASN  21           HA       ASN  21   6.326 -10.620  -1.072
  166   1HB   ASN  21          1HB       ASN  21   4.539  -9.832   0.595
  167   2HB   ASN  21          2HB       ASN  21   4.575  -8.290  -0.260
  168   1HD2  ASN  21          2HD2      ASN  21   2.758 -10.999  -0.149
  169   2HD2  ASN  21          1HD2      ASN  21   2.288 -11.127  -1.775
  170    H    ASP  22           H        ASP  22   7.943  -9.939  -2.546
  171    HA   ASP  22           HA       ASP  22   8.866  -7.521  -3.387
  172   1HB   ASP  22          1HB       ASP  22   8.501 -10.130  -4.457
  173   2HB   ASP  22          2HB       ASP  22   8.031  -8.991  -5.719
  174    H    PHE  23           H        PHE  23   5.681  -8.852  -4.324
  175    HA   PHE  23           HA       PHE  23   4.821  -6.877  -6.116
  176   1HB   PHE  23          1HB       PHE  23   3.767  -9.084  -5.031
  177   2HB   PHE  23          2HB       PHE  23   2.935  -7.894  -4.029
  178    HD1  PHE  23           HD1      PHE  23   1.429  -6.223  -5.036
  179    HD2  PHE  23           HD2      PHE  23   3.322  -9.258  -7.413
  180    HE1  PHE  23           HE1      PHE  23  -0.141  -5.745  -6.896
  181    HE2  PHE  23           HE2      PHE  23   1.753  -8.782  -9.272
  182    HZ   PHE  23           HZ       PHE  23   0.021  -7.025  -9.014
  183    H    CYS  24           H        CYS  24   4.036  -6.878  -2.602
  184    HA   CYS  24           HA       CYS  24   2.957  -4.296  -2.429
  185   1HB   CYS  24          1HB       CYS  24   4.725  -5.795  -0.465
  186   2HB   CYS  24          2HB       CYS  24   3.648  -4.465  -0.048
  187    H    ASN  25           H        ASN  25   6.385  -5.274  -2.337
  188    HA   ASN  25           HA       ASN  25   7.502  -2.723  -1.698
  189   1HB   ASN  25          1HB       ASN  25   8.315  -5.357  -2.571
  190   2HB   ASN  25          2HB       ASN  25   9.235  -4.130  -3.442
  191   1HD2  ASN  25          2HD2      ASN  25   9.126  -5.868  -0.532
  192   2HD2  ASN  25          1HD2      ASN  25  10.147  -4.875   0.390
  193    H    ARG  26           H        ARG  26   6.892  -4.273  -4.865
  194    HA   ARG  26           HA       ARG  26   7.879  -2.234  -6.550
  195   1HB   ARG  26          1HB       ARG  26   5.813  -4.396  -6.676
  196   2HB   ARG  26          2HB       ARG  26   5.860  -3.226  -7.995
  197   1HG   ARG  26          1HG       ARG  26   8.489  -3.750  -7.827
  198   2HG   ARG  26          2HG       ARG  26   7.868  -5.284  -7.216
  199   1HD   ARG  26          1HD       ARG  26   6.638  -4.138  -9.705
  200   2HD   ARG  26          2HD       ARG  26   8.206  -4.961  -9.821
  201    HE   ARG  26           HE       ARG  26   6.642  -6.631  -8.223
  202   1HH1  ARG  26          1HH1      ARG  26   6.423  -5.211 -11.365
  203   2HH1  ARG  26          2HH1      ARG  26   5.503  -6.518 -12.031
  204   1HH2  ARG  26          1HH2      ARG  26   5.437  -8.334  -9.080
  205   2HH2  ARG  26          2HH2      ARG  26   4.941  -8.281 -10.738
  206    H    GLU  27           H        GLU  27   4.805  -2.459  -4.804
  207    HA   GLU  27           HA       GLU  27   3.580  -0.190  -6.172
  208   1HB   GLU  27          1HB       GLU  27   2.928  -1.595  -3.561
  209   2HB   GLU  27          2HB       GLU  27   1.831  -0.579  -4.494
  210   1HG   GLU  27          1HG       GLU  27   3.135  -3.056  -5.638
  211   2HG   GLU  27          2HG       GLU  27   1.557  -3.083  -4.849
  212    H    CYS  28           H        CYS  28   5.109  -0.702  -2.980
  213    HA   CYS  28           HA       CYS  28   4.700   1.989  -2.031
  214   1HB   CYS  28          1HB       CYS  28   5.423  -0.385  -0.965
  215   2HB   CYS  28          2HB       CYS  28   7.014   0.364  -1.104
  216    H    LYS  29           H        LYS  29   7.098   0.547  -4.133
  217    HA   LYS  29           HA       LYS  29   9.063   2.692  -3.753
  218   1HB   LYS  29          1HB       LYS  29   9.755   0.424  -4.290
  219   2HB   LYS  29          2HB       LYS  29   8.752   0.425  -5.742
  220   1HG   LYS  29          1HG       LYS  29  10.232   1.699  -6.929
  221   2HG   LYS  29          2HG       LYS  29  10.695   2.653  -5.520
  222   1HD   LYS  29          1HD       LYS  29  12.565   1.420  -5.336
  223   2HD   LYS  29          2HD       LYS  29  11.566   0.001  -5.022
  224   1HE   LYS  29          1HE       LYS  29  12.988  -0.475  -6.950
  225   2HE   LYS  29          2HE       LYS  29  11.325  -0.273  -7.535
  226   1HZ   LYS  29          1HZ       LYS  29  12.092   2.240  -7.553
  227   2HZ   LYS  29          2HZ       LYS  29  13.615   1.526  -7.792
  228   3HZ   LYS  29          3HZ       LYS  29  12.350   1.221  -8.885
  229    H    TRP  30           H        TRP  30   6.105   2.778  -5.147
  230    HA   TRP  30           HA       TRP  30   6.265   3.706  -7.759
  231   1HB   TRP  30          1HB       TRP  30   4.513   3.894  -5.500
  232   2HB   TRP  30          2HB       TRP  30   4.588   5.480  -6.268
  233    HD1  TRP  30           HD1      TRP  30   2.370   2.827  -6.386
  234    HE1  TRP  30           HE1      TRP  30   1.373   2.385  -8.721
  235    HE3  TRP  30           HE3      TRP  30   5.732   5.364  -9.276
  236    HZ2  TRP  30           HZ2      TRP  30   1.929   3.020 -11.453
  237    HZ3  TRP  30           HZ3      TRP  30   5.474   5.429 -11.740
  238    HH2  TRP  30           HH2      TRP  30   3.579   4.261 -12.831
  239    H    LYS  31           H        LYS  31   8.223   4.849  -8.200
  240    HA   LYS  31           HA       LYS  31   9.670   6.721  -8.270
  241   1HB   LYS  31          1HB       LYS  31   6.957   7.439  -8.534
  242   2HB   LYS  31          2HB       LYS  31   7.657   8.645  -7.453
  243   1HG   LYS  31          1HG       LYS  31   9.613   8.377  -9.379
  244   2HG   LYS  31          2HG       LYS  31   8.130   8.205 -10.318
  245   1HD   LYS  31          1HD       LYS  31   7.645  10.316  -8.516
  246   2HD   LYS  31          2HD       LYS  31   9.268  10.591  -9.151
  247   1HE   LYS  31          1HE       LYS  31   8.006  11.616 -10.823
  248   2HE   LYS  31          2HE       LYS  31   8.063   9.963 -11.464
  249   1HZ   LYS  31          1HZ       LYS  31   6.027  10.167  -9.513
  250   2HZ   LYS  31          2HZ       LYS  31   5.804  11.381 -10.681
  251   3HZ   LYS  31          3HZ       LYS  31   5.887   9.752 -11.152
  252    H    HIS  32           H        HIS  32  10.187   8.849  -6.856
  253    HA   HIS  32           HA       HIS  32  10.809   7.890  -4.169
  254   1HB   HIS  32          1HB       HIS  32  11.610   9.929  -6.042
  255   2HB   HIS  32          2HB       HIS  32  11.319  10.666  -4.467
  256    HD1  HIS  32           HD1      HIS  32  12.796   9.868  -2.474
  257    HD2  HIS  32           HD2      HIS  32  13.800   8.121  -6.124
  258    HE1  HIS  32           HE1      HIS  32  15.046   8.754  -2.141
  259    H    ILE  33           H        ILE  33   8.715   7.672  -3.138
  260    HA   ILE  33           HA       ILE  33   7.060  10.127  -2.879
  261    HB   ILE  33           HB       ILE  33   6.763   7.185  -2.277
  262   1HG1  ILE  33          1HG1      ILE  33   6.295   7.932  -4.558
  263   2HG1  ILE  33          2HG1      ILE  33   4.782   7.492  -3.766
  264   1HG2  ILE  33          1HG2      ILE  33   5.436   9.446  -0.950
  265   2HG2  ILE  33          2HG2      ILE  33   4.310   8.302  -1.680
  266   3HG2  ILE  33          3HG2      ILE  33   5.486   7.745  -0.490
  267   1HD1  ILE  33          1HD1      ILE  33   4.732  10.036  -3.090
  268   2HD1  ILE  33          2HD1      ILE  33   5.835  10.218  -4.455
  269   3HD1  ILE  33          3HD1      ILE  33   4.222   9.551  -4.708
  270    H    GLY  34           H        GLY  34   8.914   7.831  -0.882
  271   1HA   GLY  34          1HA       GLY  34  10.196   9.007   0.987
  272   2HA   GLY  34          2HA       GLY  34   8.648   9.747   1.397
  273    H    GLY  35           H        GLY  35   8.949   6.411   0.328
  274   1HA   GLY  35          1HA       GLY  35   7.892   5.567   2.980
  275   2HA   GLY  35          2HA       GLY  35   7.772   4.626   1.492
  276    H    SER  36           H        SER  36   9.345   4.722   4.383
  277    HA   SER  36           HA       SER  36  12.011   3.883   3.454
  278   1HB   SER  36          1HB       SER  36  11.595   3.370   6.218
  279   2HB   SER  36          2HB       SER  36  12.463   4.721   5.497
  280    HG   SER  36           HG       SER  36  10.846   5.954   6.001
  281    H    TYR  37           H        TYR  37   9.048   2.328   3.683
  282    HA   TYR  37           HA       TYR  37  10.281  -0.311   3.457
  283   1HB   TYR  37          1HB       TYR  37   9.942   0.655   6.003
  284   2HB   TYR  37          2HB       TYR  37   8.430  -0.221   5.759
  285    HD1  TYR  37           HD1      TYR  37  11.895  -0.870   4.483
  286    HD2  TYR  37           HD2      TYR  37   8.615  -2.276   6.876
  287    HE1  TYR  37           HE1      TYR  37  13.083  -3.016   4.849
  288    HE2  TYR  37           HE2      TYR  37   9.803  -4.423   7.243
  289    HH   TYR  37           HH       TYR  37  12.368  -5.438   5.413
  290    H    GLY  38           H        GLY  38   8.705  -1.923   2.831
  291   1HA   GLY  38          1HA       GLY  38   5.867  -1.280   2.743
  292   2HA   GLY  38          2HA       GLY  38   6.633  -1.168   1.158
  293    H    TYR  39           H        TYR  39   5.629  -3.345   3.697
  294    HA   TYR  39           HA       TYR  39   6.156  -5.641   1.848
  295   1HB   TYR  39          1HB       TYR  39   7.136  -6.868   3.602
  296   2HB   TYR  39          2HB       TYR  39   7.753  -5.242   3.880
  297    HD1  TYR  39           HD1      TYR  39   6.163  -3.713   5.412
  298    HD2  TYR  39           HD2      TYR  39   6.199  -8.009   5.393
  299    HE1  TYR  39           HE1      TYR  39   5.148  -3.731   7.674
  300    HE2  TYR  39           HE2      TYR  39   5.191  -8.026   7.659
  301    HH   TYR  39           HH       TYR  39   3.667  -5.503   9.010
  302    H    CYS  40           H        CYS  40   4.687  -7.519   2.314
  303    HA   CYS  40           HA       CYS  40   1.961  -6.613   2.762
  304   1HB   CYS  40          1HB       CYS  40   3.208  -8.624   1.383
  305   2HB   CYS  40          2HB       CYS  40   2.544  -9.505   2.759
  306    H    TYR  41           H        TYR  41   0.926  -6.513   4.676
  307    HA   TYR  41           HA       TYR  41   1.869  -8.249   6.933
  308   1HB   TYR  41          1HB       TYR  41   2.642  -6.152   7.582
  309   2HB   TYR  41          2HB       TYR  41   1.391  -5.302   6.680
  310    HD1  TYR  41           HD1      TYR  41   0.972  -8.081   9.145
  311    HD2  TYR  41           HD2      TYR  41   0.395  -3.906   8.313
  312    HE1  TYR  41           HE1      TYR  41  -0.376  -7.854  11.215
  313    HE2  TYR  41           HE2      TYR  41  -0.952  -3.680  10.382
  314    HH   TYR  41           HH       TYR  41  -2.390  -5.360  11.830
  315    H    GLY  42           H        GLY  42   0.201  -9.527   7.660
  316   1HA   GLY  42          1HA       GLY  42  -1.981 -10.322   8.006
  317   2HA   GLY  42          2HA       GLY  42  -2.428  -8.628   8.215
  318    H    PHE  43           H        PHE  43  -1.379 -10.665   5.460
  319    HA   PHE  43           HA       PHE  43  -2.242 -10.782   3.261
  320   1HB   PHE  43          1HB       PHE  43  -4.702 -10.362   4.985
  321   2HB   PHE  43          2HB       PHE  43  -4.767 -10.865   3.296
  322    HD1  PHE  43           HD1      PHE  43  -2.992 -11.790   6.477
  323    HD2  PHE  43           HD2      PHE  43  -4.839 -13.145   2.843
  324    HE1  PHE  43           HE1      PHE  43  -2.613 -14.144   7.162
  325    HE2  PHE  43           HE2      PHE  43  -4.459 -15.498   3.527
  326    HZ   PHE  43           HZ       PHE  43  -3.346 -15.998   5.686
  327    H    GLY  44           H        GLY  44  -1.119  -8.350   3.457
  328   1HA   GLY  44          1HA       GLY  44  -2.556  -6.700   1.665
  329   2HA   GLY  44          2HA       GLY  44  -2.879  -6.093   3.289
  330    H    CYS  45           H        CYS  45  -1.168  -5.144   0.875
  331    HA   CYS  45           HA       CYS  45   1.581  -5.122   1.768
  332   1HB   CYS  45          1HB       CYS  45   0.022  -3.294  -0.085
  333   2HB   CYS  45          2HB       CYS  45   1.778  -3.426  -0.019
  334    H    TYR  46           H        TYR  46   2.328  -3.986   3.514
  335    HA   TYR  46           HA       TYR  46   0.818  -1.545   4.378
  336   1HB   TYR  46          1HB       TYR  46   1.076  -3.646   5.847
  337   2HB   TYR  46          2HB       TYR  46   2.776  -3.198   5.987
  338    HD1  TYR  46           HD1      TYR  46  -0.575  -1.508   6.157
  339    HD2  TYR  46           HD2      TYR  46   3.352  -1.930   7.844
  340    HE1  TYR  46           HE1      TYR  46  -1.154   0.142   7.915
  341    HE2  TYR  46           HE2      TYR  46   2.775  -0.279   9.602
  342    HH   TYR  46           HH       TYR  46  -0.032   1.674   9.432
  343    H    CYS  47           H        CYS  47   1.875   0.376   4.056
  344    HA   CYS  47           HA       CYS  47   4.816   0.288   3.516
  345   1HB   CYS  47          1HB       CYS  47   2.505   2.040   2.720
  346   2HB   CYS  47          2HB       CYS  47   4.148   2.676   2.637
  347    H    GLU  48           H        GLU  48   6.157   1.946   4.480
  348    HA   GLU  48           HA       GLU  48   4.980   3.327   6.863
  349   1HB   GLU  48          1HB       GLU  48   6.850   1.127   6.715
  350   2HB   GLU  48          2HB       GLU  48   7.632   2.525   7.453
  351   1HG   GLU  48          1HG       GLU  48   5.918   2.703   9.130
  352   2HG   GLU  48          2HG       GLU  48   4.910   1.513   8.306
  353    H    GLY  49           H        GLY  49   5.492   5.483   6.778
  354   1HA   GLY  49          1HA       GLY  49   7.335   7.168   6.687
  355   2HA   GLY  49          2HA       GLY  49   7.978   6.271   5.311
  356    H    LEU  50           H        LEU  50   4.842   6.007   4.729
  357    HA   LEU  50           HA       LEU  50   4.681   7.738   2.529
  358   1HB   LEU  50          1HB       LEU  50   2.397   6.968   4.366
  359   2HB   LEU  50          2HB       LEU  50   2.316   7.263   2.630
  360    HG   LEU  50           HG       LEU  50   4.306   5.277   3.045
  361   1HD1  LEU  50          1HD1      LEU  50   3.239   4.902   5.250
  362   2HD1  LEU  50          2HD1      LEU  50   1.686   4.669   4.449
  363   3HD1  LEU  50          3HD1      LEU  50   3.000   3.525   4.174
  364   1HD2  LEU  50          1HD2      LEU  50   2.405   5.797   1.225
  365   2HD2  LEU  50          2HD2      LEU  50   3.105   4.188   1.399
  366   3HD2  LEU  50          3HD2      LEU  50   1.550   4.558   2.144
  367    HA   PRO  51           HA       PRO  51   4.753  11.613   4.893
  368   1HB   PRO  51          1HB       PRO  51   4.356  12.956   2.368
  369   2HB   PRO  51          2HB       PRO  51   5.823  12.884   3.350
  370   1HG   PRO  51          1HG       PRO  51   5.314  11.557   0.861
  371   2HG   PRO  51          2HG       PRO  51   6.768  11.465   1.861
  372   1HD   PRO  51          1HD       PRO  51   4.780   9.419   1.446
  373   2HD   PRO  51          2HD       PRO  51   6.231   9.337   2.475
  374    H    ASP  52           H        ASP  52   3.160  13.584   4.772
  375    HA   ASP  52           HA       ASP  52   0.449  12.578   4.944
  376   1HB   ASP  52          1HB       ASP  52   1.096  14.321   6.412
  377   2HB   ASP  52          2HB       ASP  52   1.830  15.257   5.111
  378    H    SER  53           H        SER  53   2.297  13.340   2.266
  379    HA   SER  53           HA       SER  53   0.123  14.626   0.715
  380   1HB   SER  53          1HB       SER  53   2.875  14.790   0.761
  381   2HB   SER  53          2HB       SER  53   2.590  13.761  -0.639
  382    HG   SER  53           HG       SER  53   1.669  15.382  -1.647
  383    H    THR  54           H        THR  54   1.161  11.445   1.423
  384    HA   THR  54           HA       THR  54   0.199  10.372  -1.186
  385    HB   THR  54           HB       THR  54   1.105   8.548   0.955
  386    HG1  THR  54           HG1      THR  54   2.707  10.642  -0.060
  387   1HG2  THR  54          1HG2      THR  54   0.765   8.260  -1.654
  388   2HG2  THR  54          2HG2      THR  54   2.404   8.907  -1.718
  389   3HG2  THR  54          3HG2      THR  54   2.076   7.423  -0.824
  390    H    GLN  55           H        GLN  55  -1.577   8.922  -1.280
  391    HA   GLN  55           HA       GLN  55  -3.453   9.111   1.028
  392   1HB   GLN  55          1HB       GLN  55  -4.023   9.801  -1.351
  393   2HB   GLN  55          2HB       GLN  55  -3.912   8.097  -1.791
  394   1HG   GLN  55          1HG       GLN  55  -6.211   8.420  -1.339
  395   2HG   GLN  55          2HG       GLN  55  -5.584   7.688   0.138
  396   1HE2  GLN  55          2HE2      GLN  55  -6.187   8.779   2.014
  397   2HE2  GLN  55          1HE2      GLN  55  -6.581  10.428   2.101
  398    H    THR  56           H        THR  56  -4.127   7.262   2.128
  399    HA   THR  56           HA       THR  56  -2.939   4.655   1.238
  400    HB   THR  56           HB       THR  56  -3.205   4.283   3.835
  401    HG1  THR  56           HG1      THR  56  -3.372   6.086   4.989
  402   1HG2  THR  56          1HG2      THR  56  -1.143   5.961   2.418
  403   2HG2  THR  56          2HG2      THR  56  -0.978   5.571   4.130
  404   3HG2  THR  56          3HG2      THR  56  -1.025   4.278   2.931
  405    H    TRP  57           H        TRP  57  -4.276   2.833   2.591
  406    HA   TRP  57           HA       TRP  57  -7.103   3.191   1.740
  407   1HB   TRP  57          1HB       TRP  57  -5.417   1.232   1.206
  408   2HB   TRP  57          2HB       TRP  57  -5.880   0.660   2.809
  409    HD1  TRP  57           HD1      TRP  57  -7.171   1.066  -0.715
  410    HE1  TRP  57           HE1      TRP  57  -9.499  -0.022  -0.910
  411    HE3  TRP  57           HE3      TRP  57  -8.109   0.089   4.212
  412    HZ2  TRP  57           HZ2      TRP  57 -11.498  -1.152   0.793
  413    HZ3  TRP  57           HZ3      TRP  57 -10.232  -0.992   4.895
  414    HH2  TRP  57           HH2      TRP  57 -11.926  -1.613   3.194
  415    HA   PRO  58           HA       PRO  58  -8.939   2.398   2.015
  416   1HB   PRO  58          1HB       PRO  58 -11.185   3.659   3.174
  417   2HB   PRO  58          2HB       PRO  58 -10.938   1.919   2.994
  418   1HG   PRO  58          1HG       PRO  58 -10.924   3.490   5.424
  419   2HG   PRO  58          2HG       PRO  58 -10.804   1.736   5.248
  420   1HD   PRO  58          1HD       PRO  58  -8.696   3.617   5.909
  421   2HD   PRO  58          2HD       PRO  58  -8.594   1.842   5.802
  422    H    LEU  59           H        LEU  59 -10.084   4.179   0.701
  423    HA   LEU  59           HA       LEU  59  -8.591   6.715   1.002
  424   1HB   LEU  59          1HB       LEU  59  -9.766   5.119  -1.087
  425   2HB   LEU  59          2HB       LEU  59 -10.444   6.746  -1.163
  426    HG   LEU  59           HG       LEU  59  -7.758   7.220  -0.688
  427   1HD1  LEU  59          1HD1      LEU  59  -7.928   4.562  -1.584
  428   2HD1  LEU  59          2HD1      LEU  59  -7.439   5.494  -2.999
  429   3HD1  LEU  59          3HD1      LEU  59  -6.478   5.564  -1.522
  430   1HD2  LEU  59          1HD2      LEU  59  -9.686   7.859  -2.578
  431   2HD2  LEU  59          2HD2      LEU  59  -8.033   8.474  -2.557
  432   3HD2  LEU  59          3HD2      LEU  59  -8.438   7.065  -3.537
  433    HA   PRO  60           HA       PRO  60 -11.769   9.276   2.630
  434   1HB   PRO  60          1HB       PRO  60 -12.127  10.916   0.270
  435   2HB   PRO  60          2HB       PRO  60 -11.300  11.320   1.777
  436   1HG   PRO  60          1HG       PRO  60 -10.106  10.782  -0.756
  437   2HG   PRO  60          2HG       PRO  60  -9.283  11.084   0.777
  438   1HD   PRO  60          1HD       PRO  60  -9.473   8.593  -0.671
  439   2HD   PRO  60          2HD       PRO  60  -8.643   8.899   0.875
  440    H    ASN  61           H        ASN  61 -13.937  10.523   1.410
  441    HA   ASN  61           HA       ASN  61 -15.919   8.556   1.236
  442   1HB   ASN  61          1HB       ASN  61 -15.542  11.387   0.537
  443   2HB   ASN  61          2HB       ASN  61 -16.793  10.595  -0.422
  444   1HD2  ASN  61          2HD2      ASN  61 -18.774  11.032   0.561
  445   2HD2  ASN  61          1HD2      ASN  61 -19.073  10.934   2.230
  446    H    LYS  62           H        LYS  62 -13.697   9.688  -1.231
  447    HA   LYS  62           HA       LYS  62 -15.108   8.274  -3.404
  448   1HB   LYS  62          1HB       LYS  62 -12.997  10.261  -3.039
  449   2HB   LYS  62          2HB       LYS  62 -12.563   9.060  -4.256
  450   1HG   LYS  62          1HG       LYS  62 -15.341  10.114  -4.375
  451   2HG   LYS  62          2HG       LYS  62 -14.057  11.235  -4.829
  452   1HD   LYS  62          1HD       LYS  62 -13.453   8.724  -6.029
  453   2HD   LYS  62          2HD       LYS  62 -15.149   9.075  -6.362
  454   1HE   LYS  62          1HE       LYS  62 -14.657  10.980  -7.594
  455   2HE   LYS  62          2HE       LYS  62 -13.153  11.289  -6.705
  456   1HZ   LYS  62          1HZ       LYS  62 -12.867   8.784  -7.829
  457   2HZ   LYS  62          2HZ       LYS  62 -13.544   9.739  -9.057
  458   3HZ   LYS  62          3HZ       LYS  62 -12.090  10.213  -8.316
  459    H    THR  63           H        THR  63 -14.512   6.468  -1.416
  460    HA   THR  63           HA       THR  63 -11.956   5.157  -1.687
  461    HB   THR  63           HB       THR  63 -13.312   4.862   0.279
  462    HG1  THR  63           HG1      THR  63 -13.764   2.491   0.046
  463   1HG2  THR  63          1HG2      THR  63 -15.430   4.243  -1.743
  464   2HG2  THR  63          2HG2      THR  63 -15.545   3.503  -0.147
  465   3HG2  THR  63          3HG2      THR  63 -15.520   5.258  -0.304
  466    H    CYS  64           H        CYS  64 -12.352   2.553  -2.209
  467    HA   CYS  64           HA       CYS  64 -12.665   2.449  -5.097
  468   1HB   CYS  64          1HB       CYS  64 -11.098   1.116  -3.615
  469   2HB   CYS  64          2HB       CYS  64 -12.501   0.191  -3.081
  Start of MODEL   26
    1   1H    LYS   1          1H        LYS   1   4.715   4.654  11.665
    2   2H    LYS   1          2H        LYS   1   4.888   6.190  12.367
    3   3H    LYS   1          3H        LYS   1   3.792   5.078  13.026
    4    HA   LYS   1           HA       LYS   1   2.198   5.991  11.776
    5   1HB   LYS   1          1HB       LYS   1   2.746   7.903  10.437
    6   2HB   LYS   1          2HB       LYS   1   3.924   7.888  11.751
    7   1HG   LYS   1          1HG       LYS   1   5.126   6.291   9.836
    8   2HG   LYS   1          2HG       LYS   1   4.344   7.543   8.869
    9   1HD   LYS   1          1HD       LYS   1   5.466   8.918  11.038
   10   2HD   LYS   1          2HD       LYS   1   6.694   7.739  10.567
   11   1HE   LYS   1          1HE       LYS   1   6.362   8.517   8.160
   12   2HE   LYS   1          2HE       LYS   1   5.401   9.856   8.818
   13   1HZ   LYS   1          1HZ       LYS   1   7.903   9.344  10.186
   14   2HZ   LYS   1          2HZ       LYS   1   8.073   9.912   8.593
   15   3HZ   LYS   1          3HZ       LYS   1   7.200  10.821   9.727
   16    H    ASP   2           H        ASP   2   2.861   3.423  11.088
   17    HA   ASP   2           HA       ASP   2   3.297   3.286   8.159
   18   1HB   ASP   2          1HB       ASP   2   2.817   1.128  10.239
   19   2HB   ASP   2          2HB       ASP   2   3.473   0.895   8.619
   20    H    GLY   3           H        GLY   3   1.720   2.198   6.771
   21   1HA   GLY   3          1HA       GLY   3  -0.955   1.675   7.886
   22   2HA   GLY   3          2HA       GLY   3  -0.860   3.020   6.748
   23    H    TYR   4           H        TYR   4  -2.421   1.433   5.633
   24    HA   TYR   4           HA       TYR   4  -1.006  -0.734   4.157
   25   1HB   TYR   4          1HB       TYR   4  -3.757  -0.059   5.013
   26   2HB   TYR   4          2HB       TYR   4  -3.644  -0.783   3.408
   27    HD1  TYR   4           HD1      TYR   4  -2.304  -2.960   3.155
   28    HD2  TYR   4           HD2      TYR   4  -3.544  -1.385   6.954
   29    HE1  TYR   4           HE1      TYR   4  -1.974  -5.192   4.188
   30    HE2  TYR   4           HE2      TYR   4  -3.214  -3.614   7.987
   31    HH   TYR   4           HH       TYR   4  -2.387  -6.445   6.027
   32    H    LEU   5           H        LEU   5  -0.732  -0.617   1.911
   33    HA   LEU   5           HA       LEU   5  -0.859   2.009   0.667
   34   1HB   LEU   5          1HB       LEU   5  -0.083  -0.791  -0.079
   35   2HB   LEU   5          2HB       LEU   5  -0.294   0.397  -1.364
   36    HG   LEU   5           HG       LEU   5   1.584   0.601   1.006
   37   1HD1  LEU   5          1HD1      LEU   5   1.820  -0.303  -1.750
   38   2HD1  LEU   5          2HD1      LEU   5   2.920   1.035  -1.413
   39   3HD1  LEU   5          3HD1      LEU   5   2.984  -0.430  -0.431
   40   1HD2  LEU   5          1HD2      LEU   5   0.354   2.653  -0.663
   41   2HD2  LEU   5          2HD2      LEU   5   1.351   2.839   0.780
   42   3HD2  LEU   5          3HD2      LEU   5   2.112   2.669  -0.803
   43    H    VAL   6           H        VAL   6  -2.440   2.794  -0.672
   44    HA   VAL   6           HA       VAL   6  -4.925   1.195  -0.973
   45    HB   VAL   6           HB       VAL   6  -5.879   3.377  -1.529
   46   1HG1  VAL   6          1HG1      VAL   6  -4.537   2.737   0.891
   47   2HG1  VAL   6          2HG1      VAL   6  -4.265   4.453   0.588
   48   3HG1  VAL   6          3HG1      VAL   6  -5.910   3.822   0.674
   49   1HG2  VAL   6          1HG2      VAL   6  -3.487   3.953  -2.663
   50   2HG2  VAL   6          2HG2      VAL   6  -4.643   5.198  -2.188
   51   3HG2  VAL   6          3HG2      VAL   6  -3.294   4.794  -1.125
   52    H    GLU   7           H        GLU   7  -5.952   2.195  -3.316
   53    HA   GLU   7           HA       GLU   7  -4.011   1.174  -5.358
   54   1HB   GLU   7          1HB       GLU   7  -6.410   0.180  -4.692
   55   2HB   GLU   7          2HB       GLU   7  -6.947   1.386  -5.863
   56   1HG   GLU   7          1HG       GLU   7  -4.626  -0.058  -6.845
   57   2HG   GLU   7          2HG       GLU   7  -5.939  -1.166  -6.442
   58    H    LYS   8           H        LYS   8  -4.819   2.098  -7.663
   59    HA   LYS   8           HA       LYS   8  -4.132   4.849  -7.764
   60   1HB   LYS   8          1HB       LYS   8  -4.157   2.973  -9.551
   61   2HB   LYS   8          2HB       LYS   8  -5.851   3.407  -9.787
   62   1HG   LYS   8          1HG       LYS   8  -4.542   4.670 -11.379
   63   2HG   LYS   8          2HG       LYS   8  -5.106   5.792 -10.141
   64   1HD   LYS   8          1HD       LYS   8  -2.911   6.400 -10.045
   65   2HD   LYS   8          2HD       LYS   8  -2.758   4.963  -9.036
   66   1HE   LYS   8          1HE       LYS   8  -2.641   4.398 -11.932
   67   2HE   LYS   8          2HE       LYS   8  -1.295   5.381 -11.322
   68   1HZ   LYS   8          1HZ       LYS   8  -2.182   3.144  -9.667
   69   2HZ   LYS   8          2HZ       LYS   8  -1.321   2.757 -11.076
   70   3HZ   LYS   8          3HZ       LYS   8  -0.618   3.764  -9.903
   71    H    THR   9           H        THR   9  -7.309   3.260  -7.599
   72    HA   THR   9           HA       THR   9  -8.690   5.882  -7.757
   73    HB   THR   9           HB       THR   9 -10.688   4.356  -7.781
   74    HG1  THR   9           HG1      THR   9  -9.401   2.717  -6.565
   75   1HG2  THR   9          1HG2      THR   9  -9.261   5.030  -9.827
   76   2HG2  THR   9          2HG2      THR   9  -8.635   3.383  -9.757
   77   3HG2  THR   9          3HG2      THR   9 -10.358   3.662 -10.010
   78    H    GLY  10           H        GLY  10  -7.256   4.041  -5.371
   79   1HA   GLY  10          1HA       GLY  10  -7.378   4.823  -3.044
   80   2HA   GLY  10          2HA       GLY  10  -9.082   5.193  -3.309
   81    H    CYS  11           H        CYS  11  -8.345   2.296  -4.816
   82    HA   CYS  11           HA       CYS  11  -9.830   0.752  -2.807
   83   1HB   CYS  11          1HB       CYS  11  -8.771   0.439  -5.584
   84   2HB   CYS  11          2HB       CYS  11  -9.100  -1.032  -4.671
   85    H    LYS  12           H        LYS  12  -8.646  -1.715  -2.860
   86    HA   LYS  12           HA       LYS  12  -6.086  -1.233  -1.409
   87   1HB   LYS  12          1HB       LYS  12  -8.040  -3.558  -1.519
   88   2HB   LYS  12          2HB       LYS  12  -6.616  -3.491  -0.487
   89   1HG   LYS  12          1HG       LYS  12  -8.038  -2.591   1.044
   90   2HG   LYS  12          2HG       LYS  12  -7.815  -1.107   0.114
   91   1HD   LYS  12          1HD       LYS  12 -10.147  -1.301   0.172
   92   2HD   LYS  12          2HD       LYS  12  -9.752  -2.060  -1.371
   93   1HE   LYS  12          1HE       LYS  12  -9.584  -4.011   0.770
   94   2HE   LYS  12          2HE       LYS  12 -11.183  -3.241   0.746
   95   1HZ   LYS  12          1HZ       LYS  12 -10.843  -3.504  -1.829
   96   2HZ   LYS  12          2HZ       LYS  12  -9.833  -4.785  -1.350
   97   3HZ   LYS  12          3HZ       LYS  12 -11.472  -4.776  -0.900
   98    H    LYS  13           H        LYS  13  -4.780  -3.561  -1.625
   99    HA   LYS  13           HA       LYS  13  -4.627  -4.287  -4.522
  100   1HB   LYS  13          1HB       LYS  13  -3.028  -2.429  -3.850
  101   2HB   LYS  13          2HB       LYS  13  -2.251  -3.588  -2.771
  102   1HG   LYS  13          1HG       LYS  13  -0.952  -3.945  -4.636
  103   2HG   LYS  13          2HG       LYS  13  -2.259  -5.068  -5.011
  104   1HD   LYS  13          1HD       LYS  13  -3.315  -2.805  -6.036
  105   2HD   LYS  13          2HD       LYS  13  -1.601  -2.447  -6.249
  106   1HE   LYS  13          1HE       LYS  13  -1.445  -4.848  -7.252
  107   2HE   LYS  13          2HE       LYS  13  -3.205  -4.720  -7.424
  108   1HZ   LYS  13          1HZ       LYS  13  -2.260  -2.283  -8.234
  109   2HZ   LYS  13          2HZ       LYS  13  -1.144  -3.378  -8.894
  110   3HZ   LYS  13          3HZ       LYS  13  -2.798  -3.530  -9.253
  111    H    THR  14           H        THR  14  -5.824  -5.949  -2.736
  112    HA   THR  14           HA       THR  14  -4.514  -7.698  -1.078
  113    HB   THR  14           HB       THR  14  -6.577  -8.053  -3.243
  114    HG1  THR  14           HG1      THR  14  -7.904  -7.899  -1.582
  115   1HG2  THR  14          1HG2      THR  14  -5.397 -10.212  -3.095
  116   2HG2  THR  14          2HG2      THR  14  -5.624 -10.217  -1.348
  117   3HG2  THR  14          3HG2      THR  14  -7.020 -10.331  -2.416
  118    H    CYS  15           H        CYS  15  -3.200  -9.560  -1.322
  119    HA   CYS  15           HA       CYS  15  -2.075 -10.092  -4.044
  120   1HB   CYS  15          1HB       CYS  15   0.163 -10.169  -2.969
  121   2HB   CYS  15          2HB       CYS  15  -0.586  -8.582  -2.784
  122    H    TYR  16           H        TYR  16  -1.016 -12.274  -4.123
  123    HA   TYR  16           HA       TYR  16  -2.481 -14.201  -2.385
  124   1HB   TYR  16          1HB       TYR  16  -0.709 -14.845  -4.744
  125   2HB   TYR  16          2HB       TYR  16  -2.122 -15.723  -4.161
  126    HD1  TYR  16           HD1      TYR  16  -4.393 -14.354  -4.182
  127    HD2  TYR  16           HD2      TYR  16  -0.944 -13.403  -6.560
  128    HE1  TYR  16           HE1      TYR  16  -5.824 -13.063  -5.746
  129    HE2  TYR  16           HE2      TYR  16  -2.374 -12.115  -8.121
  130    HH   TYR  16           HH       TYR  16  -4.431 -11.495  -8.635
  131    H    LYS  17           H        LYS  17   0.618 -12.781  -2.763
  132    HA   LYS  17           HA       LYS  17   1.985 -15.033  -1.361
  133   1HB   LYS  17          1HB       LYS  17   3.043 -14.170  -3.382
  134   2HB   LYS  17          2HB       LYS  17   2.952 -12.520  -2.763
  135   1HG   LYS  17          1HG       LYS  17   4.278 -13.594  -0.718
  136   2HG   LYS  17          2HG       LYS  17   4.775 -14.748  -1.954
  137   1HD   LYS  17          1HD       LYS  17   5.043 -12.277  -3.212
  138   2HD   LYS  17          2HD       LYS  17   5.609 -11.977  -1.568
  139   1HE   LYS  17          1HE       LYS  17   7.473 -12.753  -3.011
  140   2HE   LYS  17          2HE       LYS  17   7.123 -13.954  -1.752
  141   1HZ   LYS  17          1HZ       LYS  17   5.396 -14.381  -3.930
  142   2HZ   LYS  17          2HZ       LYS  17   6.985 -14.296  -4.522
  143   3HZ   LYS  17          3HZ       LYS  17   6.586 -15.419  -3.313
  144    H    LEU  18           H        LEU  18   1.006 -14.583   0.734
  145    HA   LEU  18           HA       LEU  18   1.094 -12.009   2.008
  146   1HB   LEU  18          1HB       LEU  18   0.765 -14.882   2.852
  147   2HB   LEU  18          2HB       LEU  18   0.828 -13.602   4.064
  148    HG   LEU  18           HG       LEU  18  -1.074 -13.656   1.704
  149   1HD1  LEU  18          1HD1      LEU  18  -1.346 -15.365   3.676
  150   2HD1  LEU  18          2HD1      LEU  18  -1.872 -13.950   4.588
  151   3HD1  LEU  18          3HD1      LEU  18  -2.748 -14.439   3.138
  152   1HD2  LEU  18          1HD2      LEU  18  -0.212 -11.585   3.493
  153   2HD2  LEU  18          2HD2      LEU  18  -1.411 -11.489   2.205
  154   3HD2  LEU  18          3HD2      LEU  18  -1.904 -11.955   3.834
  155    H    GLY  19           H        GLY  19   2.843 -10.976   2.853
  156   1HA   GLY  19          1HA       GLY  19   4.857 -10.746   4.092
  157   2HA   GLY  19          2HA       GLY  19   5.024 -12.498   4.107
  158    H    GLU  20           H        GLU  20   7.127 -10.734   3.530
  159    HA   GLU  20           HA       GLU  20   8.696 -10.127   1.835
  160   1HB   GLU  20          1HB       GLU  20   9.024 -12.502   2.590
  161   2HB   GLU  20          2HB       GLU  20   8.086 -13.023   1.189
  162   1HG   GLU  20          1HG       GLU  20   9.707 -11.866  -0.298
  163   2HG   GLU  20          2HG       GLU  20  10.664 -11.426   1.117
  164    H    ASN  21           H        ASN  21   6.407  -9.049   0.830
  165    HA   ASN  21           HA       ASN  21   6.137 -10.144  -1.947
  166   1HB   ASN  21          1HB       ASN  21   4.187  -9.709  -0.217
  167   2HB   ASN  21          2HB       ASN  21   4.367  -8.033  -0.739
  168   1HD2  ASN  21          2HD2      ASN  21   2.175 -10.141  -1.322
  169   2HD2  ASN  21          1HD2      ASN  21   2.045 -10.131  -3.014
  170    H    ASP  22           H        ASP  22   8.328  -9.060  -2.299
  171    HA   ASP  22           HA       ASP  22   9.053  -6.425  -2.114
  172   1HB   ASP  22          1HB       ASP  22   9.788  -8.667  -3.581
  173   2HB   ASP  22          2HB       ASP  22   9.439  -7.466  -4.825
  174    H    PHE  23           H        PHE  23   6.669  -7.720  -4.422
  175    HA   PHE  23           HA       PHE  23   6.293  -5.641  -6.196
  176   1HB   PHE  23          1HB       PHE  23   4.827  -7.846  -5.142
  177   2HB   PHE  23          2HB       PHE  23   3.727  -6.469  -5.216
  178    HD1  PHE  23           HD1      PHE  23   6.624  -7.502  -7.364
  179    HD2  PHE  23           HD2      PHE  23   2.423  -6.633  -7.152
  180    HE1  PHE  23           HE1      PHE  23   6.445  -7.767  -9.823
  181    HE2  PHE  23           HE2      PHE  23   2.244  -6.899  -9.611
  182    HZ   PHE  23           HZ       PHE  23   4.255  -7.464 -10.946
  183    H    CYS  24           H        CYS  24   4.897  -5.773  -2.889
  184    HA   CYS  24           HA       CYS  24   3.519  -3.290  -2.963
  185   1HB   CYS  24          1HB       CYS  24   4.937  -4.718  -0.687
  186   2HB   CYS  24          2HB       CYS  24   3.695  -3.484  -0.493
  187    H    ASN  25           H        ASN  25   6.789  -3.980  -1.649
  188    HA   ASN  25           HA       ASN  25   7.608  -1.397  -0.969
  189   1HB   ASN  25          1HB       ASN  25   8.783  -3.965  -1.698
  190   2HB   ASN  25          2HB       ASN  25   9.812  -2.625  -2.201
  191   1HD2  ASN  25          2HD2      ASN  25   9.542  -4.680   0.299
  192   2HD2  ASN  25          1HD2      ASN  25   9.983  -3.673   1.591
  193    H    ARG  26           H        ARG  26   7.960  -2.973  -4.159
  194    HA   ARG  26           HA       ARG  26   9.127  -0.840  -5.585
  195   1HB   ARG  26          1HB       ARG  26   8.376  -3.363  -6.107
  196   2HB   ARG  26          2HB       ARG  26   7.023  -2.527  -6.869
  197   1HG   ARG  26          1HG       ARG  26   8.314  -1.720  -8.557
  198   2HG   ARG  26          2HG       ARG  26   9.664  -1.367  -7.480
  199   1HD   ARG  26          1HD       ARG  26  10.694  -3.307  -8.023
  200   2HD   ARG  26          2HD       ARG  26   9.223  -4.245  -7.715
  201    HE   ARG  26           HE       ARG  26  10.202  -3.500 -10.295
  202   1HH1  ARG  26          1HH1      ARG  26   7.245  -3.459  -8.480
  203   2HH1  ARG  26          2HH1      ARG  26   6.254  -3.273  -9.883
  204   1HH2  ARG  26          1HH2      ARG  26   8.909  -3.288 -12.106
  205   2HH2  ARG  26          2HH2      ARG  26   7.189  -3.189 -11.930
  206    H    GLU  27           H        GLU  27   5.661  -1.521  -5.008
  207    HA   GLU  27           HA       GLU  27   4.785   0.822  -6.522
  208   1HB   GLU  27          1HB       GLU  27   3.722  -1.582  -5.482
  209   2HB   GLU  27          2HB       GLU  27   2.847  -0.281  -4.674
  210   1HG   GLU  27          1HG       GLU  27   2.069   0.626  -6.707
  211   2HG   GLU  27          2HG       GLU  27   3.287  -0.225  -7.656
  212    H    CYS  28           H        CYS  28   6.015   0.341  -3.372
  213    HA   CYS  28           HA       CYS  28   4.456   2.425  -2.030
  214   1HB   CYS  28          1HB       CYS  28   5.672   0.291  -1.127
  215   2HB   CYS  28          2HB       CYS  28   7.108   1.318  -1.131
  216    H    LYS  29           H        LYS  29   7.763   2.176  -3.381
  217    HA   LYS  29           HA       LYS  29   8.327   4.990  -2.681
  218   1HB   LYS  29          1HB       LYS  29  10.549   4.425  -3.422
  219   2HB   LYS  29          2HB       LYS  29   9.936   3.034  -2.528
  220   1HG   LYS  29          1HG       LYS  29   9.550   1.787  -4.495
  221   2HG   LYS  29          2HG       LYS  29   9.603   3.218  -5.522
  222   1HD   LYS  29          1HD       LYS  29  12.021   2.394  -3.926
  223   2HD   LYS  29          2HD       LYS  29  11.679   1.652  -5.490
  224   1HE   LYS  29          1HE       LYS  29  11.688   4.659  -5.190
  225   2HE   LYS  29          2HE       LYS  29  13.190   3.762  -5.493
  226   1HZ   LYS  29          1HZ       LYS  29  10.750   3.252  -7.082
  227   2HZ   LYS  29          2HZ       LYS  29  11.829   4.490  -7.514
  228   3HZ   LYS  29          3HZ       LYS  29  12.363   2.882  -7.467
  229    H    TRP  30           H        TRP  30   7.260   3.165  -5.470
  230    HA   TRP  30           HA       TRP  30   8.121   4.789  -7.585
  231   1HB   TRP  30          1HB       TRP  30   6.644   3.511  -8.808
  232   2HB   TRP  30          2HB       TRP  30   6.656   2.561  -7.328
  233    HD1  TRP  30           HD1      TRP  30   4.204   3.052  -9.533
  234    HE1  TRP  30           HE1      TRP  30   1.901   3.682  -8.559
  235    HE3  TRP  30           HE3      TRP  30   5.626   4.737  -4.936
  236    HZ2  TRP  30           HZ2      TRP  30   0.807   4.753  -6.142
  237    HZ3  TRP  30           HZ3      TRP  30   3.938   5.553  -3.313
  238    HH2  TRP  30           HH2      TRP  30   1.531   5.567  -3.911
  239    H    LYS  31           H        LYS  31   6.111   5.981  -8.914
  240    HA   LYS  31           HA       LYS  31   5.063   8.098  -9.056
  241   1HB   LYS  31          1HB       LYS  31   3.707   6.323  -7.465
  242   2HB   LYS  31          2HB       LYS  31   3.832   7.724  -6.404
  243   1HG   LYS  31          1HG       LYS  31   2.672   9.117  -7.909
  244   2HG   LYS  31          2HG       LYS  31   2.945   8.026  -9.269
  245   1HD   LYS  31          1HD       LYS  31   0.681   7.658  -8.673
  246   2HD   LYS  31          2HD       LYS  31   1.551   6.313  -7.935
  247   1HE   LYS  31          1HE       LYS  31   1.346   7.189  -5.773
  248   2HE   LYS  31          2HE       LYS  31   1.121   8.847  -6.362
  249   1HZ   LYS  31          1HZ       LYS  31  -0.881   7.448  -7.564
  250   2HZ   LYS  31          2HZ       LYS  31  -0.826   6.765  -6.012
  251   3HZ   LYS  31          3HZ       LYS  31  -1.054   8.439  -6.196
  252    H    HIS  32           H        HIS  32   7.680   7.866  -7.430
  253    HA   HIS  32           HA       HIS  32   8.997   9.280  -6.068
  254   1HB   HIS  32          1HB       HIS  32   7.240  10.821  -7.838
  255   2HB   HIS  32          2HB       HIS  32   7.776  11.748  -6.437
  256    HD1  HIS  32           HD1      HIS  32   8.821  11.041  -9.749
  257    HD2  HIS  32           HD2      HIS  32  10.819  11.218  -6.095
  258    HE1  HIS  32           HE1      HIS  32  11.279  11.348 -10.289
  259    H    ILE  33           H        ILE  33   7.994   8.169  -4.119
  260    HA   ILE  33           HA       ILE  33   6.408  10.149  -2.528
  261    HB   ILE  33           HB       ILE  33   5.559   7.686  -3.537
  262   1HG1  ILE  33          1HG1      ILE  33   3.871   8.179  -1.413
  263   2HG1  ILE  33          2HG1      ILE  33   4.621   9.755  -1.675
  264   1HG2  ILE  33          1HG2      ILE  33   6.155   7.403  -0.574
  265   2HG2  ILE  33          2HG2      ILE  33   5.191   6.282  -1.535
  266   3HG2  ILE  33          3HG2      ILE  33   6.911   6.478  -1.870
  267   1HD1  ILE  33          1HD1      ILE  33   3.702   8.250  -4.083
  268   2HD1  ILE  33          2HD1      ILE  33   2.467   8.984  -3.061
  269   3HD1  ILE  33          3HD1      ILE  33   3.722   9.988  -3.786
  270    H    GLY  34           H        GLY  34   8.534   7.272  -2.343
  271   1HA   GLY  34          1HA       GLY  34  10.600   7.347  -1.027
  272   2HA   GLY  34          2HA       GLY  34   9.826   8.518   0.039
  273    H    GLY  35           H        GLY  35   9.911   5.113  -0.871
  274   1HA   GLY  35          1HA       GLY  35   8.399   4.483   1.628
  275   2HA   GLY  35          2HA       GLY  35   8.474   3.418   0.224
  276    H    SER  36           H        SER  36   9.727   3.870   3.270
  277    HA   SER  36           HA       SER  36  12.445   2.854   2.679
  278   1HB   SER  36          1HB       SER  36  12.142   2.900   5.402
  279   2HB   SER  36          2HB       SER  36  12.639   4.290   4.442
  280    HG   SER  36           HG       SER  36  10.059   3.602   5.386
  281    H    TYR  37           H        TYR  37   9.332   1.661   3.734
  282    HA   TYR  37           HA       TYR  37  10.418  -1.109   3.761
  283   1HB   TYR  37          1HB       TYR  37   9.865   0.491   6.067
  284   2HB   TYR  37          2HB       TYR  37   8.648  -0.783   5.993
  285    HD1  TYR  37           HD1      TYR  37  12.326  -0.157   5.913
  286    HD2  TYR  37           HD2      TYR  37   9.192  -3.029   6.528
  287    HE1  TYR  37           HE1      TYR  37  13.992  -1.796   6.743
  288    HE2  TYR  37           HE2      TYR  37  10.859  -4.670   7.355
  289    HH   TYR  37           HH       TYR  37  13.799  -4.737   6.809
  290    H    GLY  38           H        GLY  38   8.871  -2.556   2.936
  291   1HA   GLY  38          1HA       GLY  38   6.020  -1.938   3.062
  292   2HA   GLY  38          2HA       GLY  38   6.693  -1.766   1.442
  293    H    TYR  39           H        TYR  39   4.805  -3.769   2.784
  294    HA   TYR  39           HA       TYR  39   5.843  -6.139   1.389
  295   1HB   TYR  39          1HB       TYR  39   5.691  -7.497   3.521
  296   2HB   TYR  39          2HB       TYR  39   6.998  -6.312   3.518
  297    HD1  TYR  39           HD1      TYR  39   3.551  -6.989   4.731
  298    HD2  TYR  39           HD2      TYR  39   7.015  -4.465   5.040
  299    HE1  TYR  39           HE1      TYR  39   2.598  -5.929   6.760
  300    HE2  TYR  39           HE2      TYR  39   6.061  -3.406   7.072
  301    HH   TYR  39           HH       TYR  39   4.187  -4.377   8.939
  302    H    CYS  40           H        CYS  40   4.080  -8.030   1.963
  303    HA   CYS  40           HA       CYS  40   1.420  -6.650   1.843
  304   1HB   CYS  40          1HB       CYS  40   2.579  -8.070  -0.090
  305   2HB   CYS  40          2HB       CYS  40   1.870  -9.415   0.805
  306    H    TYR  41           H        TYR  41   0.081  -7.055   3.523
  307    HA   TYR  41           HA       TYR  41   0.266  -9.686   4.936
  308   1HB   TYR  41          1HB       TYR  41   1.418  -7.534   5.970
  309   2HB   TYR  41          2HB       TYR  41  -0.237  -7.124   6.426
  310    HD1  TYR  41           HD1      TYR  41   1.989 -10.151   6.396
  311    HD2  TYR  41           HD2      TYR  41  -0.946  -7.842   8.520
  312    HE1  TYR  41           HE1      TYR  41   2.116 -11.738   8.297
  313    HE2  TYR  41           HE2      TYR  41  -0.819  -9.429  10.421
  314    HH   TYR  41           HH       TYR  41   0.546 -11.079  11.347
  315    H    GLY  42           H        GLY  42  -1.791 -10.413   5.731
  316   1HA   GLY  42          1HA       GLY  42  -4.131 -10.632   5.580
  317   2HA   GLY  42          2HA       GLY  42  -4.148  -8.921   6.015
  318    H    PHE  43           H        PHE  43  -2.965 -10.593   3.091
  319    HA   PHE  43           HA       PHE  43  -3.385 -10.109   0.817
  320   1HB   PHE  43          1HB       PHE  43  -6.075  -9.831   2.181
  321   2HB   PHE  43          2HB       PHE  43  -5.889  -9.865   0.430
  322    HD1  PHE  43           HD1      PHE  43  -3.547 -11.845   0.328
  323    HD2  PHE  43           HD2      PHE  43  -7.264 -11.885   2.481
  324    HE1  PHE  43           HE1      PHE  43  -3.482 -14.319   0.395
  325    HE2  PHE  43           HE2      PHE  43  -7.199 -14.361   2.545
  326    HZ   PHE  43           HZ       PHE  43  -5.308 -15.578   1.502
  327    H    GLY  44           H        GLY  44  -2.067  -8.088   1.076
  328   1HA   GLY  44          1HA       GLY  44  -3.052  -5.859  -0.195
  329   2HA   GLY  44          2HA       GLY  44  -3.460  -5.556   1.495
  330    H    CYS  45           H        CYS  45  -1.528  -4.062  -0.123
  331    HA   CYS  45           HA       CYS  45   1.129  -4.899   0.847
  332   1HB   CYS  45          1HB       CYS  45   0.016  -2.676  -0.871
  333   2HB   CYS  45          2HB       CYS  45   1.719  -2.737  -0.419
  334    H    TYR  46           H        TYR  46   2.207  -3.956   2.543
  335    HA   TYR  46           HA       TYR  46   0.851  -1.710   3.999
  336   1HB   TYR  46          1HB       TYR  46   1.110  -4.184   4.899
  337   2HB   TYR  46          2HB       TYR  46   2.766  -3.678   5.225
  338    HD1  TYR  46           HD1      TYR  46  -0.806  -2.879   5.898
  339    HD2  TYR  46           HD2      TYR  46   3.279  -2.236   7.061
  340    HE1  TYR  46           HE1      TYR  46  -1.573  -1.734   7.959
  341    HE2  TYR  46           HE2      TYR  46   2.510  -1.091   9.123
  342    HH   TYR  46           HH       TYR  46  -0.662  -1.264  10.244
  343    H    CYS  47           H        CYS  47   2.323  -0.060   4.840
  344    HA   CYS  47           HA       CYS  47   5.171  -0.293   3.969
  345   1HB   CYS  47          1HB       CYS  47   3.033   1.515   2.969
  346   2HB   CYS  47          2HB       CYS  47   4.626   2.231   3.203
  347    H    GLU  48           H        GLU  48   6.556   1.357   4.963
  348    HA   GLU  48           HA       GLU  48   5.388   2.761   7.327
  349   1HB   GLU  48          1HB       GLU  48   7.939   1.139   7.444
  350   2HB   GLU  48          2HB       GLU  48   6.968   1.736   8.789
  351   1HG   GLU  48          1HG       GLU  48   5.160   0.204   8.221
  352   2HG   GLU  48          2HG       GLU  48   6.032  -0.337   6.785
  353    H    GLY  49           H        GLY  49   5.986   4.881   7.020
  354   1HA   GLY  49          1HA       GLY  49   8.006   6.384   7.205
  355   2HA   GLY  49          2HA       GLY  49   8.724   5.400   5.929
  356    H    LEU  50           H        LEU  50   5.387   5.853   5.454
  357    HA   LEU  50           HA       LEU  50   5.823   7.395   3.046
  358   1HB   LEU  50          1HB       LEU  50   3.203   7.064   4.523
  359   2HB   LEU  50          2HB       LEU  50   3.455   7.216   2.790
  360    HG   LEU  50           HG       LEU  50   3.170   4.956   2.840
  361   1HD1  LEU  50          1HD1      LEU  50   5.743   5.536   2.508
  362   2HD1  LEU  50          2HD1      LEU  50   5.900   4.600   3.995
  363   3HD1  LEU  50          3HD1      LEU  50   5.180   3.868   2.564
  364   1HD2  LEU  50          1HD2      LEU  50   3.523   5.390   5.688
  365   2HD2  LEU  50          2HD2      LEU  50   2.552   4.177   4.854
  366   3HD2  LEU  50          3HD2      LEU  50   4.261   3.873   5.176
  367    HA   PRO  51           HA       PRO  51   6.157  11.410   4.963
  368   1HB   PRO  51          1HB       PRO  51   4.852  12.482   2.578
  369   2HB   PRO  51          2HB       PRO  51   6.516  12.708   3.131
  370   1HG   PRO  51          1HG       PRO  51   5.635  11.085   0.965
  371   2HG   PRO  51          2HG       PRO  51   7.272  11.201   1.616
  372   1HD   PRO  51          1HD       PRO  51   5.476   8.959   1.792
  373   2HD   PRO  51          2HD       PRO  51   7.100   9.110   2.511
  374    H    ASP  52           H        ASP  52   4.681  12.761   6.063
  375    HA   ASP  52           HA       ASP  52   2.169  11.850   6.830
  376   1HB   ASP  52          1HB       ASP  52   3.757  13.887   7.491
  377   2HB   ASP  52          2HB       ASP  52   2.613  14.789   6.494
  378    H    SER  53           H        SER  53   2.829  14.198   4.201
  379    HA   SER  53           HA       SER  53   0.170  14.711   3.414
  380   1HB   SER  53          1HB       SER  53   1.228  15.815   1.709
  381   2HB   SER  53          2HB       SER  53   2.671  15.450   2.650
  382    HG   SER  53           HG       SER  53   1.761  14.387   0.265
  383    H    THR  54           H        THR  54   2.211  11.904   2.710
  384    HA   THR  54           HA       THR  54   0.722  10.795   0.547
  385    HB   THR  54           HB       THR  54   2.095   9.265   2.770
  386    HG1  THR  54           HG1      THR  54   3.871  10.206   2.223
  387   1HG2  THR  54          1HG2      THR  54   1.221   8.744   0.000
  388   2HG2  THR  54          2HG2      THR  54   2.858   8.201   0.370
  389   3HG2  THR  54          3HG2      THR  54   1.497   7.614   1.325
  390    H    GLN  55           H        GLN  55  -1.137   9.519   0.504
  391    HA   GLN  55           HA       GLN  55  -2.758   9.433   2.993
  392   1HB   GLN  55          1HB       GLN  55  -3.156   9.513   0.079
  393   2HB   GLN  55          2HB       GLN  55  -4.246   8.395   0.900
  394   1HG   GLN  55          1HG       GLN  55  -3.815  11.225   1.872
  395   2HG   GLN  55          2HG       GLN  55  -5.059  10.815   0.691
  396   1HE2  GLN  55          2HE2      GLN  55  -6.007  11.808   3.077
  397   2HE2  GLN  55          1HE2      GLN  55  -6.670  10.570   4.028
  398    H    THR  56           H        THR  56  -3.998   7.341   3.376
  399    HA   THR  56           HA       THR  56  -2.682   4.887   2.353
  400    HB   THR  56           HB       THR  56  -2.823   4.528   5.132
  401    HG1  THR  56           HG1      THR  56  -1.354   6.434   5.603
  402   1HG2  THR  56          1HG2      THR  56  -0.894   4.531   3.005
  403   2HG2  THR  56          2HG2      THR  56  -0.185   5.286   4.433
  404   3HG2  THR  56          3HG2      THR  56  -0.847   3.653   4.534
  405    H    TRP  57           H        TRP  57  -3.851   2.911   3.436
  406    HA   TRP  57           HA       TRP  57  -6.759   3.372   3.213
  407   1HB   TRP  57          1HB       TRP  57  -5.128   1.449   2.312
  408   2HB   TRP  57          2HB       TRP  57  -5.496   0.745   3.883
  409    HD1  TRP  57           HD1      TRP  57  -7.314   2.103   0.765
  410    HE1  TRP  57           HE1      TRP  57  -9.577   0.888   0.549
  411    HE3  TRP  57           HE3      TRP  57  -7.233  -0.690   5.046
  412    HZ2  TRP  57           HZ2      TRP  57 -11.145  -1.012   1.996
  413    HZ3  TRP  57           HZ3      TRP  57  -9.127  -2.190   5.600
  414    HH2  TRP  57           HH2      TRP  57 -11.080  -2.355   4.082
  415    HA   PRO  58           HA       PRO  58  -8.540   2.435   3.770
  416   1HB   PRO  58          1HB       PRO  58 -10.569   3.549   5.377
  417   2HB   PRO  58          2HB       PRO  58 -10.299   1.829   5.073
  418   1HG   PRO  58          1HG       PRO  58  -9.875   3.318   7.528
  419   2HG   PRO  58          2HG       PRO  58  -9.775   1.574   7.264
  420   1HD   PRO  58          1HD       PRO  58  -7.597   3.445   7.618
  421   2HD   PRO  58          2HD       PRO  58  -7.500   1.683   7.380
  422    H    LEU  59           H        LEU  59  -9.140   4.098   2.352
  423    HA   LEU  59           HA       LEU  59  -7.998   6.682   2.523
  424   1HB   LEU  59          1HB       LEU  59  -9.806   5.154   0.855
  425   2HB   LEU  59          2HB       LEU  59 -10.377   6.817   0.987
  426    HG   LEU  59           HG       LEU  59  -7.997   7.549   0.445
  427   1HD1  LEU  59          1HD1      LEU  59  -7.474   4.836   0.805
  428   2HD1  LEU  59          2HD1      LEU  59  -7.415   5.047  -0.944
  429   3HD1  LEU  59          3HD1      LEU  59  -6.373   6.016   0.096
  430   1HD2  LEU  59          1HD2      LEU  59  -9.836   7.579  -1.215
  431   2HD2  LEU  59          2HD2      LEU  59  -8.299   7.163  -1.974
  432   3HD2  LEU  59          3HD2      LEU  59  -9.483   5.902  -1.629
  433    HA   PRO  60           HA       PRO  60 -10.601   9.222   5.003
  434   1HB   PRO  60          1HB       PRO  60 -11.560  10.982   2.940
  435   2HB   PRO  60          2HB       PRO  60 -10.250  11.268   4.090
  436   1HG   PRO  60          1HG       PRO  60 -10.044  10.746   1.269
  437   2HG   PRO  60          2HG       PRO  60  -8.740  11.062   2.416
  438   1HD   PRO  60          1HD       PRO  60  -9.388   8.564   1.150
  439   2HD   PRO  60          2HD       PRO  60  -8.118   8.869   2.358
  440    H    ASN  61           H        ASN  61 -13.013  10.464   4.616
  441    HA   ASN  61           HA       ASN  61 -14.964   8.450   4.737
  442   1HB   ASN  61          1HB       ASN  61 -14.916  11.382   4.084
  443   2HB   ASN  61          2HB       ASN  61 -16.435  10.502   3.917
  444   1HD2  ASN  61          2HD2      ASN  61 -13.874   9.901   6.360
  445   2HD2  ASN  61          1HD2      ASN  61 -14.852  10.264   7.698
  446    H    LYS  62           H        LYS  62 -13.573  10.071   1.941
  447    HA   LYS  62           HA       LYS  62 -15.502   8.931   0.035
  448   1HB   LYS  62          1HB       LYS  62 -13.637  11.034   0.150
  449   2HB   LYS  62          2HB       LYS  62 -12.994   9.922  -1.058
  450   1HG   LYS  62          1HG       LYS  62 -15.710   9.995  -1.633
  451   2HG   LYS  62          2HG       LYS  62 -15.336  11.664  -1.206
  452   1HD   LYS  62          1HD       LYS  62 -13.358  10.326  -2.962
  453   2HD   LYS  62          2HD       LYS  62 -14.935  10.630  -3.690
  454   1HE   LYS  62          1HE       LYS  62 -13.302  12.751  -2.249
  455   2HE   LYS  62          2HE       LYS  62 -13.347  12.547  -4.013
  456   1HZ   LYS  62          1HZ       LYS  62 -15.890  12.532  -3.644
  457   2HZ   LYS  62          2HZ       LYS  62 -15.524  13.313  -2.180
  458   3HZ   LYS  62          3HZ       LYS  62 -15.073  14.019  -3.658
  459    H    THR  63           H        THR  63 -14.760   6.701   1.207
  460    HA   THR  63           HA       THR  63 -12.278   5.479   0.540
  461    HB   THR  63           HB       THR  63 -14.907   4.021   0.707
  462    HG1  THR  63           HG1      THR  63 -13.515   5.316   2.809
  463   1HG2  THR  63          1HG2      THR  63 -12.071   3.551   1.632
  464   2HG2  THR  63          2HG2      THR  63 -13.422   2.601   2.250
  465   3HG2  THR  63          3HG2      THR  63 -13.034   2.568   0.529
  466    H    CYS  64           H        CYS  64 -12.236   3.462  -0.980
  467    HA   CYS  64           HA       CYS  64 -12.667   4.323  -3.695
  468   1HB   CYS  64          1HB       CYS  64 -10.997   2.644  -2.594
  469   2HB   CYS  64          2HB       CYS  64 -12.299   1.470  -2.788
  Start of MODEL   27
    1   1H    LYS   1          1H        LYS   1   7.189   5.403  10.021
    2   2H    LYS   1          2H        LYS   1   7.216   6.557   8.774
    3   3H    LYS   1          3H        LYS   1   7.119   7.060  10.391
    4    HA   LYS   1           HA       LYS   1   4.915   6.259  10.629
    5   1HB   LYS   1          1HB       LYS   1   5.501   8.401   9.330
    6   2HB   LYS   1          2HB       LYS   1   5.136   7.481   7.870
    7   1HG   LYS   1          1HG       LYS   1   3.141   7.437  10.101
    8   2HG   LYS   1          2HG       LYS   1   3.241   8.885   9.097
    9   1HD   LYS   1          1HD       LYS   1   3.298   6.905   7.201
   10   2HD   LYS   1          2HD       LYS   1   2.239   6.194   8.419
   11   1HE   LYS   1          1HE       LYS   1   1.101   8.581   8.404
   12   2HE   LYS   1          2HE       LYS   1   1.837   8.690   6.793
   13   1HZ   LYS   1          1HZ       LYS   1   0.919   6.199   6.743
   14   2HZ   LYS   1          2HZ       LYS   1  -0.246   6.898   7.758
   15   3HZ   LYS   1          3HZ       LYS   1   0.008   7.528   6.202
   16    H    ASP   2           H        ASP   2   4.036   4.229  10.424
   17    HA   ASP   2           HA       ASP   2   4.304   2.800   7.812
   18   1HB   ASP   2          1HB       ASP   2   3.080   1.400  10.107
   19   2HB   ASP   2          2HB       ASP   2   4.418   0.899   9.080
   20    H    GLY   3           H        GLY   3   2.419   2.096   6.697
   21   1HA   GLY   3          1HA       GLY   3  -0.232   2.303   7.840
   22   2HA   GLY   3          2HA       GLY   3   0.100   3.658   6.761
   23    H    TYR   4           H        TYR   4  -1.924   2.033   6.000
   24    HA   TYR   4           HA       TYR   4  -0.853   0.013   4.094
   25   1HB   TYR   4          1HB       TYR   4  -3.430   0.685   5.428
   26   2HB   TYR   4          2HB       TYR   4  -3.543  -0.061   3.835
   27    HD1  TYR   4           HD1      TYR   4  -2.217  -2.227   3.423
   28    HD2  TYR   4           HD2      TYR   4  -2.956  -0.609   7.332
   29    HE1  TYR   4           HE1      TYR   4  -1.735  -4.442   4.432
   30    HE2  TYR   4           HE2      TYR   4  -2.471  -2.821   8.341
   31    HH   TYR   4           HH       TYR   4  -2.289  -5.065   7.840
   32    H    LEU   5           H        LEU   5  -0.126   1.083   2.239
   33    HA   LEU   5           HA       LEU   5  -1.229   3.510   1.195
   34   1HB   LEU   5          1HB       LEU   5   0.807   1.584   0.604
   35   2HB   LEU   5          2HB       LEU   5  -0.105   1.893  -0.874
   36    HG   LEU   5           HG       LEU   5   0.346   4.380   0.504
   37   1HD1  LEU   5          1HD1      LEU   5   2.793   2.677  -0.048
   38   2HD1  LEU   5          2HD1      LEU   5   2.839   4.417   0.236
   39   3HD1  LEU   5          3HD1      LEU   5   2.293   3.329   1.512
   40   1HD2  LEU   5          1HD2      LEU   5  -0.005   3.645  -2.027
   41   2HD2  LEU   5          2HD2      LEU   5   0.927   5.089  -1.630
   42   3HD2  LEU   5          3HD2      LEU   5   1.758   3.583  -2.017
   43    H    VAL   6           H        VAL   6  -2.748   3.816  -0.490
   44    HA   VAL   6           HA       VAL   6  -4.545   1.477  -1.005
   45    HB   VAL   6           HB       VAL   6  -6.238   3.185  -1.396
   46   1HG1  VAL   6          1HG1      VAL   6  -4.978   2.743   1.021
   47   2HG1  VAL   6          2HG1      VAL   6  -4.997   4.502   0.908
   48   3HG1  VAL   6          3HG1      VAL   6  -6.507   3.595   0.808
   49   1HG2  VAL   6          1HG2      VAL   6  -3.817   4.930  -1.551
   50   2HG2  VAL   6          2HG2      VAL   6  -5.293   4.969  -2.516
   51   3HG2  VAL   6          3HG2      VAL   6  -5.289   5.639  -0.885
   52    H    GLU   7           H        GLU   7  -5.784   2.078  -3.257
   53    HA   GLU   7           HA       GLU   7  -3.610   2.307  -5.302
   54   1HB   GLU   7          1HB       GLU   7  -5.839   0.570  -4.872
   55   2HB   GLU   7          2HB       GLU   7  -6.151   1.472  -6.354
   56   1HG   GLU   7          1HG       GLU   7  -3.587   0.879  -6.810
   57   2HG   GLU   7          2HG       GLU   7  -3.968  -0.469  -5.738
   58    H    LYS   8           H        LYS   8  -4.162   3.624  -7.254
   59    HA   LYS   8           HA       LYS   8  -4.998   6.231  -6.750
   60   1HB   LYS   8          1HB       LYS   8  -5.167   4.490  -9.218
   61   2HB   LYS   8          2HB       LYS   8  -5.484   6.225  -9.258
   62   1HG   LYS   8          1HG       LYS   8  -3.286   6.782  -8.790
   63   2HG   LYS   8          2HG       LYS   8  -2.977   5.271  -7.933
   64   1HD   LYS   8          1HD       LYS   8  -1.810   4.927  -9.923
   65   2HD   LYS   8          2HD       LYS   8  -3.366   4.178 -10.288
   66   1HE   LYS   8          1HE       LYS   8  -3.675   5.628 -11.999
   67   2HE   LYS   8          2HE       LYS   8  -3.516   6.999 -10.882
   68   1HZ   LYS   8          1HZ       LYS   8  -1.078   6.635 -10.954
   69   2HZ   LYS   8          2HZ       LYS   8  -1.315   5.490 -12.188
   70   3HZ   LYS   8          3HZ       LYS   8  -1.730   7.118 -12.443
   71    H    THR   9           H        THR   9  -7.016   3.421  -7.494
   72    HA   THR   9           HA       THR   9  -9.474   4.964  -7.798
   73    HB   THR   9           HB       THR   9 -10.452   2.689  -7.845
   74    HG1  THR   9           HG1      THR   9  -8.041   1.418  -7.633
   75   1HG2  THR   9          1HG2      THR   9  -8.284   3.646  -9.507
   76   2HG2  THR   9          2HG2      THR   9  -8.304   1.883  -9.468
   77   3HG2  THR   9          3HG2      THR   9  -9.740   2.770  -9.978
   78    H    GLY  10           H        GLY  10  -7.655   3.633  -5.161
   79   1HA   GLY  10          1HA       GLY  10  -8.198   4.559  -2.905
   80   2HA   GLY  10          2HA       GLY  10  -9.897   4.295  -3.296
   81    H    CYS  11           H        CYS  11  -9.532   1.741  -4.552
   82    HA   CYS  11           HA       CYS  11  -9.872  -0.055  -2.413
   83   1HB   CYS  11          1HB       CYS  11  -8.580  -0.693  -5.086
   84   2HB   CYS  11          2HB       CYS  11  -9.561  -1.770  -4.095
   85    H    LYS  12           H        LYS  12  -8.351  -1.651  -1.493
   86    HA   LYS  12           HA       LYS  12  -5.643  -0.522  -1.163
   87   1HB   LYS  12          1HB       LYS  12  -5.510  -2.425   0.492
   88   2HB   LYS  12          2HB       LYS  12  -6.842  -1.315   0.785
   89   1HG   LYS  12          1HG       LYS  12  -8.390  -2.920   0.407
   90   2HG   LYS  12          2HG       LYS  12  -7.562  -3.476  -1.049
   91   1HD   LYS  12          1HD       LYS  12  -6.796  -5.258   0.083
   92   2HD   LYS  12          2HD       LYS  12  -5.927  -4.178   1.169
   93   1HE   LYS  12          1HE       LYS  12  -7.298  -5.019   2.790
   94   2HE   LYS  12          2HE       LYS  12  -8.537  -3.968   2.079
   95   1HZ   LYS  12          1HZ       LYS  12  -8.057  -6.459   0.672
   96   2HZ   LYS  12          2HZ       LYS  12  -8.758  -6.631   2.205
   97   3HZ   LYS  12          3HZ       LYS  12  -9.522  -5.677   1.025
   98    H    LYS  13           H        LYS  13  -4.006  -2.636  -0.932
   99    HA   LYS  13           HA       LYS  13  -4.170  -3.996  -3.605
  100   1HB   LYS  13          1HB       LYS  13  -1.936  -2.779  -1.993
  101   2HB   LYS  13          2HB       LYS  13  -1.578  -4.036  -3.180
  102   1HG   LYS  13          1HG       LYS  13  -3.370  -2.208  -4.419
  103   2HG   LYS  13          2HG       LYS  13  -2.110  -1.252  -3.639
  104   1HD   LYS  13          1HD       LYS  13  -1.329  -1.787  -5.855
  105   2HD   LYS  13          2HD       LYS  13  -0.408  -2.778  -4.723
  106   1HE   LYS  13          1HE       LYS  13  -2.952  -3.945  -5.768
  107   2HE   LYS  13          2HE       LYS  13  -1.578  -3.857  -6.887
  108   1HZ   LYS  13          1HZ       LYS  13  -0.399  -4.637  -4.598
  109   2HZ   LYS  13          2HZ       LYS  13  -1.894  -5.436  -4.485
  110   3HZ   LYS  13          3HZ       LYS  13  -0.888  -5.697  -5.828
  111    H    THR  14           H        THR  14  -5.408  -5.697  -2.395
  112    HA   THR  14           HA       THR  14  -4.372  -7.189  -0.206
  113    HB   THR  14           HB       THR  14  -6.142  -7.955  -2.554
  114    HG1  THR  14           HG1      THR  14  -7.736  -7.605  -0.826
  115   1HG2  THR  14          1HG2      THR  14  -5.619  -9.324   0.095
  116   2HG2  THR  14          2HG2      THR  14  -7.005  -9.693  -0.930
  117   3HG2  THR  14          3HG2      THR  14  -5.369  -9.987  -1.521
  118    H    CYS  15           H        CYS  15  -3.148  -9.135  -0.164
  119    HA   CYS  15           HA       CYS  15  -1.848  -9.983  -2.722
  120   1HB   CYS  15          1HB       CYS  15   0.293 -10.076  -1.293
  121   2HB   CYS  15          2HB       CYS  15  -0.289  -8.470  -1.732
  122    H    TYR  16           H        TYR  16  -1.685 -12.212  -2.866
  123    HA   TYR  16           HA       TYR  16  -2.678 -13.810  -0.570
  124   1HB   TYR  16          1HB       TYR  16  -2.750 -13.899  -3.443
  125   2HB   TYR  16          2HB       TYR  16  -2.022 -15.391  -2.846
  126    HD1  TYR  16           HD1      TYR  16  -5.037 -13.259  -2.782
  127    HD2  TYR  16           HD2      TYR  16  -3.281 -16.957  -1.481
  128    HE1  TYR  16           HE1      TYR  16  -7.274 -14.080  -2.095
  129    HE2  TYR  16           HE2      TYR  16  -5.518 -17.778  -0.794
  130    HH   TYR  16           HH       TYR  16  -8.111 -15.858  -0.322
  131    H    LYS  17           H        LYS  17   0.305 -12.876  -1.985
  132    HA   LYS  17           HA       LYS  17   1.737 -15.275  -0.940
  133   1HB   LYS  17          1HB       LYS  17   2.381 -12.970  -2.782
  134   2HB   LYS  17          2HB       LYS  17   3.664 -13.988  -2.126
  135   1HG   LYS  17          1HG       LYS  17   1.317 -15.384  -3.315
  136   2HG   LYS  17          2HG       LYS  17   2.417 -14.574  -4.433
  137   1HD   LYS  17          1HD       LYS  17   3.246 -16.582  -2.315
  138   2HD   LYS  17          2HD       LYS  17   3.095 -16.924  -4.039
  139   1HE   LYS  17          1HE       LYS  17   4.744 -14.890  -4.316
  140   2HE   LYS  17          2HE       LYS  17   5.149 -15.240  -2.624
  141   1HZ   LYS  17          1HZ       LYS  17   5.151 -17.683  -3.489
  142   2HZ   LYS  17          2HZ       LYS  17   5.444 -16.953  -4.995
  143   3HZ   LYS  17          3HZ       LYS  17   6.523 -16.705  -3.710
  144    H    LEU  18           H        LEU  18   1.643 -14.805   1.340
  145    HA   LEU  18           HA       LEU  18   2.278 -12.252   2.482
  146   1HB   LEU  18          1HB       LEU  18   2.461 -15.085   3.551
  147   2HB   LEU  18          2HB       LEU  18   2.513 -13.630   4.552
  148    HG   LEU  18           HG       LEU  18   0.244 -14.512   2.758
  149   1HD1  LEU  18          1HD1      LEU  18   0.648 -14.362   5.747
  150   2HD1  LEU  18          2HD1      LEU  18  -0.966 -14.378   5.036
  151   3HD1  LEU  18          3HD1      LEU  18   0.123 -15.743   4.782
  152   1HD2  LEU  18          1HD2      LEU  18   0.795 -11.937   4.218
  153   2HD2  LEU  18          2HD2      LEU  18   0.202 -12.177   2.575
  154   3HD2  LEU  18          3HD2      LEU  18  -0.864 -12.470   3.946
  155    H    GLY  19           H        GLY  19   4.211 -11.296   2.775
  156   1HA   GLY  19          1HA       GLY  19   6.609 -11.798   3.612
  157   2HA   GLY  19          2HA       GLY  19   6.678 -12.894   2.230
  158    H    GLU  20           H        GLU  20   8.573 -11.300   1.789
  159    HA   GLU  20           HA       GLU  20   8.225  -8.610   1.031
  160   1HB   GLU  20          1HB       GLU  20  10.316 -10.143   1.194
  161   2HB   GLU  20          2HB       GLU  20   9.953 -10.574  -0.479
  162   1HG   GLU  20          1HG       GLU  20   9.946  -7.671   0.162
  163   2HG   GLU  20          2HG       GLU  20  11.517  -8.471   0.173
  164    H    ASN  21           H        ASN  21   6.115  -8.482  -0.017
  165    HA   ASN  21           HA       ASN  21   5.446  -9.957  -2.405
  166   1HB   ASN  21          1HB       ASN  21   4.121  -8.479  -0.593
  167   2HB   ASN  21          2HB       ASN  21   4.328  -7.247  -1.839
  168   1HD2  ASN  21          2HD2      ASN  21   2.865 -10.414  -1.167
  169   2HD2  ASN  21          1HD2      ASN  21   1.831 -10.413  -2.513
  170    H    ASP  22           H        ASP  22   7.400  -9.654  -3.750
  171    HA   ASP  22           HA       ASP  22   8.631  -7.290  -4.531
  172   1HB   ASP  22          1HB       ASP  22   8.272  -9.974  -5.507
  173   2HB   ASP  22          2HB       ASP  22   8.204  -8.856  -6.871
  174    H    PHE  23           H        PHE  23   5.422  -8.451  -5.432
  175    HA   PHE  23           HA       PHE  23   4.900  -6.697  -7.623
  176   1HB   PHE  23          1HB       PHE  23   3.604  -8.710  -6.365
  177   2HB   PHE  23          2HB       PHE  23   2.741  -7.337  -5.671
  178    HD1  PHE  23           HD1      PHE  23   3.655  -9.036  -8.835
  179    HD2  PHE  23           HD2      PHE  23   1.273  -5.971  -6.997
  180    HE1  PHE  23           HE1      PHE  23   2.361  -8.784 -10.934
  181    HE2  PHE  23           HE2      PHE  23  -0.022  -5.719  -9.096
  182    HZ   PHE  23           HZ       PHE  23   0.521  -7.125 -11.066
  183    H    CYS  24           H        CYS  24   3.823  -6.327  -4.220
  184    HA   CYS  24           HA       CYS  24   3.127  -3.542  -4.531
  185   1HB   CYS  24          1HB       CYS  24   2.596  -5.498  -2.749
  186   2HB   CYS  24          2HB       CYS  24   3.891  -4.675  -1.880
  187    H    ASN  25           H        ASN  25   6.016  -5.250  -3.331
  188    HA   ASN  25           HA       ASN  25   7.528  -3.165  -2.248
  189   1HB   ASN  25          1HB       ASN  25   8.013  -5.692  -2.658
  190   2HB   ASN  25          2HB       ASN  25   8.655  -5.166  -4.214
  191   1HD2  ASN  25          2HD2      ASN  25  10.758  -4.292  -4.233
  192   2HD2  ASN  25          1HD2      ASN  25  11.658  -3.949  -2.835
  193    H    ARG  26           H        ARG  26   6.897  -3.929  -5.650
  194    HA   ARG  26           HA       ARG  26   8.662  -1.885  -6.742
  195   1HB   ARG  26          1HB       ARG  26   7.264  -4.121  -7.622
  196   2HB   ARG  26          2HB       ARG  26   6.377  -2.785  -8.356
  197   1HG   ARG  26          1HG       ARG  26   9.100  -2.140  -8.674
  198   2HG   ARG  26          2HG       ARG  26   8.970  -3.853  -9.072
  199   1HD   ARG  26          1HD       ARG  26   6.755  -2.345 -10.205
  200   2HD   ARG  26          2HD       ARG  26   8.311  -1.711 -10.761
  201    HE   ARG  26           HE       ARG  26   7.142  -4.186 -11.584
  202   1HH1  ARG  26          1HH1      ARG  26  10.167  -2.939 -10.445
  203   2HH1  ARG  26          2HH1      ARG  26  11.071  -4.301 -11.008
  204   1HH2  ARG  26          1HH2      ARG  26   8.322  -5.931 -12.342
  205   2HH2  ARG  26          2HH2      ARG  26  10.035  -5.984 -12.090
  206    H    GLU  27           H        GLU  27   5.093  -2.203  -6.650
  207    HA   GLU  27           HA       GLU  27   4.400   0.381  -7.512
  208   1HB   GLU  27          1HB       GLU  27   3.223  -1.901  -6.205
  209   2HB   GLU  27          2HB       GLU  27   2.620  -0.430  -5.443
  210   1HG   GLU  27          1HG       GLU  27   1.514   0.257  -7.327
  211   2HG   GLU  27          2HG       GLU  27   2.733  -0.413  -8.412
  212    H    CYS  28           H        CYS  28   4.749  -0.722  -4.112
  213    HA   CYS  28           HA       CYS  28   4.403   1.733  -2.803
  214   1HB   CYS  28          1HB       CYS  28   4.749  -0.631  -1.891
  215   2HB   CYS  28          2HB       CYS  28   6.479  -0.357  -2.094
  216    H    LYS  29           H        LYS  29   7.505   0.343  -3.968
  217    HA   LYS  29           HA       LYS  29   9.307   2.326  -3.277
  218   1HB   LYS  29          1HB       LYS  29   8.933   0.424  -5.520
  219   2HB   LYS  29          2HB       LYS  29  10.072   1.734  -5.832
  220   1HG   LYS  29          1HG       LYS  29  11.387   1.157  -3.900
  221   2HG   LYS  29          2HG       LYS  29  10.168   0.011  -3.345
  222   1HD   LYS  29          1HD       LYS  29  11.481  -1.522  -4.403
  223   2HD   LYS  29          2HD       LYS  29  10.652  -0.946  -5.849
  224   1HE   LYS  29          1HE       LYS  29  12.516   0.127  -6.637
  225   2HE   LYS  29          2HE       LYS  29  12.998   0.673  -5.018
  226   1HZ   LYS  29          1HZ       LYS  29  13.054  -2.194  -5.695
  227   2HZ   LYS  29          2HZ       LYS  29  14.352  -1.196  -6.151
  228   3HZ   LYS  29          3HZ       LYS  29  13.942  -1.357  -4.513
  229    H    TRP  30           H        TRP  30   7.457   2.333  -6.356
  230    HA   TRP  30           HA       TRP  30   7.033   4.147  -7.834
  231   1HB   TRP  30          1HB       TRP  30   6.017   4.550  -5.113
  232   2HB   TRP  30          2HB       TRP  30   6.160   6.056  -6.017
  233    HD1  TRP  30           HD1      TRP  30   3.473   4.146  -5.264
  234    HE1  TRP  30           HE1      TRP  30   1.826   3.735  -7.203
  235    HE3  TRP  30           HE3      TRP  30   6.492   5.246  -9.237
  236    HZ2  TRP  30           HZ2      TRP  30   1.792   3.855 -10.059
  237    HZ3  TRP  30           HZ3      TRP  30   5.625   5.088 -11.554
  238    HH2  TRP  30           HH2      TRP  30   3.281   4.395 -11.970
  239    H    LYS  31           H        LYS  31   7.189   6.951  -7.261
  240    HA   LYS  31           HA       LYS  31  10.079   7.388  -6.630
  241   1HB   LYS  31          1HB       LYS  31   8.840   7.323  -9.199
  242   2HB   LYS  31          2HB       LYS  31   9.272   8.999  -8.863
  243   1HG   LYS  31          1HG       LYS  31  11.576   8.262  -8.282
  244   2HG   LYS  31          2HG       LYS  31  11.133   6.609  -8.711
  245   1HD   LYS  31          1HD       LYS  31  12.233   7.619 -10.624
  246   2HD   LYS  31          2HD       LYS  31  10.519   7.436 -11.002
  247   1HE   LYS  31          1HE       LYS  31  11.365   9.689 -11.653
  248   2HE   LYS  31          2HE       LYS  31  10.132   9.807 -10.383
  249   1HZ   LYS  31          1HZ       LYS  31  12.776   9.353  -9.355
  250   2HZ   LYS  31          2HZ       LYS  31  12.655  10.809 -10.216
  251   3HZ   LYS  31          3HZ       LYS  31  11.623  10.515  -8.899
  252    H    HIS  32           H        HIS  32   6.968   8.226  -5.932
  253    HA   HIS  32           HA       HIS  32   7.793  10.986  -5.125
  254   1HB   HIS  32          1HB       HIS  32   5.121  10.261  -6.347
  255   2HB   HIS  32          2HB       HIS  32   5.767  11.877  -6.059
  256    HD1  HIS  32           HD1      HIS  32   6.198   8.873  -8.301
  257    HD2  HIS  32           HD2      HIS  32   7.587  12.794  -8.018
  258    HE1  HIS  32           HE1      HIS  32   7.428   9.355 -10.462
  259    H    ILE  33           H        ILE  33   6.255   8.032  -4.279
  260    HA   ILE  33           HA       ILE  33   4.450   9.113  -2.256
  261    HB   ILE  33           HB       ILE  33   5.601   6.338  -2.693
  262   1HG1  ILE  33          1HG1      ILE  33   4.386   7.392  -4.655
  263   2HG1  ILE  33          2HG1      ILE  33   3.650   5.910  -4.043
  264   1HG2  ILE  33          1HG2      ILE  33   3.249   7.393  -1.105
  265   2HG2  ILE  33          2HG2      ILE  33   3.420   5.694  -1.545
  266   3HG2  ILE  33          3HG2      ILE  33   4.621   6.461  -0.507
  267   1HD1  ILE  33          1HD1      ILE  33   2.088   7.293  -2.674
  268   2HD1  ILE  33          2HD1      ILE  33   2.783   8.744  -3.397
  269   3HD1  ILE  33          3HD1      ILE  33   1.911   7.588  -4.404
  270    H    GLY  34           H        GLY  34   7.691   7.618  -2.246
  271   1HA   GLY  34          1HA       GLY  34   9.395   8.369  -0.663
  272   2HA   GLY  34          2HA       GLY  34   8.106   8.777   0.470
  273    H    GLY  35           H        GLY  35   7.128   5.935  -0.797
  274   1HA   GLY  35          1HA       GLY  35   7.600   4.422   1.561
  275   2HA   GLY  35          2HA       GLY  35   7.114   3.736   0.011
  276    H    SER  36           H        SER  36   9.772   4.297   2.162
  277    HA   SER  36           HA       SER  36  11.889   3.646   0.272
  278   1HB   SER  36          1HB       SER  36  13.116   4.391   2.025
  279   2HB   SER  36          2HB       SER  36  11.596   4.672   2.869
  280    HG   SER  36           HG       SER  36  13.309   2.427   2.954
  281    H    TYR  37           H        TYR  37   9.542   1.807   1.974
  282    HA   TYR  37           HA       TYR  37  10.603  -0.704   0.933
  283   1HB   TYR  37          1HB       TYR  37  11.888   0.056   3.119
  284   2HB   TYR  37          2HB       TYR  37  10.446  -0.554   3.930
  285    HD1  TYR  37           HD1      TYR  37   9.714  -2.942   3.525
  286    HD2  TYR  37           HD2      TYR  37  13.507  -1.431   2.191
  287    HE1  TYR  37           HE1      TYR  37  10.541  -5.263   3.251
  288    HE2  TYR  37           HE2      TYR  37  14.333  -3.752   1.913
  289    HH   TYR  37           HH       TYR  37  13.439  -5.995   1.582
  290    H    GLY  38           H        GLY  38   8.938  -2.205   0.805
  291   1HA   GLY  38          1HA       GLY  38   6.586  -1.965   2.554
  292   2HA   GLY  38          2HA       GLY  38   6.287  -1.644   0.847
  293    H    TYR  39           H        TYR  39   4.998  -3.775   2.011
  294    HA   TYR  39           HA       TYR  39   5.840  -5.976   0.337
  295   1HB   TYR  39          1HB       TYR  39   6.710  -7.447   2.020
  296   2HB   TYR  39          2HB       TYR  39   7.533  -5.906   2.246
  297    HD1  TYR  39           HD1      TYR  39   6.051  -4.194   3.784
  298    HD2  TYR  39           HD2      TYR  39   5.981  -8.486   3.962
  299    HE1  TYR  39           HE1      TYR  39   5.217  -4.083   6.117
  300    HE2  TYR  39           HE2      TYR  39   5.146  -8.374   6.297
  301    HH   TYR  39           HH       TYR  39   3.780  -5.779   7.633
  302    H    CYS  40           H        CYS  40   4.629  -8.110   1.550
  303    HA   CYS  40           HA       CYS  40   1.804  -7.183   1.739
  304   1HB   CYS  40          1HB       CYS  40   2.290  -8.819   0.042
  305   2HB   CYS  40          2HB       CYS  40   3.174  -9.826   1.188
  306    H    TYR  41           H        TYR  41   0.687  -7.341   3.636
  307    HA   TYR  41           HA       TYR  41   1.635  -9.187   5.774
  308   1HB   TYR  41          1HB       TYR  41   2.725  -6.942   6.026
  309   2HB   TYR  41          2HB       TYR  41   1.122  -6.213   6.131
  310    HD1  TYR  41           HD1      TYR  41   3.083  -9.025   7.668
  311    HD2  TYR  41           HD2      TYR  41   0.213  -5.882   8.245
  312    HE1  TYR  41           HE1      TYR  41   3.006  -9.541  10.092
  313    HE2  TYR  41           HE2      TYR  41   0.133  -6.399  10.669
  314    HH   TYR  41           HH       TYR  41   2.411  -8.221  12.235
  315    H    GLY  42           H        GLY  42  -0.186 -10.301   6.387
  316   1HA   GLY  42          1HA       GLY  42  -2.425 -10.707   6.985
  317   2HA   GLY  42          2HA       GLY  42  -2.628  -8.960   7.135
  318    H    PHE  43           H        PHE  43  -1.564 -10.696   4.239
  319    HA   PHE  43           HA       PHE  43  -2.508 -10.793   2.079
  320   1HB   PHE  43          1HB       PHE  43  -4.995 -10.601   3.809
  321   2HB   PHE  43          2HB       PHE  43  -4.994 -11.072   2.109
  322    HD1  PHE  43           HD1      PHE  43  -3.689 -13.117   1.395
  323    HD2  PHE  43           HD2      PHE  43  -4.408 -12.156   5.518
  324    HE1  PHE  43           HE1      PHE  43  -3.132 -15.446   2.035
  325    HE2  PHE  43           HE2      PHE  43  -3.852 -14.486   6.159
  326    HZ   PHE  43           HZ       PHE  43  -3.213 -16.131   4.416
  327    H    GLY  44           H        GLY  44  -1.635  -8.227   2.973
  328   1HA   GLY  44          1HA       GLY  44  -3.298  -6.524   1.238
  329   2HA   GLY  44          2HA       GLY  44  -3.182  -6.004   2.918
  330    H    CYS  45           H        CYS  45  -2.157  -4.131   1.470
  331    HA   CYS  45           HA       CYS  45   0.764  -4.689   1.103
  332   1HB   CYS  45          1HB       CYS  45  -1.316  -3.066  -0.245
  333   2HB   CYS  45          2HB       CYS  45   0.266  -2.298  -0.111
  334    H    TYR  46           H        TYR  46   1.936  -4.000   2.858
  335    HA   TYR  46           HA       TYR  46   1.029  -1.551   4.323
  336   1HB   TYR  46          1HB       TYR  46   1.436  -4.011   5.272
  337   2HB   TYR  46          2HB       TYR  46   3.110  -3.461   5.311
  338    HD1  TYR  46           HD1      TYR  46  -0.257  -1.970   6.072
  339    HD2  TYR  46           HD2      TYR  46   3.786  -2.614   7.380
  340    HE1  TYR  46           HE1      TYR  46  -0.731  -0.715   8.157
  341    HE2  TYR  46           HE2      TYR  46   3.308  -1.358   9.466
  342    HH   TYR  46           HH       TYR  46   0.763  -0.891  10.791
  343    H    CYS  47           H        CYS  47   2.292   0.260   4.031
  344    HA   CYS  47           HA       CYS  47   5.103  -0.133   3.051
  345   1HB   CYS  47          1HB       CYS  47   2.868   1.724   2.279
  346   2HB   CYS  47          2HB       CYS  47   4.540   2.216   2.012
  347    H    GLU  48           H        GLU  48   6.615   1.554   3.743
  348    HA   GLU  48           HA       GLU  48   5.726   3.019   6.209
  349   1HB   GLU  48          1HB       GLU  48   8.170   1.359   5.582
  350   2HB   GLU  48          2HB       GLU  48   8.190   2.549   6.884
  351   1HG   GLU  48          1HG       GLU  48   6.044   1.413   7.730
  352   2HG   GLU  48          2HG       GLU  48   6.447   0.097   6.627
  353    H    GLY  49           H        GLY  49   6.622   5.109   6.474
  354   1HA   GLY  49          1HA       GLY  49   8.124   6.917   5.902
  355   2HA   GLY  49          2HA       GLY  49   8.505   6.085   4.396
  356    H    LEU  50           H        LEU  50   5.308   6.812   5.749
  357    HA   LEU  50           HA       LEU  50   4.600   8.151   3.185
  358   1HB   LEU  50          1HB       LEU  50   2.784   7.395   5.479
  359   2HB   LEU  50          2HB       LEU  50   2.362   7.587   3.778
  360    HG   LEU  50           HG       LEU  50   4.103   5.405   4.967
  361   1HD1  LEU  50          1HD1      LEU  50   1.363   5.569   4.869
  362   2HD1  LEU  50          2HD1      LEU  50   1.727   4.743   3.354
  363   3HD1  LEU  50          3HD1      LEU  50   2.274   4.059   4.884
  364   1HD2  LEU  50          1HD2      LEU  50   3.371   6.074   2.101
  365   2HD2  LEU  50          2HD2      LEU  50   4.989   5.983   2.797
  366   3HD2  LEU  50          3HD2      LEU  50   4.032   4.516   2.596
  367    HA   PRO  51           HA       PRO  51   5.244  12.016   5.462
  368   1HB   PRO  51          1HB       PRO  51   3.939  13.294   3.198
  369   2HB   PRO  51          2HB       PRO  51   5.632  13.387   3.694
  370   1HG   PRO  51          1HG       PRO  51   4.581  11.996   1.450
  371   2HG   PRO  51          2HG       PRO  51   6.244  11.963   2.043
  372   1HD   PRO  51          1HD       PRO  51   4.268   9.849   2.151
  373   2HD   PRO  51          2HD       PRO  51   5.961   9.799   2.699
  374    H    ASP  52           H        ASP  52   3.743  13.683   6.310
  375    HA   ASP  52           HA       ASP  52   1.234  12.661   7.199
  376   1HB   ASP  52          1HB       ASP  52   2.773  15.193   7.231
  377   2HB   ASP  52          2HB       ASP  52   1.035  15.372   7.469
  378    H    SER  53           H        SER  53   2.108  14.492   4.323
  379    HA   SER  53           HA       SER  53  -0.648  15.254   3.689
  380   1HB   SER  53          1HB       SER  53   1.814  16.198   3.081
  381   2HB   SER  53          2HB       SER  53   1.494  15.249   1.632
  382    HG   SER  53           HG       SER  53   0.634  17.267   1.304
  383    H    THR  54           H        THR  54   0.758  12.287   3.668
  384    HA   THR  54           HA       THR  54  -0.359  11.441   1.035
  385    HB   THR  54           HB       THR  54   1.015   9.588   2.937
  386    HG1  THR  54           HG1      THR  54   2.728  11.076   1.411
  387   1HG2  THR  54          1HG2      THR  54   0.256   9.554   0.255
  388   2HG2  THR  54          2HG2      THR  54   1.997   9.831   0.201
  389   3HG2  THR  54          3HG2      THR  54   1.354   8.417   1.037
  390    H    GLN  55           H        GLN  55  -2.001   9.818   0.930
  391    HA   GLN  55           HA       GLN  55  -3.706   9.648   3.349
  392   1HB   GLN  55          1HB       GLN  55  -4.000   9.673   0.484
  393   2HB   GLN  55          2HB       GLN  55  -4.783   8.232   1.134
  394   1HG   GLN  55          1HG       GLN  55  -5.222  11.009   2.259
  395   2HG   GLN  55          2HG       GLN  55  -6.266  10.284   1.036
  396   1HE2  GLN  55          2HE2      GLN  55  -6.675   7.718   1.829
  397   2HE2  GLN  55          1HE2      GLN  55  -7.309   7.638   3.402
  398    H    THR  56           H        THR  56  -4.809   7.384   3.605
  399    HA   THR  56           HA       THR  56  -3.039   5.090   3.010
  400    HB   THR  56           HB       THR  56  -3.536   4.908   5.765
  401    HG1  THR  56           HG1      THR  56  -4.052   7.125   5.743
  402   1HG2  THR  56          1HG2      THR  56  -1.504   4.217   4.519
  403   2HG2  THR  56          2HG2      THR  56  -1.052   5.913   4.363
  404   3HG2  THR  56          3HG2      THR  56  -1.120   5.163   5.958
  405    H    TRP  57           H        TRP  57  -4.168   3.062   3.311
  406    HA   TRP  57           HA       TRP  57  -7.037   3.176   3.025
  407   1HB   TRP  57          1HB       TRP  57  -5.087   1.466   2.345
  408   2HB   TRP  57          2HB       TRP  57  -5.576   0.705   3.853
  409    HD1  TRP  57           HD1      TRP  57  -6.982   1.760   0.444
  410    HE1  TRP  57           HE1      TRP  57  -9.101   0.372  -0.041
  411    HE3  TRP  57           HE3      TRP  57  -7.447  -0.723   4.882
  412    HZ2  TRP  57           HZ2      TRP  57 -10.773  -1.534   1.279
  413    HZ3  TRP  57           HZ3      TRP  57  -9.311  -2.315   5.241
  414    HH2  TRP  57           HH2      TRP  57 -10.974  -2.723   3.448
  415    HA   PRO  58           HA       PRO  58  -8.771   1.942   3.424
  416   1HB   PRO  58          1HB       PRO  58 -11.037   3.011   4.741
  417   2HB   PRO  58          2HB       PRO  58 -10.643   1.304   4.525
  418   1HG   PRO  58          1HG       PRO  58 -10.582   2.862   6.961
  419   2HG   PRO  58          2HG       PRO  58 -10.316   1.128   6.758
  420   1HD   PRO  58          1HD       PRO  58  -8.349   3.177   7.298
  421   2HD   PRO  58          2HD       PRO  58  -8.083   1.426   7.110
  422    H    LEU  59           H        LEU  59 -10.515   3.586   2.451
  423    HA   LEU  59           HA       LEU  59  -9.190   6.248   2.378
  424   1HB   LEU  59          1HB       LEU  59 -10.773   6.373   0.261
  425   2HB   LEU  59          2HB       LEU  59  -9.280   5.460   0.194
  426    HG   LEU  59           HG       LEU  59 -11.379   4.371  -0.772
  427   1HD1  LEU  59          1HD1      LEU  59  -9.194   3.293   0.689
  428   2HD1  LEU  59          2HD1      LEU  59 -10.617   2.320   1.062
  429   3HD1  LEU  59          3HD1      LEU  59 -10.116   2.542  -0.614
  430   1HD2  LEU  59          1HD2      LEU  59 -12.056   4.307   2.166
  431   2HD2  LEU  59          2HD2      LEU  59 -13.065   4.810   0.819
  432   3HD2  LEU  59          3HD2      LEU  59 -12.687   3.105   1.053
  433    HA   PRO  60           HA       PRO  60 -12.399   8.665   4.121
  434   1HB   PRO  60          1HB       PRO  60 -13.149   9.973   1.623
  435   2HB   PRO  60          2HB       PRO  60 -12.326  10.651   3.032
  436   1HG   PRO  60          1HG       PRO  60 -11.166  10.027   0.518
  437   2HG   PRO  60          2HG       PRO  60 -10.321  10.537   1.982
  438   1HD   PRO  60          1HD       PRO  60 -10.271   7.950   0.732
  439   2HD   PRO  60          2HD       PRO  60  -9.437   8.453   2.217
  440    H    ASN  61           H        ASN  61 -14.811   9.564   3.117
  441    HA   ASN  61           HA       ASN  61 -16.570   7.396   3.358
  442   1HB   ASN  61          1HB       ASN  61 -16.828  10.039   1.892
  443   2HB   ASN  61          2HB       ASN  61 -18.197   9.003   2.305
  444   1HD2  ASN  61          2HD2      ASN  61 -15.759  11.182   3.640
  445   2HD2  ASN  61          1HD2      ASN  61 -16.409  11.242   5.207
  446    H    LYS  62           H        LYS  62 -14.758   8.434   0.573
  447    HA   LYS  62           HA       LYS  62 -16.405   7.072  -1.414
  448   1HB   LYS  62          1HB       LYS  62 -14.434   8.981  -1.388
  449   2HB   LYS  62          2HB       LYS  62 -13.543   7.570  -1.959
  450   1HG   LYS  62          1HG       LYS  62 -16.144   7.762  -3.246
  451   2HG   LYS  62          2HG       LYS  62 -15.192   9.226  -3.502
  452   1HD   LYS  62          1HD       LYS  62 -13.313   7.241  -3.859
  453   2HD   LYS  62          2HD       LYS  62 -14.764   6.509  -4.546
  454   1HE   LYS  62          1HE       LYS  62 -14.344   7.725  -6.420
  455   2HE   LYS  62          2HE       LYS  62 -14.789   9.164  -5.482
  456   1HZ   LYS  62          1HZ       LYS  62 -12.337   8.698  -4.554
  457   2HZ   LYS  62          2HZ       LYS  62 -12.153   8.136  -6.148
  458   3HZ   LYS  62          3HZ       LYS  62 -12.652   9.732  -5.865
  459    H    THR  63           H        THR  63 -16.583   4.904  -0.466
  460    HA   THR  63           HA       THR  63 -14.246   3.296   0.122
  461    HB   THR  63           HB       THR  63 -17.006   2.298  -0.584
  462    HG1  THR  63           HG1      THR  63 -17.779   3.253   1.114
  463   1HG2  THR  63          1HG2      THR  63 -14.929   1.452   1.456
  464   2HG2  THR  63          2HG2      THR  63 -16.490   0.672   1.203
  465   3HG2  THR  63          3HG2      THR  63 -15.267   0.633  -0.068
  466    H    CYS  64           H        CYS  64 -13.749   1.260  -1.093
  467    HA   CYS  64           HA       CYS  64 -13.175   1.755  -3.857
  468   1HB   CYS  64          1HB       CYS  64 -11.838   0.283  -2.484
  469   2HB   CYS  64          2HB       CYS  64 -13.236  -0.722  -2.111
  Start of MODEL   28
    1   1H    LYS   1          1H        LYS   1   4.168   6.761  10.632
    2   2H    LYS   1          2H        LYS   1   4.313   8.433  10.874
    3   3H    LYS   1          3H        LYS   1   2.813   7.767  10.437
    4    HA   LYS   1           HA       LYS   1   3.500   8.570   8.410
    5   1HB   LYS   1          1HB       LYS   1   6.067   8.225   7.899
    6   2HB   LYS   1          2HB       LYS   1   5.558   9.519   8.982
    7   1HG   LYS   1          1HG       LYS   1   6.440   8.503  10.826
    8   2HG   LYS   1          2HG       LYS   1   6.007   6.887  10.268
    9   1HD   LYS   1          1HD       LYS   1   8.057   8.238   8.633
   10   2HD   LYS   1          2HD       LYS   1   8.558   7.870  10.285
   11   1HE   LYS   1          1HE       LYS   1   7.109   5.622   9.162
   12   2HE   LYS   1          2HE       LYS   1   8.479   6.065   8.126
   13   1HZ   LYS   1          1HZ       LYS   1   8.711   5.903  11.075
   14   2HZ   LYS   1          2HZ       LYS   1   9.007   4.564  10.076
   15   3HZ   LYS   1          3HZ       LYS   1   9.962   5.961   9.927
   16    H    ASP   2           H        ASP   2   2.973   5.745   9.552
   17    HA   ASP   2           HA       ASP   2   3.894   4.200   7.139
   18   1HB   ASP   2          1HB       ASP   2   3.149   3.079   9.854
   19   2HB   ASP   2          2HB       ASP   2   4.106   2.311   8.588
   20    H    GLY   3           H        GLY   3   2.199   3.143   5.992
   21   1HA   GLY   3          1HA       GLY   3  -0.395   2.675   7.246
   22   2HA   GLY   3          2HA       GLY   3  -0.427   4.007   6.094
   23    H    TYR   4           H        TYR   4  -2.019   2.421   5.078
   24    HA   TYR   4           HA       TYR   4  -0.716   0.210   3.570
   25   1HB   TYR   4          1HB       TYR   4  -3.561   1.076   4.118
   26   2HB   TYR   4          2HB       TYR   4  -3.168  -0.243   3.016
   27    HD1  TYR   4           HD1      TYR   4  -2.187  -2.330   3.836
   28    HD2  TYR   4           HD2      TYR   4  -3.186   0.872   6.522
   29    HE1  TYR   4           HE1      TYR   4  -1.969  -3.877   5.762
   30    HE2  TYR   4           HE2      TYR   4  -2.968  -0.676   8.449
   31    HH   TYR   4           HH       TYR   4  -1.966  -2.749   9.038
   32    H    LEU   5           H        LEU   5  -1.525  -0.006   1.228
   33    HA   LEU   5           HA       LEU   5  -1.492   2.693  -0.083
   34   1HB   LEU   5          1HB       LEU   5  -0.620  -0.014  -1.150
   35   2HB   LEU   5          2HB       LEU   5  -0.341   1.554  -1.908
   36    HG   LEU   5           HG       LEU   5   0.679   0.905   0.862
   37   1HD1  LEU   5          1HD1      LEU   5   1.595  -0.710  -0.807
   38   2HD1  LEU   5          2HD1      LEU   5   2.170   0.653  -1.769
   39   3HD1  LEU   5          3HD1      LEU   5   2.831   0.369  -0.159
   40   1HD2  LEU   5          1HD2      LEU   5   0.543   3.249  -0.715
   41   2HD2  LEU   5          2HD2      LEU   5   1.432   3.029   0.793
   42   3HD2  LEU   5          3HD2      LEU   5   2.230   2.735  -0.753
   43    H    VAL   6           H        VAL   6  -2.945   3.001  -1.871
   44    HA   VAL   6           HA       VAL   6  -5.223   1.057  -1.918
   45    HB   VAL   6           HB       VAL   6  -6.579   2.957  -2.455
   46   1HG1  VAL   6          1HG1      VAL   6  -4.425   3.686  -0.454
   47   2HG1  VAL   6          2HG1      VAL   6  -5.924   4.594  -0.652
   48   3HG1  VAL   6          3HG1      VAL   6  -5.974   2.915  -0.117
   49   1HG2  VAL   6          1HG2      VAL   6  -3.947   4.116  -3.274
   50   2HG2  VAL   6          2HG2      VAL   6  -5.517   4.221  -4.072
   51   3HG2  VAL   6          3HG2      VAL   6  -5.175   5.227  -2.664
   52    H    GLU   7           H        GLU   7  -6.429   1.787  -4.256
   53    HA   GLU   7           HA       GLU   7  -4.380   1.462  -6.409
   54   1HB   GLU   7          1HB       GLU   7  -6.451  -0.405  -5.438
   55   2HB   GLU   7          2HB       GLU   7  -6.420  -0.201  -7.190
   56   1HG   GLU   7          1HG       GLU   7  -4.889  -1.961  -6.776
   57   2HG   GLU   7          2HG       GLU   7  -3.873  -0.538  -7.006
   58    H    LYS   8           H        LYS   8  -5.914   1.333  -8.603
   59    HA   LYS   8           HA       LYS   8  -6.815   3.906  -9.184
   60   1HB   LYS   8          1HB       LYS   8  -7.427   1.145 -10.197
   61   2HB   LYS   8          2HB       LYS   8  -8.307   2.518 -10.870
   62   1HG   LYS   8          1HG       LYS   8  -5.852   3.551 -11.020
   63   2HG   LYS   8          2HG       LYS   8  -5.403   1.846 -11.070
   64   1HD   LYS   8          1HD       LYS   8  -6.053   1.696 -13.215
   65   2HD   LYS   8          2HD       LYS   8  -7.664   2.283 -12.798
   66   1HE   LYS   8          1HE       LYS   8  -5.608   4.398 -12.805
   67   2HE   LYS   8          2HE       LYS   8  -5.893   3.657 -14.393
   68   1HZ   LYS   8          1HZ       LYS   8  -8.054   4.559 -12.565
   69   2HZ   LYS   8          2HZ       LYS   8  -7.467   5.485 -13.857
   70   3HZ   LYS   8          3HZ       LYS   8  -8.232   3.999 -14.159
   71    H    THR   9           H        THR   9  -8.948   1.142  -8.324
   72    HA   THR   9           HA       THR   9 -11.346   2.695  -8.098
   73    HB   THR   9           HB       THR   9 -11.809   0.572  -6.510
   74    HG1  THR   9           HG1      THR   9 -10.298  -0.895  -6.636
   75   1HG2  THR   9          1HG2      THR   9 -11.837   1.074  -9.382
   76   2HG2  THR   9          2HG2      THR   9 -11.639  -0.639  -9.014
   77   3HG2  THR   9          3HG2      THR   9 -13.027   0.245  -8.378
   78    H    GLY  10           H        GLY  10  -8.647   2.221  -5.947
   79   1HA   GLY  10          1HA       GLY  10  -8.229   3.692  -4.068
   80   2HA   GLY  10          2HA       GLY  10  -9.964   3.999  -3.962
   81    H    CYS  11           H        CYS  11  -9.063   0.715  -4.441
   82    HA   CYS  11           HA       CYS  11  -9.914   0.104  -1.651
   83   1HB   CYS  11          1HB       CYS  11  -9.511  -1.735  -4.029
   84   2HB   CYS  11          2HB       CYS  11 -10.448  -2.065  -2.572
   85    H    LYS  12           H        LYS  12  -8.631  -1.320  -0.335
   86    HA   LYS  12           HA       LYS  12  -5.809  -0.974  -0.416
   87   1HB   LYS  12          1HB       LYS  12  -5.933  -2.917   1.247
   88   2HB   LYS  12          2HB       LYS  12  -6.949  -1.525   1.619
   89   1HG   LYS  12          1HG       LYS  12  -8.913  -2.624   1.022
   90   2HG   LYS  12          2HG       LYS  12  -8.077  -3.750  -0.048
   91   1HD   LYS  12          1HD       LYS  12  -8.182  -5.236   1.648
   92   2HD   LYS  12          2HD       LYS  12  -6.951  -4.256   2.446
   93   1HE   LYS  12          1HE       LYS  12  -9.084  -2.805   3.157
   94   2HE   LYS  12          2HE       LYS  12  -9.894  -4.371   2.955
   95   1HZ   LYS  12          1HZ       LYS  12  -7.320  -4.156   4.391
   96   2HZ   LYS  12          2HZ       LYS  12  -8.790  -3.888   5.201
   97   3HZ   LYS  12          3HZ       LYS  12  -8.484  -5.391   4.477
   98    H    LYS  13           H        LYS  13  -4.506  -3.295  -0.206
   99    HA   LYS  13           HA       LYS  13  -5.085  -4.838  -2.715
  100   1HB   LYS  13          1HB       LYS  13  -3.210  -3.021  -2.690
  101   2HB   LYS  13          2HB       LYS  13  -2.315  -4.183  -1.710
  102   1HG   LYS  13          1HG       LYS  13  -3.243  -5.772  -3.751
  103   2HG   LYS  13          2HG       LYS  13  -2.942  -4.247  -4.586
  104   1HD   LYS  13          1HD       LYS  13  -0.657  -4.195  -3.563
  105   2HD   LYS  13          2HD       LYS  13  -0.967  -5.793  -2.883
  106   1HE   LYS  13          1HE       LYS  13  -1.308  -6.703  -5.161
  107   2HE   LYS  13          2HE       LYS  13  -0.979  -5.099  -5.844
  108   1HZ   LYS  13          1HZ       LYS  13   1.078  -5.374  -4.170
  109   2HZ   LYS  13          2HZ       LYS  13   0.849  -6.997  -4.619
  110   3HZ   LYS  13          3HZ       LYS  13   1.144  -5.818  -5.806
  111    H    THR  14           H        THR  14  -5.916  -6.656  -1.548
  112    HA   THR  14           HA       THR  14  -4.505  -7.771   0.749
  113    HB   THR  14           HB       THR  14  -6.792  -8.629  -1.034
  114    HG1  THR  14           HG1      THR  14  -7.390  -8.383   1.530
  115   1HG2  THR  14          1HG2      THR  14  -5.611 -10.048   1.370
  116   2HG2  THR  14          2HG2      THR  14  -7.185 -10.426   0.668
  117   3HG2  THR  14          3HG2      THR  14  -5.716 -10.671  -0.277
  118    H    CYS  15           H        CYS  15  -3.664 -10.020   0.739
  119    HA   CYS  15           HA       CYS  15  -2.849 -11.190  -1.843
  120   1HB   CYS  15          1HB       CYS  15  -0.492 -10.864  -1.476
  121   2HB   CYS  15          2HB       CYS  15  -1.258  -9.292  -1.246
  122    H    TYR  16           H        TYR  16  -2.758 -13.405  -1.570
  123    HA   TYR  16           HA       TYR  16  -3.251 -14.566   1.053
  124   1HB   TYR  16          1HB       TYR  16  -2.980 -15.411  -1.788
  125   2HB   TYR  16          2HB       TYR  16  -2.673 -16.654  -0.573
  126    HD1  TYR  16           HD1      TYR  16  -4.446 -16.347   1.544
  127    HD2  TYR  16           HD2      TYR  16  -5.162 -15.408  -2.585
  128    HE1  TYR  16           HE1      TYR  16  -6.885 -16.593   1.913
  129    HE2  TYR  16           HE2      TYR  16  -7.604 -15.653  -2.218
  130    HH   TYR  16           HH       TYR  16  -9.082 -15.472   0.490
  131    H    LYS  17           H        LYS  17  -0.434 -13.704  -0.730
  132    HA   LYS  17           HA       LYS  17   1.290 -15.568   0.838
  133   1HB   LYS  17          1HB       LYS  17   1.250 -14.925  -1.793
  134   2HB   LYS  17          2HB       LYS  17   2.384 -13.706  -1.210
  135   1HG   LYS  17          1HG       LYS  17   3.359 -15.855   0.091
  136   2HG   LYS  17          2HG       LYS  17   2.673 -16.665  -1.317
  137   1HD   LYS  17          1HD       LYS  17   4.154 -14.222  -1.996
  138   2HD   LYS  17          2HD       LYS  17   5.157 -15.456  -1.235
  139   1HE   LYS  17          1HE       LYS  17   3.907 -17.071  -2.931
  140   2HE   LYS  17          2HE       LYS  17   3.685 -15.566  -3.846
  141   1HZ   LYS  17          1HZ       LYS  17   6.215 -15.315  -3.030
  142   2HZ   LYS  17          2HZ       LYS  17   6.128 -17.002  -3.215
  143   3HZ   LYS  17          3HZ       LYS  17   5.778 -15.982  -4.528
  144    H    LEU  18           H        LEU  18   1.168 -14.413   2.872
  145    HA   LEU  18           HA       LEU  18   1.774 -11.583   3.091
  146   1HB   LEU  18          1HB       LEU  18   1.543 -13.958   4.938
  147   2HB   LEU  18          2HB       LEU  18   2.078 -12.396   5.558
  148    HG   LEU  18           HG       LEU  18  -0.507 -12.883   4.046
  149   1HD1  LEU  18          1HD1      LEU  18   0.175 -12.615   6.970
  150   2HD1  LEU  18          2HD1      LEU  18  -1.419 -12.154   6.372
  151   3HD1  LEU  18          3HD1      LEU  18  -0.851 -13.814   6.181
  152   1HD2  LEU  18          1HD2      LEU  18   1.012 -10.522   4.468
  153   2HD2  LEU  18          2HD2      LEU  18  -0.626 -10.643   3.826
  154   3HD2  LEU  18          3HD2      LEU  18  -0.370 -10.436   5.558
  155    H    GLY  19           H        GLY  19   3.770 -10.646   3.799
  156   1HA   GLY  19          1HA       GLY  19   6.082 -11.208   4.740
  157   2HA   GLY  19          2HA       GLY  19   6.138 -12.447   3.486
  158    H    GLU  20           H        GLU  20   8.141 -11.164   2.908
  159    HA   GLU  20           HA       GLU  20   8.034  -8.508   1.864
  160   1HB   GLU  20          1HB       GLU  20  10.130  -9.509   2.402
  161   2HB   GLU  20          2HB       GLU  20   9.793 -10.927   1.411
  162   1HG   GLU  20          1HG       GLU  20   9.608  -8.554  -0.215
  163   2HG   GLU  20          2HG       GLU  20  11.156  -8.571   0.630
  164    H    ASN  21           H        ASN  21   5.800  -8.980   0.698
  165    HA   ASN  21           HA       ASN  21   5.877 -10.473  -1.794
  166   1HB   ASN  21          1HB       ASN  21   3.965  -9.454  -0.114
  167   2HB   ASN  21          2HB       ASN  21   3.903  -8.295  -1.443
  168   1HD2  ASN  21          2HD2      ASN  21   2.006 -10.618  -0.624
  169   2HD2  ASN  21          1HD2      ASN  21   1.816 -11.497  -2.064
  170    H    ASP  22           H        ASP  22   7.703  -9.612  -2.937
  171    HA   ASP  22           HA       ASP  22   8.596  -7.092  -3.444
  172   1HB   ASP  22          1HB       ASP  22   8.679  -9.623  -4.659
  173   2HB   ASP  22          2HB       ASP  22   8.230  -8.510  -5.952
  174    H    PHE  23           H        PHE  23   5.823  -8.525  -5.228
  175    HA   PHE  23           HA       PHE  23   5.141  -6.511  -6.976
  176   1HB   PHE  23          1HB       PHE  23   3.895  -8.705  -5.669
  177   2HB   PHE  23          2HB       PHE  23   2.772  -7.348  -5.567
  178    HD1  PHE  23           HD1      PHE  23   4.752  -9.454  -7.895
  179    HD2  PHE  23           HD2      PHE  23   1.693  -6.462  -7.519
  180    HE1  PHE  23           HE1      PHE  23   4.166  -9.749 -10.287
  181    HE2  PHE  23           HE2      PHE  23   1.108  -6.757  -9.910
  182    HZ   PHE  23           HZ       PHE  23   2.345  -8.400 -11.294
  183    H    CYS  24           H        CYS  24   4.798  -6.420  -3.465
  184    HA   CYS  24           HA       CYS  24   3.151  -4.039  -3.361
  185   1HB   CYS  24          1HB       CYS  24   3.706  -5.948  -1.634
  186   2HB   CYS  24          2HB       CYS  24   5.069  -4.910  -1.215
  187    H    ASN  25           H        ASN  25   6.646  -4.568  -2.722
  188    HA   ASN  25           HA       ASN  25   7.421  -1.911  -2.285
  189   1HB   ASN  25          1HB       ASN  25   9.324  -3.107  -2.049
  190   2HB   ASN  25          2HB       ASN  25   8.572  -4.478  -2.852
  191   1HD2  ASN  25          2HD2      ASN  25  10.025  -5.170  -4.429
  192   2HD2  ASN  25          1HD2      ASN  25  10.829  -4.152  -5.523
  193    H    ARG  26           H        ARG  26   7.056  -3.605  -5.407
  194    HA   ARG  26           HA       ARG  26   7.983  -1.500  -7.099
  195   1HB   ARG  26          1HB       ARG  26   6.495  -4.023  -7.252
  196   2HB   ARG  26          2HB       ARG  26   6.014  -2.872  -8.498
  197   1HG   ARG  26          1HG       ARG  26   7.830  -4.135  -9.409
  198   2HG   ARG  26          2HG       ARG  26   8.488  -2.552  -8.995
  199   1HD   ARG  26          1HD       ARG  26   8.857  -3.914  -6.646
  200   2HD   ARG  26          2HD       ARG  26   9.108  -5.201  -7.838
  201    HE   ARG  26           HE       ARG  26  10.916  -3.038  -7.309
  202   1HH1  ARG  26          1HH1      ARG  26   9.458  -4.701  -9.971
  203   2HH1  ARG  26          2HH1      ARG  26  10.581  -4.079 -11.129
  204   1HH2  ARG  26          1HH2      ARG  26  12.384  -2.247  -8.814
  205   2HH2  ARG  26          2HH2      ARG  26  12.234  -2.703 -10.478
  206    H    GLU  27           H        GLU  27   4.672  -2.312  -6.006
  207    HA   GLU  27           HA       GLU  27   3.318  -0.227  -7.403
  208   1HB   GLU  27          1HB       GLU  27   2.527  -2.355  -6.101
  209   2HB   GLU  27          2HB       GLU  27   2.489  -1.276  -4.706
  210   1HG   GLU  27          1HG       GLU  27   0.718  -0.061  -5.518
  211   2HG   GLU  27          2HG       GLU  27   1.215  -0.265  -7.198
  212    H    CYS  28           H        CYS  28   4.390  -0.312  -3.970
  213    HA   CYS  28           HA       CYS  28   3.599   2.251  -3.176
  214   1HB   CYS  28          1HB       CYS  28   4.985   0.196  -2.095
  215   2HB   CYS  28          2HB       CYS  28   6.310   1.330  -2.365
  216    H    LYS  29           H        LYS  29   6.543   1.331  -4.970
  217    HA   LYS  29           HA       LYS  29   7.968   3.733  -4.991
  218   1HB   LYS  29          1HB       LYS  29   7.792   1.299  -6.480
  219   2HB   LYS  29          2HB       LYS  29   7.925   2.628  -7.634
  220   1HG   LYS  29          1HG       LYS  29   9.783   3.430  -5.863
  221   2HG   LYS  29          2HG       LYS  29   9.879   1.689  -5.592
  222   1HD   LYS  29          1HD       LYS  29   9.743   2.327  -8.432
  223   2HD   LYS  29          2HD       LYS  29  11.122   3.105  -7.653
  224   1HE   LYS  29          1HE       LYS  29  11.257   0.619  -6.527
  225   2HE   LYS  29          2HE       LYS  29  10.624   0.227  -8.137
  226   1HZ   LYS  29          1HZ       LYS  29  12.354   1.638  -9.102
  227   2HZ   LYS  29          2HZ       LYS  29  12.993   1.925  -7.554
  228   3HZ   LYS  29          3HZ       LYS  29  13.027   0.360  -8.209
  229    H    TRP  30           H        TRP  30   4.877   3.067  -6.428
  230    HA   TRP  30           HA       TRP  30   4.468   4.655  -8.576
  231   1HB   TRP  30          1HB       TRP  30   2.978   3.936  -6.157
  232   2HB   TRP  30          2HB       TRP  30   2.386   5.417  -6.911
  233    HD1  TRP  30           HD1      TRP  30   1.417   2.088  -6.959
  234    HE1  TRP  30           HE1      TRP  30   0.560   1.277  -9.251
  235    HE3  TRP  30           HE3      TRP  30   3.317   5.759  -9.957
  236    HZ2  TRP  30           HZ2      TRP  30   0.668   2.082 -11.996
  237    HZ3  TRP  30           HZ3      TRP  30   2.925   5.714 -12.403
  238    HH2  TRP  30           HH2      TRP  30   1.605   3.881 -13.426
  239    H    LYS  31           H        LYS  31   5.385   6.609  -9.042
  240    HA   LYS  31           HA       LYS  31   5.967   8.886  -8.855
  241   1HB   LYS  31          1HB       LYS  31   3.502   8.432  -7.230
  242   2HB   LYS  31          2HB       LYS  31   4.294  10.001  -7.091
  243   1HG   LYS  31          1HG       LYS  31   3.589   8.740  -9.752
  244   2HG   LYS  31          2HG       LYS  31   2.519   9.855  -8.901
  245   1HD   LYS  31          1HD       LYS  31   5.276  10.837  -9.104
  246   2HD   LYS  31          2HD       LYS  31   4.509  10.596 -10.673
  247   1HE   LYS  31          1HE       LYS  31   3.730  12.733 -10.229
  248   2HE   LYS  31          2HE       LYS  31   2.467  11.817  -9.385
  249   1HZ   LYS  31          1HZ       LYS  31   4.474  11.859  -7.580
  250   2HZ   LYS  31          2HZ       LYS  31   4.627  13.392  -8.293
  251   3HZ   LYS  31          3HZ       LYS  31   3.157  12.927  -7.579
  252    H    HIS  32           H        HIS  32   6.279  10.647  -6.920
  253    HA   HIS  32           HA       HIS  32   8.581   9.910  -5.456
  254   1HB   HIS  32          1HB       HIS  32   7.461  12.192  -6.088
  255   2HB   HIS  32          2HB       HIS  32   6.621  12.011  -4.548
  256    HD1  HIS  32           HD1      HIS  32   8.393  11.400  -2.465
  257    HD2  HIS  32           HD2      HIS  32   9.909  13.419  -5.783
  258    HE1  HIS  32           HE1      HIS  32  10.562  12.473  -1.721
  259    H    ILE  33           H        ILE  33   8.870   9.436  -3.210
  260    HA   ILE  33           HA       ILE  33   6.533   8.970  -1.493
  261    HB   ILE  33           HB       ILE  33   6.419   6.911  -2.579
  262   1HG1  ILE  33          1HG1      ILE  33   8.483   5.817  -0.801
  263   2HG1  ILE  33          2HG1      ILE  33   7.358   6.908   0.009
  264   1HG2  ILE  33          1HG2      ILE  33   9.177   7.471  -3.254
  265   2HG2  ILE  33          2HG2      ILE  33   8.988   5.799  -2.732
  266   3HG2  ILE  33          3HG2      ILE  33   8.022   6.418  -4.070
  267   1HD1  ILE  33          1HD1      ILE  33   6.452   4.645  -1.786
  268   2HD1  ILE  33          2HD1      ILE  33   6.643   4.471  -0.041
  269   3HD1  ILE  33          3HD1      ILE  33   5.464   5.610  -0.690
  270    H    GLY  34           H        GLY  34   9.791   7.522  -1.483
  271   1HA   GLY  34          1HA       GLY  34  11.634   8.616  -0.209
  272   2HA   GLY  34          2HA       GLY  34  10.409   9.173   0.931
  273    H    GLY  35           H        GLY  35   8.935   6.680   0.987
  274   1HA   GLY  35          1HA       GLY  35  10.541   5.290   2.979
  275   2HA   GLY  35          2HA       GLY  35   8.920   4.830   2.458
  276    H    SER  36           H        SER  36  11.219   3.059   2.839
  277    HA   SER  36           HA       SER  36  11.395   1.975   0.053
  278   1HB   SER  36          1HB       SER  36  13.763   1.257   1.210
  279   2HB   SER  36          2HB       SER  36  13.551   2.707   0.234
  280    HG   SER  36           HG       SER  36  13.696   3.889   1.976
  281    H    TYR  37           H        TYR  37   9.763   1.307   2.589
  282    HA   TYR  37           HA       TYR  37  10.556  -1.582   2.694
  283   1HB   TYR  37          1HB       TYR  37  10.685   0.386   4.736
  284   2HB   TYR  37          2HB       TYR  37   9.339  -0.679   5.145
  285    HD1  TYR  37           HD1      TYR  37   9.964  -3.290   4.434
  286    HD2  TYR  37           HD2      TYR  37  12.702  -0.241   5.720
  287    HE1  TYR  37           HE1      TYR  37  11.561  -5.036   5.172
  288    HE2  TYR  37           HE2      TYR  37  14.300  -1.988   6.459
  289    HH   TYR  37           HH       TYR  37  13.486  -5.124   6.953
  290    H    GLY  38           H        GLY  38   8.873  -2.408   1.455
  291   1HA   GLY  38          1HA       GLY  38   6.117  -1.873   2.476
  292   2HA   GLY  38          2HA       GLY  38   6.443  -1.895   0.741
  293    H    TYR  39           H        TYR  39   5.355  -3.773   3.255
  294    HA   TYR  39           HA       TYR  39   5.844  -6.257   1.668
  295   1HB   TYR  39          1HB       TYR  39   6.451  -7.423   3.739
  296   2HB   TYR  39          2HB       TYR  39   7.508  -6.028   3.520
  297    HD1  TYR  39           HD1      TYR  39   6.656  -3.778   4.604
  298    HD2  TYR  39           HD2      TYR  39   5.346  -7.696   5.777
  299    HE1  TYR  39           HE1      TYR  39   5.916  -2.875   6.791
  300    HE2  TYR  39           HE2      TYR  39   4.608  -6.794   7.966
  301    HH   TYR  39           HH       TYR  39   4.042  -3.713   8.586
  302    H    CYS  40           H        CYS  40   4.180  -7.892   2.069
  303    HA   CYS  40           HA       CYS  40   1.551  -6.783   2.489
  304   1HB   CYS  40          1HB       CYS  40   2.813  -9.171   1.547
  305   2HB   CYS  40          2HB       CYS  40   1.591  -9.631   2.733
  306    H    TYR  41           H        TYR  41   0.214  -6.908   4.306
  307    HA   TYR  41           HA       TYR  41   1.123  -8.423   6.695
  308   1HB   TYR  41          1HB       TYR  41   2.231  -6.281   6.925
  309   2HB   TYR  41          2HB       TYR  41   0.752  -5.416   6.509
  310    HD1  TYR  41           HD1      TYR  41  -1.321  -5.861   8.046
  311    HD2  TYR  41           HD2      TYR  41   2.741  -6.682   9.179
  312    HE1  TYR  41           HE1      TYR  41  -1.983  -5.836  10.436
  313    HE2  TYR  41           HE2      TYR  41   2.078  -6.655  11.570
  314    HH   TYR  41           HH       TYR  41  -0.956  -6.968  12.642
  315    H    GLY  42           H        GLY  42  -0.649  -9.118   7.914
  316   1HA   GLY  42          1HA       GLY  42  -2.921  -9.640   8.270
  317   2HA   GLY  42          2HA       GLY  42  -3.123  -7.888   8.265
  318    H    PHE  43           H        PHE  43  -2.188 -10.086   5.618
  319    HA   PHE  43           HA       PHE  43  -3.128 -10.347   3.470
  320   1HB   PHE  43          1HB       PHE  43  -5.449  -9.931   5.348
  321   2HB   PHE  43          2HB       PHE  43  -5.733 -10.157   3.621
  322    HD1  PHE  43           HD1      PHE  43  -4.484 -11.726   6.716
  323    HD2  PHE  43           HD2      PHE  43  -5.212 -12.275   2.517
  324    HE1  PHE  43           HE1      PHE  43  -4.179 -14.173   6.982
  325    HE2  PHE  43           HE2      PHE  43  -4.905 -14.722   2.785
  326    HZ   PHE  43           HZ       PHE  43  -4.389 -15.671   5.017
  327    H    GLY  44           H        GLY  44  -1.908  -8.035   3.445
  328   1HA   GLY  44          1HA       GLY  44  -3.369  -6.359   1.672
  329   2HA   GLY  44          2HA       GLY  44  -3.427  -5.634   3.281
  330    H    CYS  45           H        CYS  45  -2.102  -4.267   1.264
  331    HA   CYS  45           HA       CYS  45   0.795  -4.859   1.593
  332   1HB   CYS  45          1HB       CYS  45  -0.968  -3.676  -0.385
  333   2HB   CYS  45          2HB       CYS  45   0.377  -2.593  -0.025
  334    H    TYR  46           H        TYR  46   2.052  -3.653   2.961
  335    HA   TYR  46           HA       TYR  46   0.929  -1.074   4.010
  336   1HB   TYR  46          1HB       TYR  46   0.934  -3.186   5.496
  337   2HB   TYR  46          2HB       TYR  46   2.688  -3.010   5.524
  338    HD1  TYR  46           HD1      TYR  46  -0.460  -1.071   6.126
  339    HD2  TYR  46           HD2      TYR  46   3.698  -1.578   7.078
  340    HE1  TYR  46           HE1      TYR  46  -0.655   0.653   7.899
  341    HE2  TYR  46           HE2      TYR  46   3.503   0.145   8.853
  342    HH   TYR  46           HH       TYR  46   0.750   2.178   9.141
  343    H    CYS  47           H        CYS  47   2.360   0.656   3.916
  344    HA   CYS  47           HA       CYS  47   5.204   0.039   3.179
  345   1HB   CYS  47          1HB       CYS  47   3.134   1.545   1.879
  346   2HB   CYS  47          2HB       CYS  47   4.428   2.651   2.346
  347    H    GLU  48           H        GLU  48   6.764   1.050   4.424
  348    HA   GLU  48           HA       GLU  48   5.801   3.041   6.454
  349   1HB   GLU  48          1HB       GLU  48   8.068   1.084   6.846
  350   2HB   GLU  48          2HB       GLU  48   7.119   1.920   8.076
  351   1HG   GLU  48          1HG       GLU  48   5.100   0.626   7.264
  352   2HG   GLU  48          2HG       GLU  48   6.198  -0.324   6.262
  353    H    GLY  49           H        GLY  49   7.435   4.612   7.112
  354   1HA   GLY  49          1HA       GLY  49   9.686   5.583   6.828
  355   2HA   GLY  49          2HA       GLY  49   9.742   4.856   5.222
  356    H    LEU  50           H        LEU  50   7.556   5.553   3.974
  357    HA   LEU  50           HA       LEU  50   7.841   8.193   3.119
  358   1HB   LEU  50          1HB       LEU  50   5.280   7.828   2.544
  359   2HB   LEU  50          2HB       LEU  50   6.507   6.827   1.772
  360    HG   LEU  50           HG       LEU  50   5.648   5.741   4.348
  361   1HD1  LEU  50          1HD1      LEU  50   3.619   6.620   2.383
  362   2HD1  LEU  50          2HD1      LEU  50   3.469   4.945   2.914
  363   3HD1  LEU  50          3HD1      LEU  50   3.441   6.251   4.098
  364   1HD2  LEU  50          1HD2      LEU  50   6.936   4.713   2.315
  365   2HD2  LEU  50          2HD2      LEU  50   5.758   3.714   3.167
  366   3HD2  LEU  50          3HD2      LEU  50   5.326   4.474   1.636
  367    HA   PRO  51           HA       PRO  51   6.402  10.596   6.575
  368   1HB   PRO  51          1HB       PRO  51   5.691  12.769   4.829
  369   2HB   PRO  51          2HB       PRO  51   7.136  12.609   5.831
  370   1HG   PRO  51          1HG       PRO  51   6.966  12.452   2.980
  371   2HG   PRO  51          2HG       PRO  51   8.399  12.243   3.989
  372   1HD   PRO  51          1HD       PRO  51   6.922  10.215   2.539
  373   2HD   PRO  51          2HD       PRO  51   8.409  10.018   3.499
  374    H    ASP  52           H        ASP  52   4.327  11.740   7.236
  375    HA   ASP  52           HA       ASP  52   2.002  10.223   6.545
  376   1HB   ASP  52          1HB       ASP  52   2.817  12.139   8.425
  377   2HB   ASP  52          2HB       ASP  52   1.461  12.890   7.582
  378    H    SER  53           H        SER  53   3.467  13.008   5.063
  379    HA   SER  53           HA       SER  53   1.345  14.345   3.835
  380   1HB   SER  53          1HB       SER  53   3.492  15.203   3.473
  381   2HB   SER  53          2HB       SER  53   4.159  13.625   3.067
  382    HG   SER  53           HG       SER  53   2.743  15.448   1.501
  383    H    THR  54           H        THR  54   2.748  11.203   2.971
  384    HA   THR  54           HA       THR  54   1.318  10.917   0.467
  385    HB   THR  54           HB       THR  54   2.976   9.271   2.330
  386    HG1  THR  54           HG1      THR  54   3.702   8.783  -0.011
  387   1HG2  THR  54          1HG2      THR  54   0.892   8.160   0.505
  388   2HG2  THR  54          2HG2      THR  54   2.465   7.363   0.528
  389   3HG2  THR  54          3HG2      THR  54   1.528   7.507   2.015
  390    H    GLN  55           H        GLN  55  -0.668   9.877   0.092
  391    HA   GLN  55           HA       GLN  55  -2.424   9.540   2.465
  392   1HB   GLN  55          1HB       GLN  55  -2.638  10.438  -0.251
  393   2HB   GLN  55          2HB       GLN  55  -3.743   9.082  -0.025
  394   1HG   GLN  55          1HG       GLN  55  -3.751  10.962   2.226
  395   2HG   GLN  55          2HG       GLN  55  -4.263  11.697   0.706
  396   1HE2  GLN  55          2HE2      GLN  55  -5.046   9.150   3.056
  397   2HE2  GLN  55          1HE2      GLN  55  -6.609   8.850   2.468
  398    H    THR  56           H        THR  56  -3.096   7.524   3.147
  399    HA   THR  56           HA       THR  56  -2.428   5.181   1.400
  400    HB   THR  56           HB       THR  56  -2.229   4.124   3.810
  401    HG1  THR  56           HG1      THR  56  -1.685   6.858   4.298
  402   1HG2  THR  56          1HG2      THR  56  -0.432   5.151   1.952
  403   2HG2  THR  56          2HG2      THR  56   0.069   5.890   3.473
  404   3HG2  THR  56          3HG2      THR  56  -0.021   4.135   3.334
  405    H    TRP  57           H        TRP  57  -3.713   3.171   2.380
  406    HA   TRP  57           HA       TRP  57  -6.548   3.739   2.083
  407   1HB   TRP  57          1HB       TRP  57  -5.094   1.678   1.440
  408   2HB   TRP  57          2HB       TRP  57  -5.273   1.204   3.126
  409    HD1  TRP  57           HD1      TRP  57  -7.210   1.530  -0.115
  410    HE1  TRP  57           HE1      TRP  57  -9.536   0.459   0.179
  411    HE3  TRP  57           HE3      TRP  57  -7.155   0.668   4.918
  412    HZ2  TRP  57           HZ2      TRP  57 -11.157  -0.622   2.270
  413    HZ3  TRP  57           HZ3      TRP  57  -9.102  -0.382   6.034
  414    HH2  TRP  57           HH2      TRP  57 -11.102  -1.027   4.719
  415    HA   PRO  58           HA       PRO  58  -8.405   3.031   2.551
  416   1HB   PRO  58          1HB       PRO  58 -10.491   4.433   3.827
  417   2HB   PRO  58          2HB       PRO  58 -10.321   2.678   3.721
  418   1HG   PRO  58          1HG       PRO  58 -10.025   4.381   6.049
  419   2HG   PRO  58          2HG       PRO  58 -10.023   2.617   5.966
  420   1HD   PRO  58          1HD       PRO  58  -7.763   4.380   6.359
  421   2HD   PRO  58          2HD       PRO  58  -7.768   2.600   6.304
  422    H    LEU  59           H        LEU  59  -9.866   4.881   1.498
  423    HA   LEU  59           HA       LEU  59  -8.204   7.360   1.424
  424   1HB   LEU  59          1HB       LEU  59  -9.879   5.749  -0.436
  425   2HB   LEU  59          2HB       LEU  59  -9.867   7.489  -0.712
  426    HG   LEU  59           HG       LEU  59  -7.352   5.829  -0.393
  427   1HD1  LEU  59          1HD1      LEU  59  -9.016   6.510  -2.795
  428   2HD1  LEU  59          2HD1      LEU  59  -7.262   6.430  -2.964
  429   3HD1  LEU  59          3HD1      LEU  59  -8.162   5.014  -2.419
  430   1HD2  LEU  59          1HD2      LEU  59  -7.248   8.293   0.107
  431   2HD2  LEU  59          2HD2      LEU  59  -6.237   7.808  -1.253
  432   3HD2  LEU  59          3HD2      LEU  59  -7.784   8.602  -1.545
  433    HA   PRO  60           HA       PRO  60 -11.226  10.158   3.000
  434   1HB   PRO  60          1HB       PRO  60 -11.777  11.433   0.434
  435   2HB   PRO  60          2HB       PRO  60 -10.945  12.086   1.849
  436   1HG   PRO  60          1HG       PRO  60  -9.752  11.302  -0.588
  437   2HG   PRO  60          2HG       PRO  60  -8.915  11.719   0.910
  438   1HD   PRO  60          1HD       PRO  60  -9.162   9.117  -0.338
  439   2HD   PRO  60          2HD       PRO  60  -8.255   9.547   1.130
  440    H    ASN  61           H        ASN  61 -13.466  11.299   1.797
  441    HA   ASN  61           HA       ASN  61 -15.502   9.403   2.129
  442   1HB   ASN  61          1HB       ASN  61 -15.586  11.950   1.993
  443   2HB   ASN  61          2HB       ASN  61 -15.577  11.768   0.237
  444   1HD2  ASN  61          2HD2      ASN  61 -17.602  11.747   3.023
  445   2HD2  ASN  61          1HD2      ASN  61 -19.011  11.177   2.267
  446    H    LYS  62           H        LYS  62 -13.600  10.141  -0.742
  447    HA   LYS  62           HA       LYS  62 -15.303   8.428  -2.455
  448   1HB   LYS  62          1HB       LYS  62 -14.161  10.647  -3.085
  449   2HB   LYS  62          2HB       LYS  62 -12.652   9.732  -3.114
  450   1HG   LYS  62          1HG       LYS  62 -13.197   9.301  -5.279
  451   2HG   LYS  62          2HG       LYS  62 -14.311   8.117  -4.593
  452   1HD   LYS  62          1HD       LYS  62 -16.157   9.578  -4.760
  453   2HD   LYS  62          2HD       LYS  62 -15.126  10.998  -4.944
  454   1HE   LYS  62          1HE       LYS  62 -14.935  10.696  -7.196
  455   2HE   LYS  62          2HE       LYS  62 -14.710   8.944  -7.026
  456   1HZ   LYS  62          1HZ       LYS  62 -17.300  10.338  -6.606
  457   2HZ   LYS  62          2HZ       LYS  62 -16.865   9.570  -8.058
  458   3HZ   LYS  62          3HZ       LYS  62 -17.034   8.659  -6.637
  459    H    THR  63           H        THR  63 -14.356   6.853  -0.441
  460    HA   THR  63           HA       THR  63 -11.820   5.571  -1.260
  461    HB   THR  63           HB       THR  63 -12.414   5.969   1.112
  462    HG1  THR  63           HG1      THR  63 -11.218   4.055   0.352
  463   1HG2  THR  63          1HG2      THR  63 -14.770   4.240   0.362
  464   2HG2  THR  63          2HG2      THR  63 -14.239   4.408   2.035
  465   3HG2  THR  63          3HG2      THR  63 -14.780   5.825   1.136
  466    H    CYS  64           H        CYS  64 -12.330   2.936  -0.711
  467    HA   CYS  64           HA       CYS  64 -13.480   1.948  -3.144
  468   1HB   CYS  64          1HB       CYS  64 -11.753   0.930  -1.526
  469   2HB   CYS  64          2HB       CYS  64 -13.136   0.424  -0.555
  Start of MODEL   29
    1   1H    LYS   1          1H        LYS   1   4.797   8.215   6.970
    2   2H    LYS   1          2H        LYS   1   4.705   9.295   8.277
    3   3H    LYS   1          3H        LYS   1   5.499   7.809   8.463
    4    HA   LYS   1           HA       LYS   1   3.376   7.599   9.509
    5   1HB   LYS   1          1HB       LYS   1   2.731   9.607   7.841
    6   2HB   LYS   1          2HB       LYS   1   1.996   8.273   6.952
    7   1HG   LYS   1          1HG       LYS   1   1.346   7.911   9.697
    8   2HG   LYS   1          2HG       LYS   1   1.015   9.597   9.296
    9   1HD   LYS   1          1HD       LYS   1  -0.928   8.075   8.847
   10   2HD   LYS   1          2HD       LYS   1  -0.367   8.935   7.412
   11   1HE   LYS   1          1HE       LYS   1   0.584   7.016   6.468
   12   2HE   LYS   1          2HE       LYS   1   0.762   6.214   8.041
   13   1HZ   LYS   1          1HZ       LYS   1  -1.909   6.752   7.861
   14   2HZ   LYS   1          2HZ       LYS   1  -1.502   6.267   6.285
   15   3HZ   LYS   1          3HZ       LYS   1  -1.182   5.240   7.595
   16    H    ASP   2           H        ASP   2   3.014   5.420   9.577
   17    HA   ASP   2           HA       ASP   2   3.517   3.749   7.196
   18   1HB   ASP   2          1HB       ASP   2   2.563   2.940   9.955
   19   2HB   ASP   2          2HB       ASP   2   3.482   1.970   8.803
   20    H    GLY   3           H        GLY   3   1.872   2.919   5.916
   21   1HA   GLY   3          1HA       GLY   3  -0.849   2.672   7.039
   22   2HA   GLY   3          2HA       GLY   3  -0.674   3.788   5.686
   23    H    TYR   4           H        TYR   4  -2.309   2.004   4.921
   24    HA   TYR   4           HA       TYR   4  -0.859  -0.325   3.748
   25   1HB   TYR   4          1HB       TYR   4  -3.597   0.284   4.721
   26   2HB   TYR   4          2HB       TYR   4  -3.495  -0.788   3.323
   27    HD1  TYR   4           HD1      TYR   4  -2.098  -2.881   3.458
   28    HD2  TYR   4           HD2      TYR   4  -2.946  -0.453   6.900
   29    HE1  TYR   4           HE1      TYR   4  -1.447  -4.758   4.944
   30    HE2  TYR   4           HE2      TYR   4  -2.293  -2.330   8.383
   31    HH   TYR   4           HH       TYR   4  -1.085  -4.334   8.384
   32    H    LEU   5           H        LEU   5  -1.301  -0.851   1.487
   33    HA   LEU   5           HA       LEU   5  -1.435   1.534  -0.221
   34   1HB   LEU   5          1HB       LEU   5  -0.481  -1.191  -0.283
   35   2HB   LEU   5          2HB       LEU   5  -1.456  -0.873  -1.718
   36    HG   LEU   5           HG       LEU   5   0.912   0.751  -0.747
   37   1HD1  LEU   5          1HD1      LEU   5   0.501  -1.404  -2.712
   38   2HD1  LEU   5          2HD1      LEU   5   1.350   0.000  -3.357
   39   3HD1  LEU   5          3HD1      LEU   5   1.990  -0.849  -1.950
   40   1HD2  LEU   5          1HD2      LEU   5  -1.175   1.231  -2.868
   41   2HD2  LEU   5          2HD2      LEU   5  -0.527   2.363  -1.680
   42   3HD2  LEU   5          3HD2      LEU   5   0.455   1.877  -3.063
   43    H    VAL   6           H        VAL   6  -3.002   1.790  -1.947
   44    HA   VAL   6           HA       VAL   6  -5.610   0.403  -1.417
   45    HB   VAL   6           HB       VAL   6  -6.641   2.482  -2.143
   46   1HG1  VAL   6          1HG1      VAL   6  -4.309   2.903  -0.252
   47   2HG1  VAL   6          2HG1      VAL   6  -5.619   4.064  -0.472
   48   3HG1  VAL   6          3HG1      VAL   6  -5.960   2.461   0.181
   49   1HG2  VAL   6          1HG2      VAL   6  -4.123   2.815  -3.472
   50   2HG2  VAL   6          2HG2      VAL   6  -5.582   3.792  -3.638
   51   3HG2  VAL   6          3HG2      VAL   6  -4.381   4.203  -2.414
   52    H    GLU   7           H        GLU   7  -6.952   1.053  -3.721
   53    HA   GLU   7           HA       GLU   7  -5.248  -0.112  -5.909
   54   1HB   GLU   7          1HB       GLU   7  -6.867  -1.692  -4.855
   55   2HB   GLU   7          2HB       GLU   7  -8.181  -0.601  -5.297
   56   1HG   GLU   7          1HG       GLU   7  -7.850  -0.957  -7.617
   57   2HG   GLU   7          2HG       GLU   7  -6.255  -1.665  -7.364
   58    H    LYS   8           H        LYS   8  -6.144   0.387  -8.132
   59    HA   LYS   8           HA       LYS   8  -6.365   3.065  -8.767
   60   1HB   LYS   8          1HB       LYS   8  -6.225   1.042 -10.290
   61   2HB   LYS   8          2HB       LYS   8  -7.963   0.841 -10.076
   62   1HG   LYS   8          1HG       LYS   8  -8.271   3.195 -10.907
   63   2HG   LYS   8          2HG       LYS   8  -6.546   3.235 -11.278
   64   1HD   LYS   8          1HD       LYS   8  -6.759   1.819 -13.069
   65   2HD   LYS   8          2HD       LYS   8  -8.059   0.896 -12.315
   66   1HE   LYS   8          1HE       LYS   8  -9.671   2.663 -12.812
   67   2HE   LYS   8          2HE       LYS   8  -8.380   3.695 -13.460
   68   1HZ   LYS   8          1HZ       LYS   8  -8.450   1.003 -14.522
   69   2HZ   LYS   8          2HZ       LYS   8  -9.787   1.955 -14.944
   70   3HZ   LYS   8          3HZ       LYS   8  -8.217   2.481 -15.326
   71    H    THR   9           H        THR   9  -9.005   0.918  -7.739
   72    HA   THR   9           HA       THR   9 -11.013   3.062  -7.985
   73    HB   THR   9           HB       THR   9 -12.387   1.123  -6.891
   74    HG1  THR   9           HG1      THR   9 -11.097  -0.878  -7.564
   75   1HG2  THR   9          1HG2      THR   9 -11.176   1.313  -9.602
   76   2HG2  THR   9          2HG2      THR   9 -12.000  -0.193  -9.199
   77   3HG2  THR   9          3HG2      THR   9 -12.873   1.338  -9.124
   78    H    GLY  10           H        GLY  10  -9.096   1.494  -5.482
   79   1HA   GLY  10          1HA       GLY  10  -8.700   3.174  -3.555
   80   2HA   GLY  10          2HA       GLY  10 -10.459   3.183  -3.430
   81    H    CYS  11           H        CYS  11 -10.544   0.242  -4.103
   82    HA   CYS  11           HA       CYS  11 -10.603  -0.793  -1.455
   83   1HB   CYS  11          1HB       CYS  11 -10.664  -1.850  -4.250
   84   2HB   CYS  11          2HB       CYS  11 -10.453  -3.010  -2.938
   85    H    LYS  12           H        LYS  12  -9.203  -2.603  -0.626
   86    HA   LYS  12           HA       LYS  12  -6.420  -1.867  -0.592
   87   1HB   LYS  12          1HB       LYS  12  -8.184  -4.040   0.465
   88   2HB   LYS  12          2HB       LYS  12  -6.438  -4.282   0.537
   89   1HG   LYS  12          1HG       LYS  12  -6.108  -2.429   1.939
   90   2HG   LYS  12          2HG       LYS  12  -7.644  -1.693   1.485
   91   1HD   LYS  12          1HD       LYS  12  -7.623  -2.722   3.795
   92   2HD   LYS  12          2HD       LYS  12  -8.888  -3.341   2.731
   93   1HE   LYS  12          1HE       LYS  12  -8.087  -5.425   3.127
   94   2HE   LYS  12          2HE       LYS  12  -6.611  -4.962   2.258
   95   1HZ   LYS  12          1HZ       LYS  12  -6.217  -3.707   4.555
   96   2HZ   LYS  12          2HZ       LYS  12  -7.127  -5.023   5.124
   97   3HZ   LYS  12          3HZ       LYS  12  -5.683  -5.296   4.279
   98    H    LYS  13           H        LYS  13  -4.937  -4.125  -0.756
   99    HA   LYS  13           HA       LYS  13  -5.393  -5.308  -3.466
  100   1HB   LYS  13          1HB       LYS  13  -3.722  -3.182  -2.999
  101   2HB   LYS  13          2HB       LYS  13  -2.617  -4.541  -2.794
  102   1HG   LYS  13          1HG       LYS  13  -2.842  -5.240  -4.989
  103   2HG   LYS  13          2HG       LYS  13  -4.467  -4.571  -5.145
  104   1HD   LYS  13          1HD       LYS  13  -3.211  -2.266  -4.820
  105   2HD   LYS  13          2HD       LYS  13  -1.818  -3.188  -5.386
  106   1HE   LYS  13          1HE       LYS  13  -4.463  -2.835  -6.842
  107   2HE   LYS  13          2HE       LYS  13  -2.880  -2.205  -7.337
  108   1HZ   LYS  13          1HZ       LYS  13  -2.073  -4.548  -7.275
  109   2HZ   LYS  13          2HZ       LYS  13  -3.683  -5.052  -7.073
  110   3HZ   LYS  13          3HZ       LYS  13  -3.214  -4.243  -8.492
  111    H    THR  14           H        THR  14  -5.979  -7.059  -1.736
  112    HA   THR  14           HA       THR  14  -4.286  -8.332   0.043
  113    HB   THR  14           HB       THR  14  -5.959  -9.741  -2.051
  114    HG1  THR  14           HG1      THR  14  -6.735  -8.330   0.281
  115   1HG2  THR  14          1HG2      THR  14  -4.522 -10.821  -0.040
  116   2HG2  THR  14          2HG2      THR  14  -6.008 -10.445   0.833
  117   3HG2  THR  14          3HG2      THR  14  -6.060 -11.494  -0.584
  118    H    CYS  15           H        CYS  15  -2.685 -10.010  -0.132
  119    HA   CYS  15           HA       CYS  15  -1.609 -10.588  -2.854
  120   1HB   CYS  15          1HB       CYS  15   0.585  -9.867  -2.229
  121   2HB   CYS  15          2HB       CYS  15  -0.499  -8.582  -1.702
  122    H    TYR  16           H        TYR  16  -0.504 -12.612  -2.959
  123    HA   TYR  16           HA       TYR  16  -1.103 -14.450  -0.702
  124   1HB   TYR  16          1HB       TYR  16  -0.512 -14.615  -3.631
  125   2HB   TYR  16          2HB       TYR  16  -0.161 -16.031  -2.640
  126    HD1  TYR  16           HD1      TYR  16  -2.888 -13.468  -2.430
  127    HD2  TYR  16           HD2      TYR  16  -1.862 -17.599  -2.996
  128    HE1  TYR  16           HE1      TYR  16  -5.295 -14.064  -2.445
  129    HE2  TYR  16           HE2      TYR  16  -4.270 -18.196  -3.013
  130    HH   TYR  16           HH       TYR  16  -6.566 -16.537  -3.659
  131    H    LYS  17           H        LYS  17   0.987 -12.746   0.018
  132    HA   LYS  17           HA       LYS  17   3.151 -14.632   0.474
  133   1HB   LYS  17          1HB       LYS  17   3.139 -12.931  -1.885
  134   2HB   LYS  17          2HB       LYS  17   4.547 -12.603  -0.874
  135   1HG   LYS  17          1HG       LYS  17   4.579 -15.291  -0.775
  136   2HG   LYS  17          2HG       LYS  17   3.811 -15.082  -2.349
  137   1HD   LYS  17          1HD       LYS  17   6.150 -15.144  -2.797
  138   2HD   LYS  17          2HD       LYS  17   5.702 -13.440  -2.888
  139   1HE   LYS  17          1HE       LYS  17   6.357 -14.093  -0.153
  140   2HE   LYS  17          2HE       LYS  17   7.688 -14.584  -1.220
  141   1HZ   LYS  17          1HZ       LYS  17   7.513 -12.412  -2.321
  142   2HZ   LYS  17          2HZ       LYS  17   6.331 -11.941  -1.195
  143   3HZ   LYS  17          3HZ       LYS  17   7.919 -12.260  -0.681
  144    H    LEU  18           H        LEU  18   3.196 -14.021   2.649
  145    HA   LEU  18           HA       LEU  18   3.160 -11.195   3.446
  146   1HB   LEU  18          1HB       LEU  18   3.587 -13.818   4.914
  147   2HB   LEU  18          2HB       LEU  18   3.429 -12.254   5.715
  148    HG   LEU  18           HG       LEU  18   1.344 -13.428   3.853
  149   1HD1  LEU  18          1HD1      LEU  18   1.804 -14.614   6.123
  150   2HD1  LEU  18          2HD1      LEU  18   1.089 -13.171   6.844
  151   3HD1  LEU  18          3HD1      LEU  18   0.143 -14.166   5.736
  152   1HD2  LEU  18          1HD2      LEU  18   1.735 -10.815   4.566
  153   2HD2  LEU  18          2HD2      LEU  18   0.160 -11.504   4.175
  154   3HD2  LEU  18          3HD2      LEU  18   0.668 -11.361   5.858
  155    H    GLY  19           H        GLY  19   4.968 -10.059   4.313
  156   1HA   GLY  19          1HA       GLY  19   7.328 -10.144   5.134
  157   2HA   GLY  19          2HA       GLY  19   7.612 -11.409   3.939
  158    H    GLU  20           H        GLU  20   9.373  -9.889   3.280
  159    HA   GLU  20           HA       GLU  20   8.847  -7.319   2.123
  160   1HB   GLU  20          1HB       GLU  20  11.080  -7.842   0.984
  161   2HB   GLU  20          2HB       GLU  20  11.075  -7.970   2.743
  162   1HG   GLU  20          1HG       GLU  20  11.539 -10.178   2.667
  163   2HG   GLU  20          2HG       GLU  20  10.261 -10.469   1.487
  164    H    ASN  21           H        ASN  21   6.740  -8.299   1.023
  165    HA   ASN  21           HA       ASN  21   7.071  -9.857  -1.395
  166   1HB   ASN  21          1HB       ASN  21   5.025  -9.373   0.192
  167   2HB   ASN  21          2HB       ASN  21   4.788  -7.972  -0.856
  168   1HD2  ASN  21          2HD2      ASN  21   2.905 -10.155  -0.781
  169   2HD2  ASN  21          1HD2      ASN  21   2.943 -10.932  -2.289
  170    H    ASP  22           H        ASP  22   8.688  -8.750  -2.649
  171    HA   ASP  22           HA       ASP  22   9.047  -6.113  -3.300
  172   1HB   ASP  22          1HB       ASP  22   9.387  -8.714  -4.580
  173   2HB   ASP  22          2HB       ASP  22   9.156  -7.426  -5.763
  174    H    PHE  23           H        PHE  23   6.341  -8.134  -4.353
  175    HA   PHE  23           HA       PHE  23   5.284  -6.590  -6.452
  176   1HB   PHE  23          1HB       PHE  23   4.577  -8.795  -4.964
  177   2HB   PHE  23          2HB       PHE  23   3.328  -7.634  -4.509
  178    HD1  PHE  23           HD1      PHE  23   3.043  -6.022  -6.950
  179    HD2  PHE  23           HD2      PHE  23   3.539 -10.265  -6.495
  180    HE1  PHE  23           HE1      PHE  23   1.907  -6.388  -9.124
  181    HE2  PHE  23           HE2      PHE  23   2.402 -10.631  -8.669
  182    HZ   PHE  23           HZ       PHE  23   1.585  -8.692  -9.983
  183    H    CYS  24           H        CYS  24   4.639  -6.236  -2.938
  184    HA   CYS  24           HA       CYS  24   3.005  -3.863  -3.286
  185   1HB   CYS  24          1HB       CYS  24   4.488  -4.990  -0.887
  186   2HB   CYS  24          2HB       CYS  24   3.177  -3.811  -0.825
  187    H    ASN  25           H        ASN  25   6.418  -4.472  -2.464
  188    HA   ASN  25           HA       ASN  25   7.215  -1.838  -1.797
  189   1HB   ASN  25          1HB       ASN  25   8.547  -3.937  -1.575
  190   2HB   ASN  25          2HB       ASN  25   8.722  -3.986  -3.330
  191   1HD2  ASN  25          2HD2      ASN  25  10.890  -3.644  -1.295
  192   2HD2  ASN  25          1HD2      ASN  25  11.635  -2.163  -1.660
  193    H    ARG  26           H        ARG  26   7.453  -3.449  -4.995
  194    HA   ARG  26           HA       ARG  26   8.238  -1.142  -6.473
  195   1HB   ARG  26          1HB       ARG  26   7.448  -3.883  -6.879
  196   2HB   ARG  26          2HB       ARG  26   6.650  -2.870  -8.082
  197   1HG   ARG  26          1HG       ARG  26   8.583  -2.502  -9.185
  198   2HG   ARG  26          2HG       ARG  26   9.438  -2.103  -7.694
  199   1HD   ARG  26          1HD       ARG  26   9.038  -4.846  -7.480
  200   2HD   ARG  26          2HD       ARG  26   9.418  -4.620  -9.196
  201    HE   ARG  26           HE       ARG  26  11.293  -4.401  -7.050
  202   1HH1  ARG  26          1HH1      ARG  26  10.289  -2.667  -9.877
  203   2HH1  ARG  26          2HH1      ARG  26  11.706  -1.680  -9.917
  204   1HH2  ARG  26          1HH2      ARG  26  13.146  -3.132  -7.128
  205   2HH2  ARG  26          2HH2      ARG  26  13.318  -1.945  -8.377
  206    H    GLU  27           H        GLU  27   5.008  -2.480  -5.757
  207    HA   GLU  27           HA       GLU  27   3.466  -0.698  -7.363
  208   1HB   GLU  27          1HB       GLU  27   3.011  -2.862  -5.806
  209   2HB   GLU  27          2HB       GLU  27   2.430  -1.599  -4.721
  210   1HG   GLU  27          1HG       GLU  27   0.503  -1.607  -5.890
  211   2HG   GLU  27          2HG       GLU  27   1.404  -0.906  -7.236
  212    H    CYS  28           H        CYS  28   4.091  -0.517  -3.833
  213    HA   CYS  28           HA       CYS  28   3.044   2.179  -3.605
  214   1HB   CYS  28          1HB       CYS  28   2.945   0.734  -1.716
  215   2HB   CYS  28          2HB       CYS  28   4.642   0.286  -1.873
  216    H    LYS  29           H        LYS  29   6.216   0.820  -4.289
  217    HA   LYS  29           HA       LYS  29   7.475   3.497  -3.895
  218   1HB   LYS  29          1HB       LYS  29   8.236   1.062  -3.057
  219   2HB   LYS  29          2HB       LYS  29   9.031   1.067  -4.632
  220   1HG   LYS  29          1HG       LYS  29  10.298   3.004  -4.114
  221   2HG   LYS  29          2HG       LYS  29   9.278   3.399  -2.731
  222   1HD   LYS  29          1HD       LYS  29  10.257   0.783  -2.271
  223   2HD   LYS  29          2HD       LYS  29  11.634   1.741  -2.815
  224   1HE   LYS  29          1HE       LYS  29  11.757   2.651  -0.744
  225   2HE   LYS  29          2HE       LYS  29  10.160   3.378  -1.007
  226   1HZ   LYS  29          1HZ       LYS  29   9.454   0.869  -0.577
  227   2HZ   LYS  29          2HZ       LYS  29  10.866   0.905   0.369
  228   3HZ   LYS  29          3HZ       LYS  29   9.606   1.996   0.685
  229    H    TRP  30           H        TRP  30   5.790   3.227  -6.208
  230    HA   TRP  30           HA       TRP  30   7.470   2.616  -8.527
  231   1HB   TRP  30          1HB       TRP  30   4.703   3.295  -7.889
  232   2HB   TRP  30          2HB       TRP  30   5.269   4.154  -9.322
  233    HD1  TRP  30           HD1      TRP  30   3.403   1.284  -8.786
  234    HE1  TRP  30           HE1      TRP  30   3.896  -0.619 -10.455
  235    HE3  TRP  30           HE3      TRP  30   7.907   2.856 -10.608
  236    HZ2  TRP  30           HZ2      TRP  30   5.935  -1.373 -12.319
  237    HZ3  TRP  30           HZ3      TRP  30   9.102   1.528 -12.325
  238    HH2  TRP  30           HH2      TRP  30   8.123  -0.581 -13.181
  239    H    LYS  31           H        LYS  31   8.852   4.052  -9.504
  240    HA   LYS  31           HA       LYS  31   9.944   6.084 -10.011
  241   1HB   LYS  31          1HB       LYS  31   7.282   7.250  -9.127
  242   2HB   LYS  31          2HB       LYS  31   8.466   8.017 -10.185
  243   1HG   LYS  31          1HG       LYS  31   7.956   6.656 -11.982
  244   2HG   LYS  31          2HG       LYS  31   7.441   5.316 -10.957
  245   1HD   LYS  31          1HD       LYS  31   5.562   6.492 -12.185
  246   2HD   LYS  31          2HD       LYS  31   5.362   6.408 -10.435
  247   1HE   LYS  31          1HE       LYS  31   5.662   8.680 -10.158
  248   2HE   LYS  31          2HE       LYS  31   6.788   8.800 -11.525
  249   1HZ   LYS  31          1HZ       LYS  31   3.954   8.065 -11.928
  250   2HZ   LYS  31          2HZ       LYS  31   4.434   9.695 -11.868
  251   3HZ   LYS  31          3HZ       LYS  31   5.062   8.663 -13.064
  252    H    HIS  32           H        HIS  32   9.250   8.610  -8.495
  253    HA   HIS  32           HA       HIS  32  10.641   7.865  -5.946
  254   1HB   HIS  32          1HB       HIS  32  10.653  10.285  -7.756
  255   2HB   HIS  32          2HB       HIS  32  11.294  10.363  -6.113
  256    HD1  HIS  32           HD1      HIS  32  13.307  10.746  -8.342
  257    HD2  HIS  32           HD2      HIS  32  12.341   6.981  -6.832
  258    HE1  HIS  32           HE1      HIS  32  15.255   9.227  -8.902
  259    H    ILE  33           H        ILE  33   8.694   7.488  -4.729
  260    HA   ILE  33           HA       ILE  33   6.742   9.720  -4.512
  261    HB   ILE  33           HB       ILE  33   6.770   7.014  -3.150
  262   1HG1  ILE  33          1HG1      ILE  33   7.039   6.731  -5.595
  263   2HG1  ILE  33          2HG1      ILE  33   5.439   6.208  -5.066
  264   1HG2  ILE  33          1HG2      ILE  33   5.153   8.748  -2.351
  265   2HG2  ILE  33          2HG2      ILE  33   4.497   8.840  -3.986
  266   3HG2  ILE  33          3HG2      ILE  33   4.355   7.344  -3.063
  267   1HD1  ILE  33          1HD1      ILE  33   6.045   8.960  -6.183
  268   2HD1  ILE  33          2HD1      ILE  33   5.380   7.629  -7.131
  269   3HD1  ILE  33          3HD1      ILE  33   4.454   8.307  -5.792
  270    H    GLY  34           H        GLY  34   8.329   7.552  -2.132
  271   1HA   GLY  34          1HA       GLY  34   9.874   9.082  -0.587
  272   2HA   GLY  34          2HA       GLY  34   8.309   9.781  -0.183
  273    H    GLY  35           H        GLY  35   9.309   6.401  -0.725
  274   1HA   GLY  35          1HA       GLY  35   8.207   5.786   1.989
  275   2HA   GLY  35          2HA       GLY  35   8.085   4.674   0.625
  276    H    SER  36           H        SER  36   9.406   4.286   3.277
  277    HA   SER  36           HA       SER  36  12.277   4.103   2.539
  278   1HB   SER  36          1HB       SER  36  12.543   3.710   4.923
  279   2HB   SER  36          2HB       SER  36  11.446   5.067   4.706
  280    HG   SER  36           HG       SER  36  10.974   2.484   5.625
  281    H    TYR  37           H        TYR  37   9.655   1.984   3.776
  282    HA   TYR  37           HA       TYR  37  10.948  -0.297   2.354
  283   1HB   TYR  37          1HB       TYR  37  11.461   0.097   4.945
  284   2HB   TYR  37          2HB       TYR  37   9.899  -0.702   5.128
  285    HD1  TYR  37           HD1      TYR  37  12.545  -1.219   2.538
  286    HD2  TYR  37           HD2      TYR  37  10.405  -2.887   5.868
  287    HE1  TYR  37           HE1      TYR  37  13.609  -3.417   2.121
  288    HE2  TYR  37           HE2      TYR  37  11.471  -5.088   5.451
  289    HH   TYR  37           HH       TYR  37  13.081  -6.162   4.307
  290    H    GLY  38           H        GLY  38   9.420  -1.524   1.309
  291   1HA   GLY  38          1HA       GLY  38   6.572  -1.196   2.170
  292   2HA   GLY  38          2HA       GLY  38   7.044  -1.328   0.476
  293    H    TYR  39           H        TYR  39   5.677  -3.068   2.868
  294    HA   TYR  39           HA       TYR  39   6.508  -5.646   1.620
  295   1HB   TYR  39          1HB       TYR  39   6.801  -6.585   3.919
  296   2HB   TYR  39          2HB       TYR  39   7.949  -5.290   3.578
  297    HD1  TYR  39           HD1      TYR  39   4.599  -5.936   5.114
  298    HD2  TYR  39           HD2      TYR  39   8.066  -3.405   4.979
  299    HE1  TYR  39           HE1      TYR  39   3.746  -4.665   7.066
  300    HE2  TYR  39           HE2      TYR  39   7.214  -2.135   6.931
  301    HH   TYR  39           HH       TYR  39   5.692  -2.430   8.796
  302    H    CYS  40           H        CYS  40   4.902  -7.376   2.070
  303    HA   CYS  40           HA       CYS  40   2.173  -6.283   2.292
  304   1HB   CYS  40          1HB       CYS  40   3.417  -8.338   0.896
  305   2HB   CYS  40          2HB       CYS  40   2.498  -9.193   2.137
  306    H    TYR  41           H        TYR  41   0.958  -6.367   4.121
  307    HA   TYR  41           HA       TYR  41   1.778  -8.245   6.309
  308   1HB   TYR  41          1HB       TYR  41   2.191  -5.523   6.247
  309   2HB   TYR  41          2HB       TYR  41   0.642  -5.632   7.084
  310    HD1  TYR  41           HD1      TYR  41   4.205  -6.626   7.169
  311    HD2  TYR  41           HD2      TYR  41   0.462  -6.640   9.275
  312    HE1  TYR  41           HE1      TYR  41   5.375  -7.310   9.247
  313    HE2  TYR  41           HE2      TYR  41   1.634  -7.322  11.353
  314    HH   TYR  41           HH       TYR  41   4.221  -8.694  11.642
  315    H    GLY  42           H        GLY  42   0.021  -9.257   7.312
  316   1HA   GLY  42          1HA       GLY  42  -2.202  -9.954   7.608
  317   2HA   GLY  42          2HA       GLY  42  -2.634  -8.252   7.430
  318    H    PHE  43           H        PHE  43  -1.024 -10.300   5.026
  319    HA   PHE  43           HA       PHE  43  -1.676 -10.878   2.832
  320   1HB   PHE  43          1HB       PHE  43  -4.132 -10.919   4.533
  321   2HB   PHE  43          2HB       PHE  43  -4.357 -11.028   2.787
  322    HD1  PHE  43           HD1      PHE  43  -2.274 -12.490   5.547
  323    HD2  PHE  43           HD2      PHE  43  -4.170 -13.110   1.741
  324    HE1  PHE  43           HE1      PHE  43  -1.624 -14.881   5.612
  325    HE2  PHE  43           HE2      PHE  43  -3.519 -15.503   1.807
  326    HZ   PHE  43           HZ       PHE  43  -2.246 -16.388   3.743
  327    H    GLY  44           H        GLY  44  -1.003  -8.229   3.054
  328   1HA   GLY  44          1HA       GLY  44  -2.543  -7.007   0.931
  329   2HA   GLY  44          2HA       GLY  44  -2.869  -6.232   2.483
  330    H    CYS  45           H        CYS  45  -1.503  -5.031   0.188
  331    HA   CYS  45           HA       CYS  45   1.358  -4.971   0.736
  332   1HB   CYS  45          1HB       CYS  45  -0.567  -3.327  -0.928
  333   2HB   CYS  45          2HB       CYS  45   1.170  -3.024  -0.906
  334    H    TYR  46           H        TYR  46   2.487  -3.438   1.948
  335    HA   TYR  46           HA       TYR  46   0.961  -1.166   3.147
  336   1HB   TYR  46          1HB       TYR  46   0.991  -3.235   4.605
  337   2HB   TYR  46          2HB       TYR  46   2.748  -3.088   4.664
  338    HD1  TYR  46           HD1      TYR  46   3.765  -0.923   5.563
  339    HD2  TYR  46           HD2      TYR  46  -0.390  -1.918   6.003
  340    HE1  TYR  46           HE1      TYR  46   3.559   0.744   7.388
  341    HE2  TYR  46           HE2      TYR  46  -0.598  -0.250   7.826
  342    HH   TYR  46           HH       TYR  46   0.415   1.414   8.915
  343    H    CYS  47           H        CYS  47   2.434   0.555   3.939
  344    HA   CYS  47           HA       CYS  47   5.268   0.296   3.001
  345   1HB   CYS  47          1HB       CYS  47   3.118   1.744   1.784
  346   2HB   CYS  47          2HB       CYS  47   4.287   2.906   2.410
  347    H    GLU  48           H        GLU  48   6.694   1.922   3.971
  348    HA   GLU  48           HA       GLU  48   5.586   3.118   6.494
  349   1HB   GLU  48          1HB       GLU  48   8.396   2.097   6.004
  350   2HB   GLU  48          2HB       GLU  48   7.646   2.475   7.555
  351   1HG   GLU  48          1HG       GLU  48   5.889   0.637   6.505
  352   2HG   GLU  48          2HG       GLU  48   7.442   0.039   5.919
  353    H    GLY  49           H        GLY  49   5.348   5.263   5.691
  354   1HA   GLY  49          1HA       GLY  49   7.125   7.216   5.897
  355   2HA   GLY  49          2HA       GLY  49   7.713   6.509   4.393
  356    H    LEU  50           H        LEU  50   4.606   5.872   4.062
  357    HA   LEU  50           HA       LEU  50   3.923   7.572   2.027
  358   1HB   LEU  50          1HB       LEU  50   2.166   6.621   4.310
  359   2HB   LEU  50          2HB       LEU  50   1.571   7.181   2.752
  360    HG   LEU  50           HG       LEU  50   1.638   4.960   2.243
  361   1HD1  LEU  50          1HD1      LEU  50   4.588   5.601   2.014
  362   2HD1  LEU  50          2HD1      LEU  50   3.777   4.246   1.227
  363   3HD1  LEU  50          3HD1      LEU  50   3.364   5.901   0.781
  364   1HD2  LEU  50          1HD2      LEU  50   2.666   4.729   4.753
  365   2HD2  LEU  50          2HD2      LEU  50   2.436   3.368   3.655
  366   3HD2  LEU  50          3HD2      LEU  50   4.016   4.139   3.784
  367    HA   PRO  51           HA       PRO  51   4.385  11.488   4.337
  368   1HB   PRO  51          1HB       PRO  51   3.830  12.747   1.792
  369   2HB   PRO  51          2HB       PRO  51   5.351  12.711   2.690
  370   1HG   PRO  51          1HG       PRO  51   4.702  11.291   0.290
  371   2HG   PRO  51          2HG       PRO  51   6.206  11.222   1.213
  372   1HD   PRO  51          1HD       PRO  51   4.195   9.175   0.977
  373   2HD   PRO  51          2HD       PRO  51   5.685   9.127   1.949
  374    H    ASP  52           H        ASP  52   2.783  13.066   4.915
  375    HA   ASP  52           HA       ASP  52   0.128  12.353   5.156
  376   1HB   ASP  52          1HB       ASP  52   1.682  14.887   5.027
  377   2HB   ASP  52          2HB       ASP  52  -0.072  15.043   4.921
  378    H    SER  53           H        SER  53   1.429  14.389   2.497
  379    HA   SER  53           HA       SER  53  -0.936  14.721   1.012
  380   1HB   SER  53          1HB       SER  53   1.583  15.528   0.765
  381   2HB   SER  53          2HB       SER  53   1.674  14.175  -0.359
  382    HG   SER  53           HG       SER  53  -0.513  15.304  -1.022
  383    H    THR  54           H        THR  54   1.444  12.049   0.774
  384    HA   THR  54           HA       THR  54   0.330  10.580  -1.334
  385    HB   THR  54           HB       THR  54   1.243   9.142   1.123
  386    HG1  THR  54           HG1      THR  54   3.159  10.485  -0.387
  387   1HG2  THR  54          1HG2      THR  54   0.944   8.003  -1.056
  388   2HG2  THR  54          2HG2      THR  54   2.118   9.104  -1.779
  389   3HG2  THR  54          3HG2      THR  54   2.627   7.969  -0.528
  390    H    GLN  55           H        GLN  55  -1.403   9.134  -1.517
  391    HA   GLN  55           HA       GLN  55  -3.470   9.287   0.604
  392   1HB   GLN  55          1HB       GLN  55  -3.888   9.697  -1.848
  393   2HB   GLN  55          2HB       GLN  55  -3.510   8.000  -2.143
  394   1HG   GLN  55          1HG       GLN  55  -5.710   7.613  -1.780
  395   2HG   GLN  55          2HG       GLN  55  -5.340   7.865  -0.074
  396   1HE2  GLN  55          2HE2      GLN  55  -5.045  10.544   0.235
  397   2HE2  GLN  55          1HE2      GLN  55  -6.414  11.394  -0.296
  398    H    THR  56           H        THR  56  -4.237   7.447   1.709
  399    HA   THR  56           HA       THR  56  -2.905   4.833   1.127
  400    HB   THR  56           HB       THR  56  -3.092   5.033   3.913
  401    HG1  THR  56           HG1      THR  56  -2.600   7.016   4.441
  402   1HG2  THR  56          1HG2      THR  56  -1.245   4.262   2.136
  403   2HG2  THR  56          2HG2      THR  56  -0.554   5.826   2.569
  404   3HG2  THR  56          3HG2      THR  56  -0.836   4.610   3.816
  405    H    TRP  57           H        TRP  57  -3.997   3.177   2.844
  406    HA   TRP  57           HA       TRP  57  -6.927   3.405   2.381
  407   1HB   TRP  57          1HB       TRP  57  -5.256   1.410   1.866
  408   2HB   TRP  57          2HB       TRP  57  -5.493   1.045   3.572
  409    HD1  TRP  57           HD1      TRP  57  -7.507   1.437   0.315
  410    HE1  TRP  57           HE1      TRP  57  -9.698   0.099   0.554
  411    HE3  TRP  57           HE3      TRP  57  -7.127  -0.013   5.196
  412    HZ2  TRP  57           HZ2      TRP  57 -11.106  -1.387   2.554
  413    HZ3  TRP  57           HZ3      TRP  57  -8.905  -1.387   6.243
  414    HH2  TRP  57           HH2      TRP  57 -10.893  -2.074   4.929
  415    HA   PRO  58           HA       PRO  58  -8.743   3.008   3.025
  416   1HB   PRO  58          1HB       PRO  58 -10.564   4.711   4.372
  417   2HB   PRO  58          2HB       PRO  58 -10.613   2.946   4.316
  418   1HG   PRO  58          1HG       PRO  58  -9.985   4.643   6.566
  419   2HG   PRO  58          2HG       PRO  58 -10.125   2.883   6.527
  420   1HD   PRO  58          1HD       PRO  58  -7.710   4.485   6.690
  421   2HD   PRO  58          2HD       PRO  58  -7.861   2.710   6.736
  422    H    LEU  59           H        LEU  59 -10.072   4.952   1.945
  423    HA   LEU  59           HA       LEU  59  -8.147   7.208   1.609
  424   1HB   LEU  59          1HB       LEU  59 -10.045   5.656  -0.036
  425   2HB   LEU  59          2HB       LEU  59 -10.039   7.386  -0.377
  426    HG   LEU  59           HG       LEU  59  -7.381   6.974  -0.236
  427   1HD1  LEU  59          1HD1      LEU  59  -8.659   4.333  -0.907
  428   2HD1  LEU  59          2HD1      LEU  59  -7.100   4.766  -1.607
  429   3HD1  LEU  59          3HD1      LEU  59  -7.281   4.662   0.144
  430   1HD2  LEU  59          1HD2      LEU  59  -8.622   7.975  -2.129
  431   2HD2  LEU  59          2HD2      LEU  59  -7.410   6.829  -2.699
  432   3HD2  LEU  59          3HD2      LEU  59  -9.111   6.364  -2.656
  433    HA   PRO  60           HA       PRO  60 -10.707  10.426   3.173
  434   1HB   PRO  60          1HB       PRO  60 -11.281  11.683   0.625
  435   2HB   PRO  60          2HB       PRO  60 -10.184  12.222   1.900
  436   1HG   PRO  60          1HG       PRO  60  -9.482  11.110  -0.634
  437   2HG   PRO  60          2HG       PRO  60  -8.394  11.570   0.679
  438   1HD   PRO  60          1HD       PRO  60  -9.032   8.913  -0.226
  439   2HD   PRO  60          2HD       PRO  60  -7.969   9.375   1.125
  440    H    ASN  61           H        ASN  61 -12.886  11.757   2.045
  441    HA   ASN  61           HA       ASN  61 -15.094  10.120   2.568
  442   1HB   ASN  61          1HB       ASN  61 -14.770  12.477   0.680
  443   2HB   ASN  61          2HB       ASN  61 -16.329  11.854   1.223
  444   1HD2  ASN  61          2HD2      ASN  61 -15.697  11.282   3.945
  445   2HD2  ASN  61          1HD2      ASN  61 -15.366  12.743   4.742
  446    H    LYS  62           H        LYS  62 -13.215  10.432  -0.378
  447    HA   LYS  62           HA       LYS  62 -15.132   8.820  -1.958
  448   1HB   LYS  62          1HB       LYS  62 -12.759  10.530  -2.372
  449   2HB   LYS  62          2HB       LYS  62 -12.858   9.145  -3.461
  450   1HG   LYS  62          1HG       LYS  62 -15.372   9.894  -3.712
  451   2HG   LYS  62          2HG       LYS  62 -14.755  11.452  -3.160
  452   1HD   LYS  62          1HD       LYS  62 -14.026  11.865  -5.247
  453   2HD   LYS  62          2HD       LYS  62 -12.926  10.493  -5.107
  454   1HE   LYS  62          1HE       LYS  62 -14.220   9.896  -6.985
  455   2HE   LYS  62          2HE       LYS  62 -15.092   9.079  -5.671
  456   1HZ   LYS  62          1HZ       LYS  62 -16.332  11.263  -5.420
  457   2HZ   LYS  62          2HZ       LYS  62 -15.714  11.677  -6.948
  458   3HZ   LYS  62          3HZ       LYS  62 -16.724  10.321  -6.775
  459    H    THR  63           H        THR  63 -14.730   7.028  -0.216
  460    HA   THR  63           HA       THR  63 -12.186   5.552  -0.597
  461    HB   THR  63           HB       THR  63 -14.482   4.650   1.106
  462    HG1  THR  63           HG1      THR  63 -12.739   6.689   1.956
  463   1HG2  THR  63          1HG2      THR  63 -11.604   4.274   0.912
  464   2HG2  THR  63          2HG2      THR  63 -12.085   4.751   2.540
  465   3HG2  THR  63          3HG2      THR  63 -12.798   3.320   1.794
  466    H    CYS  64           H        CYS  64 -12.752   2.975  -0.542
  467    HA   CYS  64           HA       CYS  64 -14.073   2.438  -3.095
  468   1HB   CYS  64          1HB       CYS  64 -11.985   1.357  -1.918
  469   2HB   CYS  64          2HB       CYS  64 -13.193   0.365  -1.099
  Start of MODEL   30
    1   1H    LYS   1          1H        LYS   1   5.626   7.388   7.077
    2   2H    LYS   1          2H        LYS   1   6.237   8.283   8.385
    3   3H    LYS   1          3H        LYS   1   6.917   6.779   7.998
    4    HA   LYS   1           HA       LYS   1   5.543   6.396   9.877
    5   1HB   LYS   1          1HB       LYS   1   3.218   7.268   9.846
    6   2HB   LYS   1          2HB       LYS   1   4.395   8.567   9.646
    7   1HG   LYS   1          1HG       LYS   1   3.878   8.881   7.405
    8   2HG   LYS   1          2HG       LYS   1   3.319   7.220   7.196
    9   1HD   LYS   1          1HD       LYS   1   1.385   7.810   8.749
   10   2HD   LYS   1          2HD       LYS   1   1.880   9.493   8.578
   11   1HE   LYS   1          1HE       LYS   1   1.737   8.206   5.975
   12   2HE   LYS   1          2HE       LYS   1   0.188   8.089   6.835
   13   1HZ   LYS   1          1HZ       LYS   1   1.775  10.590   6.731
   14   2HZ   LYS   1          2HZ       LYS   1   0.577  10.230   5.586
   15   3HZ   LYS   1          3HZ       LYS   1   0.160  10.398   7.225
   16    H    ASP   2           H        ASP   2   3.946   4.626  10.021
   17    HA   ASP   2           HA       ASP   2   4.020   2.863   7.690
   18   1HB   ASP   2          1HB       ASP   2   2.422   2.520  10.237
   19   2HB   ASP   2          2HB       ASP   2   3.143   1.266   9.229
   20    H    GLY   3           H        GLY   3   2.193   2.219   6.437
   21   1HA   GLY   3          1HA       GLY   3  -0.476   3.206   7.029
   22   2HA   GLY   3          2HA       GLY   3   0.286   4.099   5.714
   23    H    TYR   4           H        TYR   4  -1.708   3.031   4.645
   24    HA   TYR   4           HA       TYR   4  -0.897   0.363   3.537
   25   1HB   TYR   4          1HB       TYR   4  -3.333   1.374   4.831
   26   2HB   TYR   4          2HB       TYR   4  -3.653   0.592   3.284
   27    HD1  TYR   4           HD1      TYR   4  -2.237  -1.659   2.906
   28    HD2  TYR   4           HD2      TYR   4  -3.270   0.020   6.721
   29    HE1  TYR   4           HE1      TYR   4  -1.942  -3.882   3.964
   30    HE2  TYR   4           HE2      TYR   4  -2.975  -2.203   7.780
   31    HH   TYR   4           HH       TYR   4  -1.954  -4.282   7.425
   32    H    LEU   5           H        LEU   5   0.179   1.943   1.903
   33    HA   LEU   5           HA       LEU   5  -1.050   3.786   0.258
   34   1HB   LEU   5          1HB       LEU   5   1.067   1.748   0.003
   35   2HB   LEU   5          2HB       LEU   5   0.388   2.277  -1.536
   36    HG   LEU   5           HG       LEU   5   1.233   4.251   0.585
   37   1HD1  LEU   5          1HD1      LEU   5   2.881   2.907  -1.564
   38   2HD1  LEU   5          2HD1      LEU   5   3.318   4.481  -0.898
   39   3HD1  LEU   5          3HD1      LEU   5   3.252   3.066   0.153
   40   1HD2  LEU   5          1HD2      LEU   5   0.220   4.306  -2.185
   41   2HD2  LEU   5          2HD2      LEU   5   0.147   5.550  -0.937
   42   3HD2  LEU   5          3HD2      LEU   5   1.610   5.354  -1.903
   43    H    VAL   6           H        VAL   6  -2.523   3.729  -1.453
   44    HA   VAL   6           HA       VAL   6  -4.038   1.179  -1.775
   45    HB   VAL   6           HB       VAL   6  -5.819   2.659  -2.537
   46   1HG1  VAL   6          1HG1      VAL   6  -4.526   2.842   0.000
   47   2HG1  VAL   6          2HG1      VAL   6  -5.099   4.454  -0.429
   48   3HG1  VAL   6          3HG1      VAL   6  -6.230   3.101  -0.372
   49   1HG2  VAL   6          1HG2      VAL   6  -3.609   4.329  -3.238
   50   2HG2  VAL   6          2HG2      VAL   6  -5.317   4.584  -3.595
   51   3HG2  VAL   6          3HG2      VAL   6  -4.623   5.224  -2.106
   52    H    GLU   7           H        GLU   7  -5.181   1.455  -4.197
   53    HA   GLU   7           HA       GLU   7  -2.867   1.261  -6.069
   54   1HB   GLU   7          1HB       GLU   7  -5.702   0.218  -5.970
   55   2HB   GLU   7          2HB       GLU   7  -4.757   0.142  -7.457
   56   1HG   GLU   7          1HG       GLU   7  -4.019  -1.086  -4.787
   57   2HG   GLU   7          2HG       GLU   7  -4.492  -1.952  -6.249
   58    H    LYS   8           H        LYS   8  -3.330   2.089  -8.345
   59    HA   LYS   8           HA       LYS   8  -3.802   4.827  -8.478
   60   1HB   LYS   8          1HB       LYS   8  -3.404   2.636 -10.226
   61   2HB   LYS   8          2HB       LYS   8  -4.814   3.500 -10.840
   62   1HG   LYS   8          1HG       LYS   8  -2.352   5.022 -10.018
   63   2HG   LYS   8          2HG       LYS   8  -2.440   4.272 -11.611
   64   1HD   LYS   8          1HD       LYS   8  -3.910   5.814 -12.376
   65   2HD   LYS   8          2HD       LYS   8  -4.868   5.757 -10.897
   66   1HE   LYS   8          1HE       LYS   8  -4.025   7.874 -10.587
   67   2HE   LYS   8          2HE       LYS   8  -2.602   7.000  -9.988
   68   1HZ   LYS   8          1HZ       LYS   8  -2.739   7.150 -12.861
   69   2HZ   LYS   8          2HZ       LYS   8  -2.610   8.673 -12.123
   70   3HZ   LYS   8          3HZ       LYS   8  -1.439   7.485 -11.820
   71    H    THR   9           H        THR   9  -6.181   2.225  -8.418
   72    HA   THR   9           HA       THR   9  -8.411   4.080  -9.019
   73    HB   THR   9           HB       THR   9  -9.662   1.835  -8.635
   74    HG1  THR   9           HG1      THR   9  -8.185   0.053  -8.854
   75   1HG2  THR   9          1HG2      THR   9  -8.935   2.889 -10.850
   76   2HG2  THR   9          2HG2      THR   9  -7.551   1.798 -10.794
   77   3HG2  THR   9          3HG2      THR   9  -9.187   1.143 -10.862
   78    H    GLY  10           H        GLY  10  -6.676   3.026  -6.283
   79   1HA   GLY  10          1HA       GLY  10  -7.154   4.018  -4.099
   80   2HA   GLY  10          2HA       GLY  10  -8.870   4.009  -4.517
   81    H    CYS  11           H        CYS  11  -8.333   1.191  -5.687
   82    HA   CYS  11           HA       CYS  11  -9.261  -0.311  -3.419
   83   1HB   CYS  11          1HB       CYS  11  -8.297  -0.816  -6.205
   84   2HB   CYS  11          2HB       CYS  11  -8.404  -2.199  -5.116
   85    H    LYS  12           H        LYS  12  -8.085  -1.384  -1.841
   86    HA   LYS  12           HA       LYS  12  -5.332  -0.844  -1.394
   87   1HB   LYS  12          1HB       LYS  12  -5.584  -2.664   0.293
   88   2HB   LYS  12          2HB       LYS  12  -6.927  -1.527   0.335
   89   1HG   LYS  12          1HG       LYS  12  -8.041  -3.182  -1.361
   90   2HG   LYS  12          2HG       LYS  12  -6.864  -4.335  -0.733
   91   1HD   LYS  12          1HD       LYS  12  -7.944  -4.532   1.252
   92   2HD   LYS  12          2HD       LYS  12  -8.231  -2.795   1.365
   93   1HE   LYS  12          1HE       LYS  12 -10.373  -4.032   1.151
   94   2HE   LYS  12          2HE       LYS  12 -10.096  -3.017  -0.278
   95   1HZ   LYS  12          1HZ       LYS  12  -8.756  -5.430  -0.687
   96   2HZ   LYS  12          2HZ       LYS  12 -10.316  -5.825  -0.151
   97   3HZ   LYS  12          3HZ       LYS  12 -10.114  -4.841  -1.520
   98    H    LYS  13           H        LYS  13  -4.053  -3.197  -0.878
   99    HA   LYS  13           HA       LYS  13  -4.062  -4.766  -3.420
  100   1HB   LYS  13          1HB       LYS  13  -2.162  -2.766  -2.542
  101   2HB   LYS  13          2HB       LYS  13  -1.369  -4.335  -2.689
  102   1HG   LYS  13          1HG       LYS  13  -3.234  -3.545  -4.876
  103   2HG   LYS  13          2HG       LYS  13  -1.685  -2.706  -4.797
  104   1HD   LYS  13          1HD       LYS  13  -1.144  -4.550  -6.119
  105   2HD   LYS  13          2HD       LYS  13  -0.709  -5.130  -4.512
  106   1HE   LYS  13          1HE       LYS  13  -2.336  -6.723  -4.536
  107   2HE   LYS  13          2HE       LYS  13  -3.539  -5.599  -5.199
  108   1HZ   LYS  13          1HZ       LYS  13  -2.170  -5.727  -7.319
  109   2HZ   LYS  13          2HZ       LYS  13  -1.438  -7.100  -6.646
  110   3HZ   LYS  13          3HZ       LYS  13  -3.112  -7.088  -6.936
  111    H    THR  14           H        THR  14  -4.833  -6.583  -2.185
  112    HA   THR  14           HA       THR  14  -3.464  -7.459   0.242
  113    HB   THR  14           HB       THR  14  -5.445  -8.815  -1.621
  114    HG1  THR  14           HG1      THR  14  -5.639  -6.956   0.444
  115   1HG2  THR  14          1HG2      THR  14  -4.025  -9.719   0.727
  116   2HG2  THR  14          2HG2      THR  14  -5.759  -9.661   1.047
  117   3HG2  THR  14          3HG2      THR  14  -5.143 -10.611  -0.305
  118    H    CYS  15           H        CYS  15  -1.918  -9.113   0.396
  119    HA   CYS  15           HA       CYS  15  -0.796 -10.098  -2.202
  120   1HB   CYS  15          1HB       CYS  15   1.318 -10.046  -1.120
  121   2HB   CYS  15          2HB       CYS  15   0.502  -8.597  -0.540
  122    H    TYR  16           H        TYR  16   0.390 -12.307  -1.835
  123    HA   TYR  16           HA       TYR  16  -1.397 -14.078  -0.199
  124   1HB   TYR  16          1HB       TYR  16  -0.363 -14.132  -2.977
  125   2HB   TYR  16          2HB       TYR  16  -0.327 -15.681  -2.135
  126    HD1  TYR  16           HD1      TYR  16  -2.670 -15.446  -0.345
  127    HD2  TYR  16           HD2      TYR  16  -2.195 -14.303  -4.459
  128    HE1  TYR  16           HE1      TYR  16  -5.114 -15.689  -0.696
  129    HE2  TYR  16           HE2      TYR  16  -4.638 -14.546  -4.809
  130    HH   TYR  16           HH       TYR  16  -6.755 -15.757  -2.230
  131    H    LYS  17           H        LYS  17   1.777 -12.933  -0.695
  132    HA   LYS  17           HA       LYS  17   2.939 -15.239   0.834
  133   1HB   LYS  17          1HB       LYS  17   3.799 -14.894  -1.462
  134   2HB   LYS  17          2HB       LYS  17   4.212 -13.228  -1.053
  135   1HG   LYS  17          1HG       LYS  17   5.456 -14.566   0.971
  136   2HG   LYS  17          2HG       LYS  17   5.595 -15.744  -0.334
  137   1HD   LYS  17          1HD       LYS  17   6.304 -12.837  -0.746
  138   2HD   LYS  17          2HD       LYS  17   7.481 -13.998  -0.129
  139   1HE   LYS  17          1HE       LYS  17   5.953 -14.807  -2.564
  140   2HE   LYS  17          2HE       LYS  17   7.201 -13.561  -2.763
  141   1HZ   LYS  17          1HZ       LYS  17   8.695 -15.022  -1.433
  142   2HZ   LYS  17          2HZ       LYS  17   7.525 -16.246  -1.536
  143   3HZ   LYS  17          3HZ       LYS  17   8.271 -15.664  -2.947
  144    H    LEU  18           H        LEU  18   1.894 -13.810   2.670
  145    HA   LEU  18           HA       LEU  18   2.602 -11.307   3.525
  146   1HB   LEU  18          1HB       LEU  18   2.263 -13.959   4.874
  147   2HB   LEU  18          2HB       LEU  18   2.793 -12.590   5.851
  148    HG   LEU  18           HG       LEU  18   0.353 -12.536   4.058
  149   1HD1  LEU  18          1HD1      LEU  18   0.568 -14.015   6.342
  150   2HD1  LEU  18          2HD1      LEU  18   0.052 -12.462   6.999
  151   3HD1  LEU  18          3HD1      LEU  18  -0.936 -13.279   5.788
  152   1HD2  LEU  18          1HD2      LEU  18   1.704 -10.623   5.929
  153   2HD2  LEU  18          2HD2      LEU  18   0.939 -10.308   4.371
  154   3HD2  LEU  18          3HD2      LEU  18  -0.055 -10.575   5.804
  155    H    GLY  19           H        GLY  19   4.388 -10.386   4.715
  156   1HA   GLY  19          1HA       GLY  19   6.625 -10.514   5.686
  157   2HA   GLY  19          2HA       GLY  19   6.890 -11.994   4.777
  158    H    GLU  20           H        GLU  20   8.854 -11.036   3.990
  159    HA   GLU  20           HA       GLU  20   9.144  -8.613   2.578
  160   1HB   GLU  20          1HB       GLU  20  11.105  -9.746   1.604
  161   2HB   GLU  20          2HB       GLU  20  10.938 -10.169   3.309
  162   1HG   GLU  20          1HG       GLU  20   9.396 -12.000   1.694
  163   2HG   GLU  20          2HG       GLU  20  11.061 -11.947   1.115
  164    H    ASN  21           H        ASN  21   7.012  -8.526   1.412
  165    HA   ASN  21           HA       ASN  21   6.601 -10.364  -0.848
  166   1HB   ASN  21          1HB       ASN  21   4.916  -9.166   0.776
  167   2HB   ASN  21          2HB       ASN  21   5.109  -7.803  -0.327
  168   1HD2  ASN  21          2HD2      ASN  21   3.592 -10.910   0.079
  169   2HD2  ASN  21          1HD2      ASN  21   2.878 -10.992  -1.458
  170    H    ASP  22           H        ASP  22   8.619  -9.795  -2.067
  171    HA   ASP  22           HA       ASP  22   9.475  -7.297  -2.938
  172   1HB   ASP  22          1HB       ASP  22   9.166  -9.898  -4.480
  173   2HB   ASP  22          2HB       ASP  22  10.195  -8.560  -4.984
  174    H    PHE  23           H        PHE  23   6.902  -9.298  -4.406
  175    HA   PHE  23           HA       PHE  23   6.067  -7.743  -6.548
  176   1HB   PHE  23          1HB       PHE  23   5.171  -9.936  -5.506
  177   2HB   PHE  23          2HB       PHE  23   4.177  -8.901  -4.485
  178    HD1  PHE  23           HD1      PHE  23   4.160  -6.789  -7.005
  179    HD2  PHE  23           HD2      PHE  23   2.980 -10.867  -6.351
  180    HE1  PHE  23           HE1      PHE  23   2.497  -6.599  -8.831
  181    HE2  PHE  23           HE2      PHE  23   1.318 -10.677  -8.177
  182    HZ   PHE  23           HZ       PHE  23   1.076  -8.545  -9.419
  183    H    CYS  24           H        CYS  24   4.932  -7.380  -3.169
  184    HA   CYS  24           HA       CYS  24   3.412  -5.006  -3.558
  185   1HB   CYS  24          1HB       CYS  24   3.376  -6.542  -1.588
  186   2HB   CYS  24          2HB       CYS  24   4.972  -5.948  -1.128
  187    H    ASN  25           H        ASN  25   6.777  -5.381  -2.376
  188    HA   ASN  25           HA       ASN  25   7.526  -2.755  -1.955
  189   1HB   ASN  25          1HB       ASN  25   8.756  -5.276  -2.651
  190   2HB   ASN  25          2HB       ASN  25   9.610  -3.957  -3.453
  191   1HD2  ASN  25          2HD2      ASN  25   8.969  -5.451  -0.354
  192   2HD2  ASN  25          1HD2      ASN  25   9.917  -4.391   0.573
  193    H    ARG  26           H        ARG  26   8.105  -4.334  -5.124
  194    HA   ARG  26           HA       ARG  26   8.693  -2.077  -6.650
  195   1HB   ARG  26          1HB       ARG  26   7.243  -4.664  -7.207
  196   2HB   ARG  26          2HB       ARG  26   7.563  -3.508  -8.499
  197   1HG   ARG  26          1HG       ARG  26   9.812  -3.896  -8.478
  198   2HG   ARG  26          2HG       ARG  26   9.859  -4.155  -6.735
  199   1HD   ARG  26          1HD       ARG  26   8.303  -6.267  -7.783
  200   2HD   ARG  26          2HD       ARG  26   9.717  -6.131  -8.842
  201    HE   ARG  26           HE       ARG  26   9.747  -7.136  -6.167
  202   1HH1  ARG  26          1HH1      ARG  26  11.471  -4.900  -8.177
  203   2HH1  ARG  26          2HH1      ARG  26  12.847  -4.844  -7.132
  204   1HH2  ARG  26          1HH2      ARG  26  11.542  -7.077  -4.829
  205   2HH2  ARG  26          2HH2      ARG  26  12.892  -6.074  -5.245
  206    H    GLU  27           H        GLU  27   5.453  -3.403  -5.948
  207    HA   GLU  27           HA       GLU  27   3.997  -1.456  -7.488
  208   1HB   GLU  27          1HB       GLU  27   3.227  -3.176  -5.108
  209   2HB   GLU  27          2HB       GLU  27   2.088  -2.383  -6.196
  210   1HG   GLU  27          1HG       GLU  27   4.077  -3.920  -7.666
  211   2HG   GLU  27          2HG       GLU  27   3.181  -4.931  -6.531
  212    H    CYS  28           H        CYS  28   4.499  -1.701  -3.931
  213    HA   CYS  28           HA       CYS  28   3.216   0.788  -3.318
  214   1HB   CYS  28          1HB       CYS  28   3.570  -0.985  -1.690
  215   2HB   CYS  28          2HB       CYS  28   5.319  -0.857  -1.882
  216    H    LYS  29           H        LYS  29   6.397   0.082  -4.545
  217    HA   LYS  29           HA       LYS  29   7.354   2.814  -3.809
  218   1HB   LYS  29          1HB       LYS  29   8.484   0.178  -4.050
  219   2HB   LYS  29          2HB       LYS  29   9.327   1.271  -5.148
  220   1HG   LYS  29          1HG       LYS  29   9.206   2.870  -2.999
  221   2HG   LYS  29          2HG       LYS  29   9.182   1.309  -2.175
  222   1HD   LYS  29          1HD       LYS  29  11.166   0.748  -3.822
  223   2HD   LYS  29          2HD       LYS  29  11.324   2.504  -3.903
  224   1HE   LYS  29          1HE       LYS  29  11.279   0.906  -1.317
  225   2HE   LYS  29          2HE       LYS  29  12.744   1.541  -2.093
  226   1HZ   LYS  29          1HZ       LYS  29  10.394   3.232  -1.451
  227   2HZ   LYS  29          2HZ       LYS  29  11.705   3.043  -0.387
  228   3HZ   LYS  29          3HZ       LYS  29  11.948   3.742  -1.913
  229    H    TRP  30           H        TRP  30   5.390   2.100  -6.036
  230    HA   TRP  30           HA       TRP  30   6.977   2.792  -8.447
  231   1HB   TRP  30          1HB       TRP  30   5.035   2.043  -9.627
  232   2HB   TRP  30          2HB       TRP  30   5.311   0.909  -8.312
  233    HD1  TRP  30           HD1      TRP  30   2.519   0.994  -9.489
  234    HE1  TRP  30           HE1      TRP  30   0.480   1.802  -8.150
  235    HE3  TRP  30           HE3      TRP  30   4.830   3.886  -5.907
  236    HZ2  TRP  30           HZ2      TRP  30  -0.112   3.426  -5.894
  237    HZ3  TRP  30           HZ3      TRP  30   3.482   5.031  -4.195
  238    HH2  TRP  30           HH2      TRP  30   1.018   4.810  -4.179
  239    H    LYS  31           H        LYS  31   6.823   4.971  -6.663
  240    HA   LYS  31           HA       LYS  31   5.671   7.000  -8.343
  241   1HB   LYS  31          1HB       LYS  31   3.707   5.746  -7.187
  242   2HB   LYS  31          2HB       LYS  31   4.215   6.610  -5.732
  243   1HG   LYS  31          1HG       LYS  31   4.030   8.747  -6.938
  244   2HG   LYS  31          2HG       LYS  31   3.505   7.883  -8.383
  245   1HD   LYS  31          1HD       LYS  31   1.428   7.381  -7.501
  246   2HD   LYS  31          2HD       LYS  31   2.017   7.391  -5.838
  247   1HE   LYS  31          1HE       LYS  31   2.243   9.869  -5.950
  248   2HE   LYS  31          2HE       LYS  31   1.568   9.834  -7.591
  249   1HZ   LYS  31          1HZ       LYS  31   0.033   8.264  -5.760
  250   2HZ   LYS  31          2HZ       LYS  31   0.124   9.886  -5.264
  251   3HZ   LYS  31          3HZ       LYS  31  -0.474   9.505  -6.803
  252    H    HIS  32           H        HIS  32   5.847   9.182  -7.290
  253    HA   HIS  32           HA       HIS  32   8.319   9.504  -5.869
  254   1HB   HIS  32          1HB       HIS  32   6.579  11.047  -7.321
  255   2HB   HIS  32          2HB       HIS  32   6.271  11.630  -5.685
  256    HD1  HIS  32           HD1      HIS  32   8.490  12.177  -8.457
  257    HD2  HIS  32           HD2      HIS  32   8.923  12.244  -4.311
  258    HE1  HIS  32           HE1      HIS  32  10.601  13.493  -7.978
  259    H    ILE  33           H        ILE  33   7.431   7.754  -4.159
  260    HA   ILE  33           HA       ILE  33   5.844   9.078  -2.011
  261    HB   ILE  33           HB       ILE  33   6.821   6.236  -2.429
  262   1HG1  ILE  33          1HG1      ILE  33   5.055   5.957  -3.800
  263   2HG1  ILE  33          2HG1      ILE  33   3.983   6.391  -2.478
  264   1HG2  ILE  33          1HG2      ILE  33   5.970   7.482  -0.081
  265   2HG2  ILE  33          2HG2      ILE  33   4.553   6.598  -0.649
  266   3HG2  ILE  33          3HG2      ILE  33   6.072   5.745  -0.370
  267   1HD1  ILE  33          1HD1      ILE  33   4.495   8.851  -3.164
  268   2HD1  ILE  33          2HD1      ILE  33   5.079   8.146  -4.670
  269   3HD1  ILE  33          3HD1      ILE  33   3.404   7.914  -4.178
  270    H    GLY  34           H        GLY  34   8.582   6.787  -1.914
  271   1HA   GLY  34          1HA       GLY  34  10.775   7.363  -0.990
  272   2HA   GLY  34          2HA       GLY  34  10.005   8.676  -0.102
  273    H    GLY  35           H        GLY  35   9.201   5.217  -0.401
  274   1HA   GLY  35          1HA       GLY  35   8.666   5.089   2.479
  275   2HA   GLY  35          2HA       GLY  35   8.460   3.769   1.329
  276    H    SER  36           H        SER  36   9.807   3.697   3.948
  277    HA   SER  36           HA       SER  36  12.669   3.333   3.244
  278   1HB   SER  36          1HB       SER  36  12.923   3.257   5.661
  279   2HB   SER  36          2HB       SER  36  11.850   4.592   5.265
  280    HG   SER  36           HG       SER  36  10.143   3.439   5.965
  281    H    TYR  37           H        TYR  37   9.771   1.520   4.054
  282    HA   TYR  37           HA       TYR  37  11.070  -1.002   3.254
  283   1HB   TYR  37          1HB       TYR  37  11.149  -0.185   5.917
  284   2HB   TYR  37          2HB       TYR  37   9.770  -1.283   5.866
  285    HD1  TYR  37           HD1      TYR  37  13.304  -1.018   4.637
  286    HD2  TYR  37           HD2      TYR  37  10.148  -3.585   6.017
  287    HE1  TYR  37           HE1      TYR  37  14.848  -2.957   4.561
  288    HE2  TYR  37           HE2      TYR  37  11.692  -5.523   5.940
  289    HH   TYR  37           HH       TYR  37  15.112  -5.112   5.022
  290    H    GLY  38           H        GLY  38   9.510  -1.923   1.970
  291   1HA   GLY  38          1HA       GLY  38   6.659  -1.478   2.758
  292   2HA   GLY  38          2HA       GLY  38   7.189  -1.588   1.083
  293    H    TYR  39           H        TYR  39   6.191  -3.374   3.856
  294    HA   TYR  39           HA       TYR  39   6.542  -5.914   2.297
  295   1HB   TYR  39          1HB       TYR  39   6.691  -6.965   4.631
  296   2HB   TYR  39          2HB       TYR  39   8.067  -5.974   4.149
  297    HD1  TYR  39           HD1      TYR  39   5.096  -6.183   6.314
  298    HD2  TYR  39           HD2      TYR  39   8.460  -3.789   5.136
  299    HE1  TYR  39           HE1      TYR  39   4.747  -4.719   8.289
  300    HE2  TYR  39           HE2      TYR  39   8.114  -2.325   7.108
  301    HH   TYR  39           HH       TYR  39   7.032  -2.593   9.427
  302    H    CYS  40           H        CYS  40   4.811  -7.552   2.894
  303    HA   CYS  40           HA       CYS  40   2.199  -6.315   2.808
  304   1HB   CYS  40          1HB       CYS  40   3.125  -8.553   1.852
  305   2HB   CYS  40          2HB       CYS  40   2.754  -9.204   3.451
  306    H    TYR  41           H        TYR  41   0.439  -6.884   4.342
  307    HA   TYR  41           HA       TYR  41   1.103  -7.661   7.090
  308   1HB   TYR  41          1HB       TYR  41   1.772  -5.163   6.582
  309   2HB   TYR  41          2HB       TYR  41   0.037  -4.871   6.694
  310    HD1  TYR  41           HD1      TYR  41  -0.860  -6.689   8.776
  311    HD2  TYR  41           HD2      TYR  41   2.755  -4.379   8.558
  312    HE1  TYR  41           HE1      TYR  41  -0.698  -6.706  11.252
  313    HE2  TYR  41           HE2      TYR  41   2.916  -4.395  11.033
  314    HH   TYR  41           HH       TYR  41   2.028  -5.124  12.927
  315    H    GLY  42           H        GLY  42  -0.725  -8.778   7.724
  316   1HA   GLY  42          1HA       GLY  42  -2.966  -9.506   7.727
  317   2HA   GLY  42          2HA       GLY  42  -3.358  -7.784   7.702
  318    H    PHE  43           H        PHE  43  -1.680  -9.743   5.248
  319    HA   PHE  43           HA       PHE  43  -2.163 -10.032   2.951
  320   1HB   PHE  43          1HB       PHE  43  -4.880  -9.889   4.272
  321   2HB   PHE  43          2HB       PHE  43  -4.700 -10.225   2.552
  322    HD1  PHE  43           HD1      PHE  43  -1.881 -11.718   3.221
  323    HD2  PHE  43           HD2      PHE  43  -5.960 -12.125   4.515
  324    HE1  PHE  43           HE1      PHE  43  -1.479 -14.101   3.736
  325    HE2  PHE  43           HE2      PHE  43  -5.552 -14.515   5.029
  326    HZ   PHE  43           HZ       PHE  43  -3.314 -15.502   4.639
  327    H    GLY  44           H        GLY  44  -1.303  -7.541   3.338
  328   1HA   GLY  44          1HA       GLY  44  -2.778  -5.997   1.363
  329   2HA   GLY  44          2HA       GLY  44  -2.889  -5.303   2.981
  330    H    CYS  45           H        CYS  45  -1.481  -4.286   0.542
  331    HA   CYS  45           HA       CYS  45   1.372  -4.575   0.924
  332   1HB   CYS  45          1HB       CYS  45  -0.552  -3.172  -0.764
  333   2HB   CYS  45          2HB       CYS  45   0.852  -2.167  -0.400
  334    H    TYR  46           H        TYR  46   1.866  -4.059   3.136
  335    HA   TYR  46           HA       TYR  46   1.075  -1.380   4.151
  336   1HB   TYR  46          1HB       TYR  46   1.057  -3.717   5.364
  337   2HB   TYR  46          2HB       TYR  46   2.776  -3.395   5.595
  338    HD1  TYR  46           HD1      TYR  46  -0.509  -1.599   5.878
  339    HD2  TYR  46           HD2      TYR  46   3.409  -2.240   7.519
  340    HE1  TYR  46           HE1      TYR  46  -1.046  -0.072   7.757
  341    HE2  TYR  46           HE2      TYR  46   2.871  -0.713   9.398
  342    HH   TYR  46           HH       TYR  46  -0.378   0.569   9.848
  343    H    CYS  47           H        CYS  47   2.496   0.326   4.073
  344    HA   CYS  47           HA       CYS  47   5.410  -0.301   3.686
  345   1HB   CYS  47          1HB       CYS  47   3.499   1.490   2.234
  346   2HB   CYS  47          2HB       CYS  47   5.179   2.009   2.375
  347    H    GLU  48           H        GLU  48   6.852   1.410   4.509
  348    HA   GLU  48           HA       GLU  48   5.580   3.048   6.682
  349   1HB   GLU  48          1HB       GLU  48   8.164   1.487   6.491
  350   2HB   GLU  48          2HB       GLU  48   7.912   2.711   7.736
  351   1HG   GLU  48          1HG       GLU  48   5.707   1.445   8.241
  352   2HG   GLU  48          2HG       GLU  48   6.424   0.124   7.318
  353    H    GLY  49           H        GLY  49   6.451   5.174   6.980
  354   1HA   GLY  49          1HA       GLY  49   7.980   6.979   6.470
  355   2HA   GLY  49          2HA       GLY  49   8.510   6.089   5.042
  356    H    LEU  50           H        LEU  50   5.381   5.627   4.764
  357    HA   LEU  50           HA       LEU  50   4.833   7.240   2.586
  358   1HB   LEU  50          1HB       LEU  50   2.897   6.552   4.816
  359   2HB   LEU  50          2HB       LEU  50   2.491   6.835   3.126
  360    HG   LEU  50           HG       LEU  50   3.996   4.505   4.321
  361   1HD1  LEU  50          1HD1      LEU  50   1.535   4.381   4.167
  362   2HD1  LEU  50          2HD1      LEU  50   1.630   4.729   2.441
  363   3HD1  LEU  50          3HD1      LEU  50   2.301   3.227   3.076
  364   1HD2  LEU  50          1HD2      LEU  50   3.829   5.322   1.401
  365   2HD2  LEU  50          2HD2      LEU  50   5.295   5.294   2.382
  366   3HD2  LEU  50          3HD2      LEU  50   4.467   3.787   1.989
  367    HA   PRO  51           HA       PRO  51   5.190  11.230   4.755
  368   1HB   PRO  51          1HB       PRO  51   4.893  12.496   2.198
  369   2HB   PRO  51          2HB       PRO  51   6.370  12.304   3.146
  370   1HG   PRO  51          1HG       PRO  51   5.659  10.966   0.709
  371   2HG   PRO  51          2HG       PRO  51   7.134  10.778   1.662
  372   1HD   PRO  51          1HD       PRO  51   4.940   8.913   1.395
  373   2HD   PRO  51          2HD       PRO  51   6.443   8.712   2.330
  374    H    ASP  52           H        ASP  52   3.597  12.900   5.142
  375    HA   ASP  52           HA       ASP  52   0.880  12.175   5.075
  376   1HB   ASP  52          1HB       ASP  52   2.425  14.746   5.282
  377   2HB   ASP  52          2HB       ASP  52   0.662  14.791   5.258
  378    H    SER  53           H        SER  53   2.805  13.836   2.615
  379    HA   SER  53           HA       SER  53   0.763  14.915   0.987
  380   1HB   SER  53          1HB       SER  53   3.484  14.710   0.954
  381   2HB   SER  53          2HB       SER  53   3.057  13.619  -0.361
  382    HG   SER  53           HG       SER  53   2.283  15.257  -1.482
  383    H    THR  54           H        THR  54   2.177  11.623   0.901
  384    HA   THR  54           HA       THR  54   0.542  10.731  -1.313
  385    HB   THR  54           HB       THR  54   2.025   9.226   0.867
  386    HG1  THR  54           HG1      THR  54   3.443   9.110  -1.190
  387   1HG2  THR  54          1HG2      THR  54   0.681   8.414  -1.681
  388   2HG2  THR  54          2HG2      THR  54   2.164   7.585  -1.208
  389   3HG2  THR  54          3HG2      THR  54   0.763   7.564  -0.138
  390    H    GLN  55           H        GLN  55  -1.316   9.374  -1.239
  391    HA   GLN  55           HA       GLN  55  -2.994   9.692   1.181
  392   1HB   GLN  55          1HB       GLN  55  -3.409   8.719  -1.658
  393   2HB   GLN  55          2HB       GLN  55  -4.690   8.671  -0.447
  394   1HG   GLN  55          1HG       GLN  55  -3.214  11.129  -1.427
  395   2HG   GLN  55          2HG       GLN  55  -4.910  10.733  -1.710
  396   1HE2  GLN  55          2HE2      GLN  55  -5.938  10.055   0.705
  397   2HE2  GLN  55          1HE2      GLN  55  -5.702  11.278   1.859
  398    H    THR  56           H        THR  56  -4.317   7.673   1.818
  399    HA   THR  56           HA       THR  56  -2.828   5.120   1.402
  400    HB   THR  56           HB       THR  56  -1.988   6.327   3.443
  401    HG1  THR  56           HG1      THR  56  -2.522   3.880   3.158
  402   1HG2  THR  56          1HG2      THR  56  -4.839   5.898   4.378
  403   2HG2  THR  56          2HG2      THR  56  -3.513   6.478   5.384
  404   3HG2  THR  56          3HG2      THR  56  -4.090   7.457   4.036
  405    H    TRP  57           H        TRP  57  -4.143   3.258   2.373
  406    HA   TRP  57           HA       TRP  57  -6.938   3.520   1.529
  407   1HB   TRP  57          1HB       TRP  57  -5.173   1.577   1.291
  408   2HB   TRP  57          2HB       TRP  57  -5.723   1.142   2.910
  409    HD1  TRP  57           HD1      TRP  57  -6.749   1.057  -0.706
  410    HE1  TRP  57           HE1      TRP  57  -9.047  -0.091  -0.925
  411    HE3  TRP  57           HE3      TRP  57  -8.072   0.795   4.217
  412    HZ2  TRP  57           HZ2      TRP  57 -11.166  -1.004   0.767
  413    HZ3  TRP  57           HZ3      TRP  57 -10.234  -0.217   4.887
  414    HH2  TRP  57           HH2      TRP  57 -11.782  -1.115   3.170
  415    HA   PRO  58           HA       PRO  58  -8.691   2.759   1.700
  416   1HB   PRO  58          1HB       PRO  58 -11.193   3.610   2.617
  417   2HB   PRO  58          2HB       PRO  58 -10.618   1.939   2.623
  418   1HG   PRO  58          1HG       PRO  58 -11.079   3.703   4.890
  419   2HG   PRO  58          2HG       PRO  58 -10.701   1.977   4.892
  420   1HD   PRO  58          1HD       PRO  58  -8.934   4.207   5.500
  421   2HD   PRO  58          2HD       PRO  58  -8.587   2.463   5.609
  422    H    LEU  59           H        LEU  59 -10.076   4.363   0.331
  423    HA   LEU  59           HA       LEU  59  -8.883   7.019   0.430
  424   1HB   LEU  59          1HB       LEU  59 -10.529   5.348  -1.306
  425   2HB   LEU  59          2HB       LEU  59 -11.091   7.019  -1.295
  426    HG   LEU  59           HG       LEU  59  -8.867   7.820  -1.873
  427   1HD1  LEU  59          1HD1      LEU  59  -7.766   5.865  -0.585
  428   2HD1  LEU  59          2HD1      LEU  59  -7.952   4.953  -2.083
  429   3HD1  LEU  59          3HD1      LEU  59  -6.972   6.419  -2.059
  430   1HD2  LEU  59          1HD2      LEU  59  -9.827   5.500  -3.575
  431   2HD2  LEU  59          2HD2      LEU  59 -10.256   7.201  -3.760
  432   3HD2  LEU  59          3HD2      LEU  59  -8.611   6.664  -4.100
  433    HA   PRO  60           HA       PRO  60 -11.818   9.440   2.643
  434   1HB   PRO  60          1HB       PRO  60 -12.970  10.819   0.361
  435   2HB   PRO  60          2HB       PRO  60 -11.848  11.445   1.574
  436   1HG   PRO  60          1HG       PRO  60 -11.273  10.804  -1.148
  437   2HG   PRO  60          2HG       PRO  60 -10.136  11.337   0.095
  438   1HD   PRO  60          1HD       PRO  60 -10.348   8.720  -1.097
  439   2HD   PRO  60          2HD       PRO  60  -9.220   9.249   0.177
  440    H    ASN  61           H        ASN  61 -14.398  10.263   2.117
  441    HA   ASN  61           HA       ASN  61 -16.030   8.026   2.473
  442   1HB   ASN  61          1HB       ASN  61 -16.287  10.839   1.846
  443   2HB   ASN  61          2HB       ASN  61 -17.508   9.918   0.967
  444   1HD2  ASN  61          2HD2      ASN  61 -18.716   8.228   2.415
  445   2HD2  ASN  61          1HD2      ASN  61 -19.083   8.714   4.000
  446    H    LYS  62           H        LYS  62 -14.603   9.255  -0.452
  447    HA   LYS  62           HA       LYS  62 -16.290   7.612  -2.235
  448   1HB   LYS  62          1HB       LYS  62 -15.023   9.988  -2.485
  449   2HB   LYS  62          2HB       LYS  62 -13.775   8.927  -3.139
  450   1HG   LYS  62          1HG       LYS  62 -16.632   9.218  -4.098
  451   2HG   LYS  62          2HG       LYS  62 -15.155   9.581  -4.992
  452   1HD   LYS  62          1HD       LYS  62 -14.699   6.982  -4.358
  453   2HD   LYS  62          2HD       LYS  62 -16.458   6.968  -4.476
  454   1HE   LYS  62          1HE       LYS  62 -16.444   7.543  -6.742
  455   2HE   LYS  62          2HE       LYS  62 -14.852   8.320  -6.637
  456   1HZ   LYS  62          1HZ       LYS  62 -14.477   5.717  -5.797
  457   2HZ   LYS  62          2HZ       LYS  62 -15.474   5.595  -7.167
  458   3HZ   LYS  62          3HZ       LYS  62 -13.976   6.389  -7.272
  459    H    THR  63           H        THR  63 -15.483   5.616  -0.904
  460    HA   THR  63           HA       THR  63 -12.785   4.697  -1.066
  461    HB   THR  63           HB       THR  63 -15.254   2.959  -1.094
  462    HG1  THR  63           HG1      THR  63 -14.236   4.608   0.968
  463   1HG2  THR  63          1HG2      THR  63 -12.432   2.674  -0.412
  464   2HG2  THR  63          2HG2      THR  63 -13.490   2.172   0.906
  465   3HG2  THR  63          3HG2      THR  63 -13.650   1.429  -0.686
  466    H    CYS  64           H        CYS  64 -12.226   2.619  -2.361
  467    HA   CYS  64           HA       CYS  64 -12.275   3.159  -5.162
  468   1HB   CYS  64          1HB       CYS  64 -10.614   1.793  -3.888
  469   2HB   CYS  64          2HB       CYS  64 -11.841   0.544  -3.678
  Start of MODEL   31
    1   1H    LYS   1          1H        LYS   1   5.380   7.113   9.269
    2   2H    LYS   1          2H        LYS   1   5.195   7.727  10.841
    3   3H    LYS   1          3H        LYS   1   5.837   6.172  10.605
    4    HA   LYS   1           HA       LYS   1   3.603   5.840  11.280
    5   1HB   LYS   1          1HB       LYS   1   1.841   7.212  10.433
    6   2HB   LYS   1          2HB       LYS   1   3.184   8.317  10.725
    7   1HG   LYS   1          1HG       LYS   1   2.540   8.939   8.571
    8   2HG   LYS   1          2HG       LYS   1   3.805   7.758   8.227
    9   1HD   LYS   1          1HD       LYS   1   2.341   6.339   7.258
   10   2HD   LYS   1          2HD       LYS   1   1.209   6.485   8.602
   11   1HE   LYS   1          1HE       LYS   1   1.508   8.612   6.455
   12   2HE   LYS   1          2HE       LYS   1   0.283   7.328   6.402
   13   1HZ   LYS   1          1HZ       LYS   1  -0.320   8.009   8.720
   14   2HZ   LYS   1          2HZ       LYS   1   0.661   9.377   8.515
   15   3HZ   LYS   1          3HZ       LYS   1  -0.700   9.155   7.524
   16    H    ASP   2           H        ASP   2   2.189   4.297  10.227
   17    HA   ASP   2           HA       ASP   2   3.315   3.225   7.679
   18   1HB   ASP   2          1HB       ASP   2   1.227   1.881   9.380
   19   2HB   ASP   2          2HB       ASP   2   2.522   1.151   8.435
   20    H    GLY   3           H        GLY   3   1.758   2.505   6.017
   21   1HA   GLY   3          1HA       GLY   3  -0.988   3.565   6.193
   22   2HA   GLY   3          2HA       GLY   3   0.034   4.292   4.952
   23    H    TYR   4           H        TYR   4  -1.826   3.234   3.635
   24    HA   TYR   4           HA       TYR   4  -0.905   0.500   2.824
   25   1HB   TYR   4          1HB       TYR   4  -3.382   1.326   4.038
   26   2HB   TYR   4          2HB       TYR   4  -3.706   0.743   2.405
   27    HD1  TYR   4           HD1      TYR   4  -2.272  -1.450   1.756
   28    HD2  TYR   4           HD2      TYR   4  -3.361  -0.261   5.738
   29    HE1  TYR   4           HE1      TYR   4  -1.986  -3.788   2.535
   30    HE2  TYR   4           HE2      TYR   4  -3.076  -2.600   6.514
   31    HH   TYR   4           HH       TYR   4  -2.732  -4.716   5.884
   32    H    LEU   5           H        LEU   5  -1.474  -0.007   0.558
   33    HA   LEU   5           HA       LEU   5  -1.396   2.423  -1.145
   34   1HB   LEU   5          1HB       LEU   5  -0.568  -0.405  -1.251
   35   2HB   LEU   5          2HB       LEU   5  -1.200   0.219  -2.776
   36    HG   LEU   5           HG       LEU   5   0.788   1.850  -1.224
   37   1HD1  LEU   5          1HD1      LEU   5   1.418  -0.721  -1.796
   38   2HD1  LEU   5          2HD1      LEU   5   1.829   0.037  -3.334
   39   3HD1  LEU   5          3HD1      LEU   5   2.596   0.591  -1.846
   40   1HD2  LEU   5          1HD2      LEU   5  -0.579   2.036  -3.709
   41   2HD2  LEU   5          2HD2      LEU   5   0.663   3.122  -3.083
   42   3HD2  LEU   5          3HD2      LEU   5   1.119   1.743  -4.085
   43    H    VAL   6           H        VAL   6  -2.944   2.809  -2.784
   44    HA   VAL   6           HA       VAL   6  -5.510   1.288  -2.493
   45    HB   VAL   6           HB       VAL   6  -6.556   3.375  -3.197
   46   1HG1  VAL   6          1HG1      VAL   6  -5.035   3.042  -0.857
   47   2HG1  VAL   6          2HG1      VAL   6  -4.686   4.680  -1.409
   48   3HG1  VAL   6          3HG1      VAL   6  -6.353   4.187  -1.108
   49   1HG2  VAL   6          1HG2      VAL   6  -4.278   3.824  -4.625
   50   2HG2  VAL   6          2HG2      VAL   6  -5.451   5.084  -4.245
   51   3HG2  VAL   6          3HG2      VAL   6  -4.008   4.894  -3.250
   52    H    GLU   7           H        GLU   7  -6.755   1.983  -4.826
   53    HA   GLU   7           HA       GLU   7  -4.905   0.970  -6.969
   54   1HB   GLU   7          1HB       GLU   7  -6.938  -0.405  -5.812
   55   2HB   GLU   7          2HB       GLU   7  -7.819   0.404  -7.109
   56   1HG   GLU   7          1HG       GLU   7  -5.653  -0.420  -8.496
   57   2HG   GLU   7          2HG       GLU   7  -5.715  -1.689  -7.271
   58    H    LYS   8           H        LYS   8  -5.784   1.503  -9.216
   59    HA   LYS   8           HA       LYS   8  -6.008   4.231  -9.714
   60   1HB   LYS   8          1HB       LYS   8  -6.880   1.718 -11.102
   61   2HB   LYS   8          2HB       LYS   8  -7.353   3.269 -11.799
   62   1HG   LYS   8          1HG       LYS   8  -4.778   3.829 -11.351
   63   2HG   LYS   8          2HG       LYS   8  -4.632   2.076 -11.497
   64   1HD   LYS   8          1HD       LYS   8  -4.346   2.934 -13.708
   65   2HD   LYS   8          2HD       LYS   8  -5.984   2.280 -13.655
   66   1HE   LYS   8          1HE       LYS   8  -6.071   5.010 -12.760
   67   2HE   LYS   8          2HE       LYS   8  -5.218   4.939 -14.315
   68   1HZ   LYS   8          1HZ       LYS   8  -7.075   3.268 -14.917
   69   2HZ   LYS   8          2HZ       LYS   8  -7.931   3.998 -13.648
   70   3HZ   LYS   8          3HZ       LYS   8  -7.418   4.932 -14.971
   71    H    THR   9           H        THR   9  -8.585   1.980  -8.813
   72    HA   THR   9           HA       THR   9 -10.683   4.026  -9.196
   73    HB   THR   9           HB       THR   9 -12.141   2.151  -8.629
   74    HG1  THR   9           HG1      THR   9  -9.934   0.490  -8.242
   75   1HG2  THR   9          1HG2      THR   9  -9.823   1.563 -10.457
   76   2HG2  THR   9          2HG2      THR   9 -11.140   0.408 -10.256
   77   3HG2  THR   9          3HG2      THR   9 -11.471   2.022 -10.884
   78    H    GLY  10           H        GLY  10  -8.540   2.986  -6.729
   79   1HA   GLY  10          1HA       GLY  10  -8.382   4.277  -4.653
   80   2HA   GLY  10          2HA       GLY  10 -10.129   4.514  -4.719
   81    H    CYS  11           H        CYS  11  -9.439   1.360  -5.607
   82    HA   CYS  11           HA       CYS  11 -10.556   0.292  -3.131
   83   1HB   CYS  11          1HB       CYS  11  -9.641  -0.684  -5.806
   84   2HB   CYS  11          2HB       CYS  11  -9.791  -1.870  -4.510
   85    H    LYS  12           H        LYS  12  -9.167  -1.996  -2.630
   86    HA   LYS  12           HA       LYS  12  -6.542  -0.969  -1.632
   87   1HB   LYS  12          1HB       LYS  12  -6.847  -3.135  -0.184
   88   2HB   LYS  12          2HB       LYS  12  -7.827  -1.721   0.186
   89   1HG   LYS  12          1HG       LYS  12  -9.759  -2.661  -0.706
   90   2HG   LYS  12          2HG       LYS  12  -8.864  -3.740  -1.777
   91   1HD   LYS  12          1HD       LYS  12  -8.679  -4.039   1.216
   92   2HD   LYS  12          2HD       LYS  12 -10.009  -4.769   0.318
   93   1HE   LYS  12          1HE       LYS  12  -8.648  -6.329  -0.689
   94   2HE   LYS  12          2HE       LYS  12  -7.261  -5.223  -0.759
   95   1HZ   LYS  12          1HZ       LYS  12  -7.543  -5.379   1.846
   96   2HZ   LYS  12          2HZ       LYS  12  -8.187  -6.901   1.451
   97   3HZ   LYS  12          3HZ       LYS  12  -6.604  -6.504   0.987
   98    H    LYS  13           H        LYS  13  -5.005  -3.078  -1.310
   99    HA   LYS  13           HA       LYS  13  -5.055  -4.673  -3.845
  100   1HB   LYS  13          1HB       LYS  13  -3.537  -2.471  -3.541
  101   2HB   LYS  13          2HB       LYS  13  -2.465  -3.647  -2.780
  102   1HG   LYS  13          1HG       LYS  13  -2.301  -4.949  -4.749
  103   2HG   LYS  13          2HG       LYS  13  -3.717  -4.184  -5.474
  104   1HD   LYS  13          1HD       LYS  13  -1.182  -2.663  -4.822
  105   2HD   LYS  13          2HD       LYS  13  -1.479  -3.402  -6.397
  106   1HE   LYS  13          1HE       LYS  13  -3.315  -1.973  -6.851
  107   2HE   LYS  13          2HE       LYS  13  -3.481  -1.508  -5.146
  108   1HZ   LYS  13          1HZ       LYS  13  -0.997  -0.800  -5.489
  109   2HZ   LYS  13          2HZ       LYS  13  -1.469  -0.670  -7.112
  110   3HZ   LYS  13          3HZ       LYS  13  -2.261   0.249  -5.922
  111    H    THR  14           H        THR  14  -4.900  -6.814  -3.307
  112    HA   THR  14           HA       THR  14  -3.716  -7.538  -0.662
  113    HB   THR  14           HB       THR  14  -5.722  -8.732  -2.567
  114    HG1  THR  14           HG1      THR  14  -7.008  -8.309  -0.959
  115   1HG2  THR  14          1HG2      THR  14  -3.895 -10.184  -0.722
  116   2HG2  THR  14          2HG2      THR  14  -5.595 -10.652  -0.679
  117   3HG2  THR  14          3HG2      THR  14  -4.693 -10.747  -2.191
  118    H    CYS  15           H        CYS  15  -2.039  -9.075  -0.558
  119    HA   CYS  15           HA       CYS  15  -0.836  -9.905  -3.178
  120   1HB   CYS  15          1HB       CYS  15   1.342  -9.758  -1.654
  121   2HB   CYS  15          2HB       CYS  15   0.693  -8.320  -2.434
  122    H    TYR  16           H        TYR  16  -0.419 -12.071  -3.341
  123    HA   TYR  16           HA       TYR  16  -1.333 -13.887  -1.278
  124   1HB   TYR  16          1HB       TYR  16   0.108 -14.116  -3.923
  125   2HB   TYR  16          2HB       TYR  16  -0.258 -15.540  -2.949
  126    HD1  TYR  16           HD1      TYR  16  -2.859 -15.009  -1.803
  127    HD2  TYR  16           HD2      TYR  16  -1.383 -14.046  -5.721
  128    HE1  TYR  16           HE1      TYR  16  -5.179 -15.015  -2.679
  129    HE2  TYR  16           HE2      TYR  16  -3.704 -14.053  -6.597
  130    HH   TYR  16           HH       TYR  16  -5.841 -14.480  -6.137
  131    H    LYS  17           H        LYS  17   1.921 -13.113  -2.575
  132    HA   LYS  17           HA       LYS  17   3.256 -14.812  -0.601
  133   1HB   LYS  17          1HB       LYS  17   3.811 -13.553  -3.070
  134   2HB   LYS  17          2HB       LYS  17   4.934 -12.850  -1.905
  135   1HG   LYS  17          1HG       LYS  17   5.122 -15.442  -1.183
  136   2HG   LYS  17          2HG       LYS  17   4.736 -15.647  -2.892
  137   1HD   LYS  17          1HD       LYS  17   6.824 -13.639  -2.137
  138   2HD   LYS  17          2HD       LYS  17   7.252 -15.350  -2.097
  139   1HE   LYS  17          1HE       LYS  17   5.844 -14.215  -4.512
  140   2HE   LYS  17          2HE       LYS  17   7.604 -14.052  -4.339
  141   1HZ   LYS  17          1HZ       LYS  17   6.382 -16.649  -3.748
  142   2HZ   LYS  17          2HZ       LYS  17   6.557 -16.208  -5.380
  143   3HZ   LYS  17          3HZ       LYS  17   7.920 -16.298  -4.372
  144    H    LEU  18           H        LEU  18   3.169 -14.106   1.516
  145    HA   LEU  18           HA       LEU  18   3.138 -11.261   2.212
  146   1HB   LEU  18          1HB       LEU  18   3.303 -13.874   3.739
  147   2HB   LEU  18          2HB       LEU  18   3.243 -12.301   4.538
  148    HG   LEU  18           HG       LEU  18   1.181 -13.236   2.527
  149   1HD1  LEU  18          1HD1      LEU  18   1.202 -13.360   5.555
  150   2HD1  LEU  18          2HD1      LEU  18  -0.272 -13.486   4.594
  151   3HD1  LEU  18          3HD1      LEU  18   0.997 -14.700   4.427
  152   1HD2  LEU  18          1HD2      LEU  18   1.781 -10.702   3.398
  153   2HD2  LEU  18          2HD2      LEU  18   0.187 -11.208   2.839
  154   3HD2  LEU  18          3HD2      LEU  18   0.551 -11.192   4.564
  155    H    GLY  19           H        GLY  19   4.832 -10.901   4.268
  156   1HA   GLY  19          1HA       GLY  19   7.099 -10.603   4.859
  157   2HA   GLY  19          2HA       GLY  19   7.455 -12.037   3.905
  158    H    GLU  20           H        GLU  20   9.332 -10.941   3.111
  159    HA   GLU  20           HA       GLU  20   9.584  -8.490   1.830
  160   1HB   GLU  20          1HB       GLU  20  11.115 -10.677   2.193
  161   2HB   GLU  20          2HB       GLU  20  10.747 -10.886   0.482
  162   1HG   GLU  20          1HG       GLU  20  11.557  -8.158   1.359
  163   2HG   GLU  20          2HG       GLU  20  12.815  -9.393   1.326
  164    H    ASN  21           H        ASN  21   7.487  -8.039   0.805
  165    HA   ASN  21           HA       ASN  21   6.843  -9.635  -1.630
  166   1HB   ASN  21          1HB       ASN  21   5.073  -9.230   0.004
  167   2HB   ASN  21          2HB       ASN  21   5.377  -7.493  -0.056
  168   1HD2  ASN  21          2HD2      ASN  21   3.481  -9.976  -1.410
  169   2HD2  ASN  21          1HD2      ASN  21   2.916  -9.134  -2.771
  170    H    ASP  22           H        ASP  22   8.632  -8.716  -2.919
  171    HA   ASP  22           HA       ASP  22   9.221  -6.007  -3.343
  172   1HB   ASP  22          1HB       ASP  22  10.359  -8.077  -4.255
  173   2HB   ASP  22          2HB       ASP  22   9.067  -8.185  -5.451
  174    H    PHE  23           H        PHE  23   6.608  -7.964  -4.735
  175    HA   PHE  23           HA       PHE  23   5.611  -6.358  -6.760
  176   1HB   PHE  23          1HB       PHE  23   4.810  -8.577  -5.618
  177   2HB   PHE  23          2HB       PHE  23   3.803  -7.506  -4.642
  178    HD1  PHE  23           HD1      PHE  23   4.841  -7.321  -8.236
  179    HD2  PHE  23           HD2      PHE  23   1.609  -7.686  -5.432
  180    HE1  PHE  23           HE1      PHE  23   3.210  -7.154 -10.095
  181    HE2  PHE  23           HE2      PHE  23  -0.024  -7.516  -7.291
  182    HZ   PHE  23           HZ       PHE  23   0.777  -7.250  -9.622
  183    H    CYS  24           H        CYS  24   4.361  -6.120  -3.405
  184    HA   CYS  24           HA       CYS  24   3.110  -3.565  -3.794
  185   1HB   CYS  24          1HB       CYS  24   4.124  -4.950  -1.287
  186   2HB   CYS  24          2HB       CYS  24   2.928  -3.660  -1.327
  187    H    ASN  25           H        ASN  25   6.222  -4.489  -2.292
  188    HA   ASN  25           HA       ASN  25   7.089  -1.935  -1.460
  189   1HB   ASN  25          1HB       ASN  25   8.442  -3.645  -0.716
  190   2HB   ASN  25          2HB       ASN  25   8.268  -4.565  -2.208
  191   1HD2  ASN  25          2HD2      ASN  25   9.809  -4.195  -3.906
  192   2HD2  ASN  25          1HD2      ASN  25  11.177  -3.212  -3.699
  193    H    ARG  26           H        ARG  26   7.524  -3.535  -4.633
  194    HA   ARG  26           HA       ARG  26   9.097  -1.517  -5.874
  195   1HB   ARG  26          1HB       ARG  26   8.257  -3.956  -6.536
  196   2HB   ARG  26          2HB       ARG  26   7.023  -3.040  -7.401
  197   1HG   ARG  26          1HG       ARG  26   8.511  -2.705  -9.054
  198   2HG   ARG  26          2HG       ARG  26   9.467  -1.733  -7.933
  199   1HD   ARG  26          1HD       ARG  26  10.534  -3.888  -7.118
  200   2HD   ARG  26          2HD       ARG  26   9.725  -4.712  -8.465
  201    HE   ARG  26           HE       ARG  26  10.956  -2.467  -9.602
  202   1HH1  ARG  26          1HH1      ARG  26  11.896  -5.234  -7.760
  203   2HH1  ARG  26          2HH1      ARG  26  13.482  -5.313  -8.448
  204   1HH2  ARG  26          1HH2      ARG  26  13.018  -2.565 -10.510
  205   2HH2  ARG  26          2HH2      ARG  26  14.119  -3.801 -10.001
  206    H    GLU  27           H        GLU  27   5.521  -1.894  -5.774
  207    HA   GLU  27           HA       GLU  27   4.957   0.401  -7.413
  208   1HB   GLU  27          1HB       GLU  27   3.584  -1.566  -5.788
  209   2HB   GLU  27          2HB       GLU  27   2.873   0.030  -5.546
  210   1HG   GLU  27          1HG       GLU  27   1.705  -0.512  -7.438
  211   2HG   GLU  27          2HG       GLU  27   3.167   0.066  -8.237
  212    H    CYS  28           H        CYS  28   5.210  -0.003  -3.879
  213    HA   CYS  28           HA       CYS  28   4.535   2.680  -3.153
  214   1HB   CYS  28          1HB       CYS  28   4.916   0.370  -1.867
  215   2HB   CYS  28          2HB       CYS  28   6.517   1.060  -1.607
  216    H    LYS  29           H        LYS  29   7.448   1.318  -4.503
  217    HA   LYS  29           HA       LYS  29   8.920   3.859  -3.891
  218   1HB   LYS  29          1HB       LYS  29   9.774   1.653  -2.996
  219   2HB   LYS  29          2HB       LYS  29  10.010   1.138  -4.668
  220   1HG   LYS  29          1HG       LYS  29  11.491   3.098  -5.041
  221   2HG   LYS  29          2HG       LYS  29  11.301   3.542  -3.344
  222   1HD   LYS  29          1HD       LYS  29  12.653   1.845  -2.606
  223   2HD   LYS  29          2HD       LYS  29  12.134   0.740  -3.881
  224   1HE   LYS  29          1HE       LYS  29  13.517   1.943  -5.524
  225   2HE   LYS  29          2HE       LYS  29  14.012   3.101  -4.273
  226   1HZ   LYS  29          1HZ       LYS  29  14.267   0.282  -3.599
  227   2HZ   LYS  29          2HZ       LYS  29  15.355   0.861  -4.769
  228   3HZ   LYS  29          3HZ       LYS  29  15.298   1.582  -3.235
  229    H    TRP  30           H        TRP  30   7.511   4.556  -5.881
  230    HA   TRP  30           HA       TRP  30   9.237   4.662  -8.195
  231   1HB   TRP  30          1HB       TRP  30   8.575   2.757  -9.226
  232   2HB   TRP  30          2HB       TRP  30   7.535   2.388  -7.862
  233    HD1  TRP  30           HD1      TRP  30   5.111   2.153  -8.435
  234    HE1  TRP  30           HE1      TRP  30   3.544   2.970 -10.315
  235    HE3  TRP  30           HE3      TRP  30   8.369   5.043 -11.088
  236    HZ2  TRP  30           HZ2      TRP  30   3.666   4.631 -12.641
  237    HZ3  TRP  30           HZ3      TRP  30   7.622   6.230 -13.131
  238    HH2  TRP  30           HH2      TRP  30   5.277   6.028 -13.911
  239    H    LYS  31           H        LYS  31   8.855   6.797  -8.589
  240    HA   LYS  31           HA       LYS  31   7.686   8.734  -9.265
  241   1HB   LYS  31          1HB       LYS  31   6.078   6.431 -10.013
  242   2HB   LYS  31          2HB       LYS  31   5.054   7.811  -9.615
  243   1HG   LYS  31          1HG       LYS  31   7.450   8.030 -11.448
  244   2HG   LYS  31          2HG       LYS  31   5.827   7.673 -12.042
  245   1HD   LYS  31          1HD       LYS  31   5.003   9.774 -11.448
  246   2HD   LYS  31          2HD       LYS  31   6.249  10.029 -10.226
  247   1HE   LYS  31          1HE       LYS  31   7.133   9.748 -13.076
  248   2HE   LYS  31          2HE       LYS  31   6.393  11.280 -12.572
  249   1HZ   LYS  31          1HZ       LYS  31   8.488   9.934 -10.968
  250   2HZ   LYS  31          2HZ       LYS  31   8.874  11.056 -12.185
  251   3HZ   LYS  31          3HZ       LYS  31   7.946  11.540 -10.850
  252    H    HIS  32           H        HIS  32   7.224   7.105  -6.454
  253    HA   HIS  32           HA       HIS  32   6.315   9.268  -4.900
  254   1HB   HIS  32          1HB       HIS  32   4.244   9.206  -6.145
  255   2HB   HIS  32          2HB       HIS  32   4.126   7.455  -5.971
  256    HD1  HIS  32           HD1      HIS  32   3.917   6.630  -3.350
  257    HD2  HIS  32           HD2      HIS  32   2.938  10.601  -4.160
  258    HE1  HIS  32           HE1      HIS  32   2.573   7.457  -1.367
  259    H    ILE  33           H        ILE  33   7.026   8.619  -2.892
  260    HA   ILE  33           HA       ILE  33   6.381   5.870  -1.967
  261    HB   ILE  33           HB       ILE  33   8.471   5.449  -2.920
  262   1HG1  ILE  33          1HG1      ILE  33  10.096   5.282  -1.073
  263   2HG1  ILE  33          2HG1      ILE  33   9.115   6.385  -0.112
  264   1HG2  ILE  33          1HG2      ILE  33   8.841   8.299  -2.569
  265   2HG2  ILE  33          2HG2      ILE  33  10.282   7.410  -2.077
  266   3HG2  ILE  33          3HG2      ILE  33   9.629   7.202  -3.702
  267   1HD1  ILE  33          1HD1      ILE  33   7.206   4.787  -0.300
  268   2HD1  ILE  33          2HD1      ILE  33   8.272   3.664  -1.144
  269   3HD1  ILE  33          3HD1      ILE  33   8.596   4.094   0.535
  270    H    GLY  34           H        GLY  34   8.674   8.309  -0.731
  271   1HA   GLY  34          1HA       GLY  34   8.337   9.810   1.103
  272   2HA   GLY  34          2HA       GLY  34   6.788   9.031   1.424
  273    H    GLY  35           H        GLY  35   7.868   6.318   1.389
  274   1HA   GLY  35          1HA       GLY  35   9.386   6.424   3.967
  275   2HA   GLY  35          2HA       GLY  35   8.221   5.160   3.575
  276    H    SER  36           H        SER  36  10.500   4.079   4.260
  277    HA   SER  36           HA       SER  36  11.852   3.388   1.672
  278   1HB   SER  36          1HB       SER  36  13.811   3.127   3.563
  279   2HB   SER  36          2HB       SER  36  13.562   4.581   2.601
  280    HG   SER  36           HG       SER  36  13.529   4.519   5.130
  281    H    TYR  37           H        TYR  37   9.784   2.105   3.702
  282    HA   TYR  37           HA       TYR  37  11.021  -0.598   3.563
  283   1HB   TYR  37          1HB       TYR  37  11.385   0.820   5.786
  284   2HB   TYR  37          2HB       TYR  37   9.742   0.282   6.130
  285    HD1  TYR  37           HD1      TYR  37   9.344  -2.329   5.551
  286    HD2  TYR  37           HD2      TYR  37  13.120  -0.533   6.536
  287    HE1  TYR  37           HE1      TYR  37  10.217  -4.544   6.242
  288    HE2  TYR  37           HE2      TYR  37  13.993  -2.749   7.227
  289    HH   TYR  37           HH       TYR  37  13.408  -5.229   6.619
  290    H    GLY  38           H        GLY  38   9.435  -1.745   2.488
  291   1HA   GLY  38          1HA       GLY  38   6.661  -1.594   3.530
  292   2HA   GLY  38          2HA       GLY  38   6.901  -1.254   1.818
  293    H    TYR  39           H        TYR  39   5.419  -3.491   3.050
  294    HA   TYR  39           HA       TYR  39   6.486  -5.641   1.396
  295   1HB   TYR  39          1HB       TYR  39   6.866  -7.155   3.391
  296   2HB   TYR  39          2HB       TYR  39   8.018  -5.826   3.257
  297    HD1  TYR  39           HD1      TYR  39   7.874  -3.871   4.756
  298    HD2  TYR  39           HD2      TYR  39   5.209  -7.216   5.154
  299    HE1  TYR  39           HE1      TYR  39   7.214  -3.078   7.011
  300    HE2  TYR  39           HE2      TYR  39   4.552  -6.422   7.407
  301    HH   TYR  39           HH       TYR  39   4.580  -4.570   8.781
  302    H    CYS  40           H        CYS  40   5.112  -7.731   1.881
  303    HA   CYS  40           HA       CYS  40   2.288  -6.898   1.981
  304   1HB   CYS  40          1HB       CYS  40   3.214  -8.449   0.283
  305   2HB   CYS  40          2HB       CYS  40   3.646  -9.582   1.563
  306    H    TYR  41           H        TYR  41   1.209  -6.862   3.919
  307    HA   TYR  41           HA       TYR  41   1.861  -8.977   5.939
  308   1HB   TYR  41          1HB       TYR  41   2.708  -6.471   6.232
  309   2HB   TYR  41          2HB       TYR  41   1.048  -6.210   6.766
  310    HD1  TYR  41           HD1      TYR  41   1.315  -9.462   7.609
  311    HD2  TYR  41           HD2      TYR  41   3.112  -5.717   8.709
  312    HE1  TYR  41           HE1      TYR  41   1.900 -10.394   9.829
  313    HE2  TYR  41           HE2      TYR  41   3.694  -6.652  10.930
  314    HH   TYR  41           HH       TYR  41   2.689  -8.598  12.424
  315    H    GLY  42           H        GLY  42   0.017 -10.116   6.409
  316   1HA   GLY  42          1HA       GLY  42  -2.258 -10.581   6.779
  317   2HA   GLY  42          2HA       GLY  42  -2.517  -8.841   6.930
  318    H    PHE  43           H        PHE  43  -1.167 -10.551   4.135
  319    HA   PHE  43           HA       PHE  43  -1.898 -10.616   1.891
  320   1HB   PHE  43          1HB       PHE  43  -4.526 -10.526   3.405
  321   2HB   PHE  43          2HB       PHE  43  -4.384 -10.921   1.692
  322    HD1  PHE  43           HD1      PHE  43  -2.316 -12.701   1.275
  323    HD2  PHE  43           HD2      PHE  43  -4.742 -12.365   4.803
  324    HE1  PHE  43           HE1      PHE  43  -1.799 -15.057   1.854
  325    HE2  PHE  43           HE2      PHE  43  -4.221 -14.719   5.385
  326    HZ   PHE  43           HZ       PHE  43  -2.753 -16.066   3.910
  327    H    GLY  44           H        GLY  44  -0.961  -8.226   2.092
  328   1HA   GLY  44          1HA       GLY  44  -2.595  -6.518   0.522
  329   2HA   GLY  44          2HA       GLY  44  -2.757  -6.011   2.203
  330    H    CYS  45           H        CYS  45  -1.473  -4.604  -0.072
  331    HA   CYS  45           HA       CYS  45   1.415  -4.663   0.403
  332   1HB   CYS  45          1HB       CYS  45  -0.428  -2.740  -1.058
  333   2HB   CYS  45          2HB       CYS  45   1.325  -2.764  -1.203
  334    H    TYR  46           H        TYR  46   2.267  -3.722   2.242
  335    HA   TYR  46           HA       TYR  46   0.875  -1.310   3.355
  336   1HB   TYR  46          1HB       TYR  46   1.027  -3.675   4.532
  337   2HB   TYR  46          2HB       TYR  46   2.655  -3.132   4.935
  338    HD1  TYR  46           HD1      TYR  46  -0.629  -1.345   4.663
  339    HD2  TYR  46           HD2      TYR  46   2.705  -2.397   7.160
  340    HE1  TYR  46           HE1      TYR  46  -1.555   0.056   6.489
  341    HE2  TYR  46           HE2      TYR  46   1.779  -0.996   8.986
  342    HH   TYR  46           HH       TYR  46  -0.989   1.098   8.471
  343    H    CYS  47           H        CYS  47   2.212   0.439   3.979
  344    HA   CYS  47           HA       CYS  47   5.146   0.172   3.426
  345   1HB   CYS  47          1HB       CYS  47   3.164   1.550   1.915
  346   2HB   CYS  47          2HB       CYS  47   4.160   2.772   2.706
  347    H    GLU  48           H        GLU  48   6.442   1.757   4.572
  348    HA   GLU  48           HA       GLU  48   5.028   3.139   6.827
  349   1HB   GLU  48          1HB       GLU  48   7.596   1.518   6.835
  350   2HB   GLU  48          2HB       GLU  48   6.992   2.435   8.215
  351   1HG   GLU  48          1HG       GLU  48   4.949   1.092   8.254
  352   2HG   GLU  48          2HG       GLU  48   5.478   0.209   6.822
  353    H    GLY  49           H        GLY  49   5.716   5.256   7.121
  354   1HA   GLY  49          1HA       GLY  49   7.476   6.968   7.083
  355   2HA   GLY  49          2HA       GLY  49   8.224   6.101   5.742
  356    H    LEU  50           H        LEU  50   4.766   6.561   5.864
  357    HA   LEU  50           HA       LEU  50   4.877   8.048   3.319
  358   1HB   LEU  50          1HB       LEU  50   2.489   7.209   4.987
  359   2HB   LEU  50          2HB       LEU  50   2.519   7.545   3.257
  360    HG   LEU  50           HG       LEU  50   4.392   5.439   4.199
  361   1HD1  LEU  50          1HD1      LEU  50   1.797   5.362   5.180
  362   2HD1  LEU  50          2HD1      LEU  50   1.709   4.370   3.725
  363   3HD1  LEU  50          3HD1      LEU  50   2.867   3.973   4.995
  364   1HD2  LEU  50          1HD2      LEU  50   2.796   6.179   1.812
  365   2HD2  LEU  50          2HD2      LEU  50   4.410   5.475   1.913
  366   3HD2  LEU  50          3HD2      LEU  50   2.987   4.448   2.093
  367    HA   PRO  51           HA       PRO  51   4.710  11.918   5.620
  368   1HB   PRO  51          1HB       PRO  51   4.020  13.228   3.140
  369   2HB   PRO  51          2HB       PRO  51   5.558  13.266   4.007
  370   1HG   PRO  51          1HG       PRO  51   4.978  11.921   1.554
  371   2HG   PRO  51          2HG       PRO  51   6.493  11.901   2.461
  372   1HD   PRO  51          1HD       PRO  51   4.574   9.758   2.156
  373   2HD   PRO  51          2HD       PRO  51   6.117   9.730   3.046
  374    H    ASP  52           H        ASP  52   2.956  13.216   6.361
  375    HA   ASP  52           HA       ASP  52   0.344  12.165   6.322
  376   1HB   ASP  52          1HB       ASP  52   1.604  14.831   6.895
  377   2HB   ASP  52          2HB       ASP  52  -0.153  14.681   6.944
  378    H    SER  53           H        SER  53   1.879  14.447   4.094
  379    HA   SER  53           HA       SER  53  -0.592  15.178   2.737
  380   1HB   SER  53          1HB       SER  53   0.859  16.502   1.442
  381   2HB   SER  53          2HB       SER  53   1.732  16.363   2.965
  382    HG   SER  53           HG       SER  53   2.399  15.475   0.498
  383    H    THR  54           H        THR  54   1.018  12.289   2.861
  384    HA   THR  54           HA       THR  54   0.814  11.591  -0.006
  385    HB   THR  54           HB       THR  54   1.565  10.022   2.485
  386    HG1  THR  54           HG1      THR  54   2.830  11.940   1.451
  387   1HG2  THR  54          1HG2      THR  54   0.775   8.876   0.211
  388   2HG2  THR  54          2HG2      THR  54   2.430   9.256  -0.266
  389   3HG2  THR  54          3HG2      THR  54   2.131   8.237   1.140
  390    H    GLN  55           H        GLN  55  -0.857  10.371  -0.861
  391    HA   GLN  55           HA       GLN  55  -3.277   9.990   0.741
  392   1HB   GLN  55          1HB       GLN  55  -2.869  10.617  -1.792
  393   2HB   GLN  55          2HB       GLN  55  -2.803   8.868  -2.006
  394   1HG   GLN  55          1HG       GLN  55  -5.047   9.808  -0.338
  395   2HG   GLN  55          2HG       GLN  55  -5.117  10.330  -2.022
  396   1HE2  GLN  55          2HE2      GLN  55  -6.437   8.874  -3.126
  397   2HE2  GLN  55          1HE2      GLN  55  -6.364   7.186  -2.970
  398    H    THR  56           H        THR  56  -4.293   7.869   1.055
  399    HA   THR  56           HA       THR  56  -2.867   5.407   0.439
  400    HB   THR  56           HB       THR  56  -1.488   6.454   2.252
  401    HG1  THR  56           HG1      THR  56  -1.687   4.170   2.034
  402   1HG2  THR  56          1HG2      THR  56  -3.700   7.417   3.302
  403   2HG2  THR  56          2HG2      THR  56  -3.729   5.876   4.159
  404   3HG2  THR  56          3HG2      THR  56  -2.355   6.966   4.350
  405    H    TRP  57           H        TRP  57  -3.951   3.521   1.631
  406    HA   TRP  57           HA       TRP  57  -6.874   3.887   1.586
  407   1HB   TRP  57          1HB       TRP  57  -5.210   1.974   0.726
  408   2HB   TRP  57          2HB       TRP  57  -5.461   1.362   2.358
  409    HD1  TRP  57           HD1      TRP  57  -7.818   2.837  -0.353
  410    HE1  TRP  57           HE1      TRP  57  -9.892   1.312  -0.512
  411    HE3  TRP  57           HE3      TRP  57  -6.602  -0.668   3.153
  412    HZ2  TRP  57           HZ2      TRP  57 -10.898  -1.084   0.689
  413    HZ3  TRP  57           HZ3      TRP  57  -8.131  -2.560   3.625
  414    HH2  TRP  57           HH2      TRP  57 -10.276  -2.771   2.399
  415    HA   PRO  58           HA       PRO  58  -8.565   2.864   2.299
  416   1HB   PRO  58          1HB       PRO  58 -10.611   3.855   3.942
  417   2HB   PRO  58          2HB       PRO  58 -10.169   2.156   3.748
  418   1HG   PRO  58          1HG       PRO  58  -9.774   3.885   6.057
  419   2HG   PRO  58          2HG       PRO  58  -9.555   2.137   5.931
  420   1HD   PRO  58          1HD       PRO  58  -7.509   4.172   6.029
  421   2HD   PRO  58          2HD       PRO  58  -7.289   2.410   5.892
  422    H    LEU  59           H        LEU  59 -10.044   4.425   1.202
  423    HA   LEU  59           HA       LEU  59  -8.897   7.086   0.977
  424   1HB   LEU  59          1HB       LEU  59 -10.716   5.304  -0.375
  425   2HB   LEU  59          2HB       LEU  59 -11.456   6.899  -0.240
  426    HG   LEU  59           HG       LEU  59  -9.087   7.745  -1.013
  427   1HD1  LEU  59          1HD1      LEU  59  -9.164   4.878  -2.000
  428   2HD1  LEU  59          2HD1      LEU  59  -8.062   6.111  -2.612
  429   3HD1  LEU  59          3HD1      LEU  59  -7.955   5.591  -0.931
  430   1HD2  LEU  59          1HD2      LEU  59 -11.478   6.827  -2.436
  431   2HD2  LEU  59          2HD2      LEU  59 -10.556   8.316  -2.642
  432   3HD2  LEU  59          3HD2      LEU  59 -10.043   6.840  -3.460
  433    HA   PRO  60           HA       PRO  60 -11.373   9.667   3.556
  434   1HB   PRO  60          1HB       PRO  60 -13.075  10.736   1.440
  435   2HB   PRO  60          2HB       PRO  60 -11.814  11.552   2.368
  436   1HG   PRO  60          1HG       PRO  60 -11.665  10.740  -0.342
  437   2HG   PRO  60          2HG       PRO  60 -10.344  11.363   0.651
  438   1HD   PRO  60          1HD       PRO  60 -10.709   8.668  -0.331
  439   2HD   PRO  60          2HD       PRO  60  -9.363   9.306   0.643
  440    H    ASN  61           H        ASN  61 -14.016  10.396   3.584
  441    HA   ASN  61           HA       ASN  61 -15.438   8.174   4.525
  442   1HB   ASN  61          1HB       ASN  61 -15.843  10.814   4.429
  443   2HB   ASN  61          2HB       ASN  61 -16.882  10.362   3.077
  444   1HD2  ASN  61          2HD2      ASN  61 -18.994  10.254   3.850
  445   2HD2  ASN  61          1HD2      ASN  61 -19.461   9.516   5.305
  446    H    LYS  62           H        LYS  62 -15.031   9.330   1.232
  447    HA   LYS  62           HA       LYS  62 -17.079   7.580   0.082
  448   1HB   LYS  62          1HB       LYS  62 -14.743   8.912  -1.311
  449   2HB   LYS  62          2HB       LYS  62 -16.338   8.552  -1.973
  450   1HG   LYS  62          1HG       LYS  62 -17.121  10.116   0.041
  451   2HG   LYS  62          2HG       LYS  62 -15.494  10.768  -0.153
  452   1HD   LYS  62          1HD       LYS  62 -16.858  12.079  -1.598
  453   2HD   LYS  62          2HD       LYS  62 -16.035  10.935  -2.661
  454   1HE   LYS  62          1HE       LYS  62 -18.368  10.925  -3.302
  455   2HE   LYS  62          2HE       LYS  62 -18.092   9.424  -2.395
  456   1HZ   LYS  62          1HZ       LYS  62 -18.582  11.164  -0.421
  457   2HZ   LYS  62          2HZ       LYS  62 -19.592  11.786  -1.636
  458   3HZ   LYS  62          3HZ       LYS  62 -19.770  10.177  -1.121
  459    H    THR  63           H        THR  63 -16.654   5.379   0.347
  460    HA   THR  63           HA       THR  63 -13.908   4.344   0.197
  461    HB   THR  63           HB       THR  63 -16.360   2.636   0.223
  462    HG1  THR  63           HG1      THR  63 -15.609   4.517   2.180
  463   1HG2  THR  63          1HG2      THR  63 -13.728   2.708   1.718
  464   2HG2  THR  63          2HG2      THR  63 -15.011   1.549   2.064
  465   3HG2  THR  63          3HG2      THR  63 -14.224   1.548   0.486
  466    H    CYS  64           H        CYS  64 -13.462   2.460  -1.283
  467    HA   CYS  64           HA       CYS  64 -13.953   3.125  -4.035
  468   1HB   CYS  64          1HB       CYS  64 -12.017   1.863  -2.929
  469   2HB   CYS  64          2HB       CYS  64 -13.085   0.462  -2.883
  Start of MODEL   32
    1   1H    LYS   1          1H        LYS   1   6.253   5.541   9.647
    2   2H    LYS   1          2H        LYS   1   5.988   6.888  10.646
    3   3H    LYS   1          3H        LYS   1   6.019   5.327  11.317
    4    HA   LYS   1           HA       LYS   1   3.778   5.484  11.180
    5   1HB   LYS   1          1HB       LYS   1   4.376   7.909  10.363
    6   2HB   LYS   1          2HB       LYS   1   3.980   7.274   8.765
    7   1HG   LYS   1          1HG       LYS   1   1.996   6.532  10.784
    8   2HG   LYS   1          2HG       LYS   1   2.153   8.278  10.600
    9   1HD   LYS   1          1HD       LYS   1   0.690   7.942   8.872
   10   2HD   LYS   1          2HD       LYS   1   2.168   7.545   7.995
   11   1HE   LYS   1          1HE       LYS   1   1.548   5.373   7.770
   12   2HE   LYS   1          2HE       LYS   1   1.126   5.249   9.490
   13   1HZ   LYS   1          1HZ       LYS   1  -0.527   6.679   7.478
   14   2HZ   LYS   1          2HZ       LYS   1  -0.816   5.074   7.959
   15   3HZ   LYS   1          3HZ       LYS   1  -0.942   6.332   9.090
   16    H    ASP   2           H        ASP   2   3.175   3.467  10.455
   17    HA   ASP   2           HA       ASP   2   3.782   2.662   7.656
   18   1HB   ASP   2          1HB       ASP   2   2.449   1.039   9.834
   19   2HB   ASP   2          2HB       ASP   2   3.404   0.455   8.470
   20    H    GLY   3           H        GLY   3   2.031   1.806   6.299
   21   1HA   GLY   3          1HA       GLY   3  -0.744   2.161   7.146
   22   2HA   GLY   3          2HA       GLY   3  -0.217   3.357   5.964
   23    H    TYR   4           H        TYR   4  -2.061   2.121   4.782
   24    HA   TYR   4           HA       TYR   4  -0.909  -0.270   3.386
   25   1HB   TYR   4          1HB       TYR   4  -3.617   0.517   4.374
   26   2HB   TYR   4          2HB       TYR   4  -3.533  -0.479   2.919
   27    HD1  TYR   4           HD1      TYR   4  -2.141  -2.624   2.995
   28    HD2  TYR   4           HD2      TYR   4  -3.268  -0.433   6.513
   29    HE1  TYR   4           HE1      TYR   4  -1.681  -4.625   4.387
   30    HE2  TYR   4           HE2      TYR   4  -2.809  -2.434   7.906
   31    HH   TYR   4           HH       TYR   4  -1.807  -4.473   7.914
   32    H    LEU   5           H        LEU   5  -1.031  -0.317   1.115
   33    HA   LEU   5           HA       LEU   5  -1.112   2.266  -0.229
   34   1HB   LEU   5          1HB       LEU   5  -0.386  -0.540  -0.747
   35   2HB   LEU   5          2HB       LEU   5  -1.057   0.279  -2.157
   36    HG   LEU   5           HG       LEU   5   1.317   1.157  -0.491
   37   1HD1  LEU   5          1HD1      LEU   5   0.982  -0.397  -2.889
   38   2HD1  LEU   5          2HD1      LEU   5   1.816   1.108  -3.285
   39   3HD1  LEU   5          3HD1      LEU   5   2.477   0.030  -2.055
   40   1HD2  LEU   5          1HD2      LEU   5  -0.380   2.606  -2.507
   41   2HD2  LEU   5          2HD2      LEU   5   0.322   3.210  -1.006
   42   3HD2  LEU   5          3HD2      LEU   5   1.346   2.954  -2.418
   43    H    VAL   6           H        VAL   6  -2.556   2.690  -2.099
   44    HA   VAL   6           HA       VAL   6  -5.228   1.339  -1.840
   45    HB   VAL   6           HB       VAL   6  -6.220   3.521  -2.172
   46   1HG1  VAL   6          1HG1      VAL   6  -3.913   3.539  -0.215
   47   2HG1  VAL   6          2HG1      VAL   6  -5.114   4.828  -0.287
   48   3HG1  VAL   6          3HG1      VAL   6  -5.608   3.185   0.118
   49   1HG2  VAL   6          1HG2      VAL   6  -3.517   4.113  -3.187
   50   2HG2  VAL   6          2HG2      VAL   6  -5.066   4.834  -3.626
   51   3HG2  VAL   6          3HG2      VAL   6  -4.206   5.395  -2.191
   52    H    GLU   7           H        GLU   7  -6.461   2.492  -4.000
   53    HA   GLU   7           HA       GLU   7  -4.802   1.536  -6.308
   54   1HB   GLU   7          1HB       GLU   7  -7.370   0.859  -5.318
   55   2HB   GLU   7          2HB       GLU   7  -7.644   1.757  -6.811
   56   1HG   GLU   7          1HG       GLU   7  -5.699   0.219  -7.724
   57   2HG   GLU   7          2HG       GLU   7  -6.196  -0.832  -6.399
   58    H    LYS   8           H        LYS   8  -5.132   2.761  -8.354
   59    HA   LYS   8           HA       LYS   8  -4.783   5.518  -8.204
   60   1HB   LYS   8          1HB       LYS   8  -5.207   3.522 -10.165
   61   2HB   LYS   8          2HB       LYS   8  -6.343   4.821 -10.535
   62   1HG   LYS   8          1HG       LYS   8  -3.367   5.178 -10.070
   63   2HG   LYS   8          2HG       LYS   8  -4.163   5.195 -11.643
   64   1HD   LYS   8          1HD       LYS   8  -4.684   7.367 -11.388
   65   2HD   LYS   8          2HD       LYS   8  -5.539   7.006  -9.888
   66   1HE   LYS   8          1HE       LYS   8  -3.148   6.918  -8.825
   67   2HE   LYS   8          2HE       LYS   8  -2.668   7.842 -10.264
   68   1HZ   LYS   8          1HZ       LYS   8  -5.106   8.608  -8.813
   69   2HZ   LYS   8          2HZ       LYS   8  -3.600   9.080  -8.184
   70   3HZ   LYS   8          3HZ       LYS   8  -4.064   9.570  -9.743
   71    H    THR   9           H        THR   9  -7.808   3.720  -8.066
   72    HA   THR   9           HA       THR   9  -9.416   6.215  -8.197
   73    HB   THR   9           HB       THR   9 -11.263   4.417  -8.044
   74    HG1  THR   9           HG1      THR   9 -10.534   2.325  -8.438
   75   1HG2  THR   9          1HG2      THR   9  -9.378   5.017 -10.212
   76   2HG2  THR   9          2HG2      THR   9 -10.226   3.486 -10.420
   77   3HG2  THR   9          3HG2      THR   9 -11.140   4.982 -10.233
   78    H    GLY  10           H        GLY  10  -7.789   4.463  -5.853
   79   1HA   GLY  10          1HA       GLY  10  -7.861   5.189  -3.519
   80   2HA   GLY  10          2HA       GLY  10  -9.577   5.538  -3.719
   81    H    CYS  11           H        CYS  11  -9.455   2.787  -5.318
   82    HA   CYS  11           HA       CYS  11 -10.699   1.157  -3.371
   83   1HB   CYS  11          1HB       CYS  11  -9.209   0.714  -5.947
   84   2HB   CYS  11          2HB       CYS  11  -9.749  -0.681  -5.014
   85    H    LYS  12           H        LYS  12  -9.350  -1.229  -3.163
   86    HA   LYS  12           HA       LYS  12  -6.995  -0.450  -1.504
   87   1HB   LYS  12          1HB       LYS  12  -7.452  -2.834  -0.583
   88   2HB   LYS  12          2HB       LYS  12  -8.573  -1.555  -0.157
   89   1HG   LYS  12          1HG       LYS  12  -9.769  -3.607  -0.824
   90   2HG   LYS  12          2HG       LYS  12 -10.102  -2.304  -1.957
   91   1HD   LYS  12          1HD       LYS  12  -8.943  -3.317  -3.664
   92   2HD   LYS  12          2HD       LYS  12  -7.756  -4.026  -2.570
   93   1HE   LYS  12          1HE       LYS  12  -9.083  -5.854  -3.439
   94   2HE   LYS  12          2HE       LYS  12  -9.625  -5.590  -1.769
   95   1HZ   LYS  12          1HZ       LYS  12 -10.863  -4.062  -3.955
   96   2HZ   LYS  12          2HZ       LYS  12 -11.366  -5.660  -3.674
   97   3HZ   LYS  12          3HZ       LYS  12 -11.511  -4.494  -2.448
   98    H    LYS  13           H        LYS  13  -5.296  -2.251  -1.410
   99    HA   LYS  13           HA       LYS  13  -4.900  -3.476  -4.122
  100   1HB   LYS  13          1HB       LYS  13  -3.580  -1.299  -3.130
  101   2HB   LYS  13          2HB       LYS  13  -2.532  -2.602  -2.567
  102   1HG   LYS  13          1HG       LYS  13  -3.357  -3.065  -5.308
  103   2HG   LYS  13          2HG       LYS  13  -2.586  -1.487  -5.145
  104   1HD   LYS  13          1HD       LYS  13  -0.557  -2.422  -4.864
  105   2HD   LYS  13          2HD       LYS  13  -1.169  -3.505  -3.615
  106   1HE   LYS  13          1HE       LYS  13  -1.093  -5.236  -5.069
  107   2HE   LYS  13          2HE       LYS  13  -2.194  -4.372  -6.161
  108   1HZ   LYS  13          1HZ       LYS  13  -0.203  -3.011  -6.822
  109   2HZ   LYS  13          2HZ       LYS  13   0.760  -4.149  -6.008
  110   3HZ   LYS  13          3HZ       LYS  13  -0.180  -4.624  -7.342
  111    H    THR  14           H        THR  14  -6.026  -5.069  -2.298
  112    HA   THR  14           HA       THR  14  -4.479  -6.334  -0.315
  113    HB   THR  14           HB       THR  14  -6.432  -7.697  -2.180
  114    HG1  THR  14           HG1      THR  14  -7.121  -6.177   0.091
  115   1HG2  THR  14          1HG2      THR  14  -5.113  -8.450   0.207
  116   2HG2  THR  14          2HG2      THR  14  -6.798  -8.149   0.638
  117   3HG2  THR  14          3HG2      THR  14  -6.404  -9.315  -0.625
  118    H    CYS  15           H        CYS  15  -3.185  -8.236  -0.345
  119    HA   CYS  15           HA       CYS  15  -2.247  -9.185  -3.026
  120   1HB   CYS  15          1HB       CYS  15   0.070  -9.162  -1.942
  121   2HB   CYS  15          2HB       CYS  15  -0.626  -7.575  -2.271
  122    H    TYR  16           H        TYR  16  -1.677 -11.424  -3.027
  123    HA   TYR  16           HA       TYR  16  -2.588 -12.925  -0.618
  124   1HB   TYR  16          1HB       TYR  16  -2.384 -13.375  -3.562
  125   2HB   TYR  16          2HB       TYR  16  -2.273 -14.791  -2.519
  126    HD1  TYR  16           HD1      TYR  16  -4.142 -11.997  -1.172
  127    HD2  TYR  16           HD2      TYR  16  -4.452 -15.523  -3.608
  128    HE1  TYR  16           HE1      TYR  16  -6.604 -11.980  -0.884
  129    HE2  TYR  16           HE2      TYR  16  -6.915 -15.502  -3.320
  130    HH   TYR  16           HH       TYR  16  -8.479 -13.493  -1.013
  131    H    LYS  17           H        LYS  17   0.287 -12.256  -2.513
  132    HA   LYS  17           HA       LYS  17   1.834 -14.510  -1.484
  133   1HB   LYS  17          1HB       LYS  17   2.453 -11.931  -2.950
  134   2HB   LYS  17          2HB       LYS  17   3.699 -13.110  -2.539
  135   1HG   LYS  17          1HG       LYS  17   1.555 -14.562  -3.697
  136   2HG   LYS  17          2HG       LYS  17   1.837 -13.163  -4.731
  137   1HD   LYS  17          1HD       LYS  17   3.393 -14.640  -5.612
  138   2HD   LYS  17          2HD       LYS  17   4.380 -13.840  -4.387
  139   1HE   LYS  17          1HE       LYS  17   4.746 -16.185  -4.053
  140   2HE   LYS  17          2HE       LYS  17   3.591 -15.722  -2.789
  141   1HZ   LYS  17          1HZ       LYS  17   2.206 -16.259  -5.190
  142   2HZ   LYS  17          2HZ       LYS  17   3.206 -17.582  -4.823
  143   3HZ   LYS  17          3HZ       LYS  17   2.068 -17.043  -3.688
  144    H    LEU  18           H        LEU  18   1.351 -14.107   0.862
  145    HA   LEU  18           HA       LEU  18   2.155 -11.726   2.243
  146   1HB   LEU  18          1HB       LEU  18   1.760 -14.628   3.009
  147   2HB   LEU  18          2HB       LEU  18   2.138 -13.386   4.204
  148    HG   LEU  18           HG       LEU  18  -0.181 -13.167   2.271
  149   1HD1  LEU  18          1HD1      LEU  18   0.068 -14.517   4.928
  150   2HD1  LEU  18          2HD1      LEU  18  -1.410 -13.614   4.594
  151   3HD1  LEU  18          3HD1      LEU  18  -0.934 -14.947   3.542
  152   1HD2  LEU  18          1HD2      LEU  18   1.017 -11.500   4.383
  153   2HD2  LEU  18          2HD2      LEU  18  -0.044 -11.037   3.054
  154   3HD2  LEU  18          3HD2      LEU  18  -0.729 -11.700   4.537
  155    H    GLY  19           H        GLY  19   4.101 -11.313   3.438
  156   1HA   GLY  19          1HA       GLY  19   6.321 -12.057   4.232
  157   2HA   GLY  19          2HA       GLY  19   6.387 -13.139   2.847
  158    H    GLU  20           H        GLU  20   8.452 -12.115   2.383
  159    HA   GLU  20           HA       GLU  20   8.809  -9.346   1.804
  160   1HB   GLU  20          1HB       GLU  20  10.603 -11.005   2.133
  161   2HB   GLU  20          2HB       GLU  20  10.126 -11.825   0.646
  162   1HG   GLU  20          1HG       GLU  20  10.440  -9.105  -0.042
  163   2HG   GLU  20          2HG       GLU  20  11.824  -9.507   0.977
  164    H    ASN  21           H        ASN  21   6.549  -9.192   0.671
  165    HA   ASN  21           HA       ASN  21   6.477 -10.132  -2.121
  166   1HB   ASN  21          1HB       ASN  21   4.525 -10.060  -0.526
  167   2HB   ASN  21          2HB       ASN  21   4.619  -8.300  -0.567
  168   1HD2  ASN  21          2HD2      ASN  21   2.423 -10.104  -1.599
  169   2HD2  ASN  21          1HD2      ASN  21   2.258  -9.705  -3.241
  170    H    ASP  22           H        ASP  22   8.430  -8.875  -2.800
  171    HA   ASP  22           HA       ASP  22   8.838  -6.118  -2.621
  172   1HB   ASP  22          1HB       ASP  22   9.720  -8.351  -4.180
  173   2HB   ASP  22          2HB       ASP  22   9.469  -6.989  -5.272
  174    H    PHE  23           H        PHE  23   6.587  -7.852  -4.750
  175    HA   PHE  23           HA       PHE  23   5.870  -5.993  -6.659
  176   1HB   PHE  23          1HB       PHE  23   4.778  -8.270  -5.411
  177   2HB   PHE  23          2HB       PHE  23   3.506  -7.050  -5.349
  178    HD1  PHE  23           HD1      PHE  23   4.291  -5.500  -7.844
  179    HD2  PHE  23           HD2      PHE  23   3.909  -9.712  -7.093
  180    HE1  PHE  23           HE1      PHE  23   3.826  -5.888 -10.249
  181    HE2  PHE  23           HE2      PHE  23   3.449 -10.100  -9.497
  182    HZ   PHE  23           HZ       PHE  23   3.407  -8.189 -11.077
  183    H    CYS  24           H        CYS  24   4.353  -6.094  -3.394
  184    HA   CYS  24           HA       CYS  24   2.953  -3.627  -3.595
  185   1HB   CYS  24          1HB       CYS  24   4.155  -5.208  -1.307
  186   2HB   CYS  24          2HB       CYS  24   3.182  -3.769  -1.033
  187    H    ASN  25           H        ASN  25   6.114  -4.293  -2.052
  188    HA   ASN  25           HA       ASN  25   6.878  -1.709  -1.321
  189   1HB   ASN  25          1HB       ASN  25   8.013  -4.041  -1.097
  190   2HB   ASN  25          2HB       ASN  25   8.754  -3.666  -2.654
  191   1HD2  ASN  25          2HD2      ASN  25  10.740  -3.812  -1.024
  192   2HD2  ASN  25          1HD2      ASN  25  11.216  -2.338  -0.333
  193    H    ARG  26           H        ARG  26   7.097  -3.241  -4.528
  194    HA   ARG  26           HA       ARG  26   8.565  -1.223  -5.886
  195   1HB   ARG  26          1HB       ARG  26   7.241  -3.632  -6.432
  196   2HB   ARG  26          2HB       ARG  26   6.441  -2.446  -7.466
  197   1HG   ARG  26          1HG       ARG  26   9.359  -2.141  -7.415
  198   2HG   ARG  26          2HG       ARG  26   8.838  -3.706  -8.038
  199   1HD   ARG  26          1HD       ARG  26   7.131  -2.288  -9.448
  200   2HD   ARG  26          2HD       ARG  26   8.261  -0.959  -9.127
  201    HE   ARG  26           HE       ARG  26   9.877  -3.109  -9.885
  202   1HH1  ARG  26          1HH1      ARG  26   7.217  -1.346 -11.209
  203   2HH1  ARG  26          2HH1      ARG  26   7.705  -1.593 -12.852
  204   1HH2  ARG  26          1HH2      ARG  26  10.526  -3.431 -12.023
  205   2HH2  ARG  26          2HH2      ARG  26   9.576  -2.771 -13.312
  206    H    GLU  27           H        GLU  27   5.002  -1.635  -5.667
  207    HA   GLU  27           HA       GLU  27   4.420   0.889  -6.963
  208   1HB   GLU  27          1HB       GLU  27   2.858  -1.027  -5.206
  209   2HB   GLU  27          2HB       GLU  27   2.127   0.362  -6.007
  210   1HG   GLU  27          1HG       GLU  27   3.298  -0.646  -8.149
  211   2HG   GLU  27          2HG       GLU  27   3.250  -2.140  -7.212
  212    H    CYS  28           H        CYS  28   4.430  -0.180  -3.553
  213    HA   CYS  28           HA       CYS  28   3.526   2.109  -2.250
  214   1HB   CYS  28          1HB       CYS  28   4.173  -0.059  -1.230
  215   2HB   CYS  28          2HB       CYS  28   5.870   0.328  -1.514
  216    H    LYS  29           H        LYS  29   6.780   1.527  -3.590
  217    HA   LYS  29           HA       LYS  29   7.503   4.345  -2.872
  218   1HB   LYS  29          1HB       LYS  29   8.915   2.582  -1.929
  219   2HB   LYS  29          2HB       LYS  29   9.169   1.897  -3.535
  220   1HG   LYS  29          1HG       LYS  29  10.547   3.645  -4.212
  221   2HG   LYS  29          2HG       LYS  29   9.843   4.780  -3.059
  222   1HD   LYS  29          1HD       LYS  29  12.047   4.217  -2.258
  223   2HD   LYS  29          2HD       LYS  29  10.882   3.412  -1.207
  224   1HE   LYS  29          1HE       LYS  29  11.831   1.898  -3.608
  225   2HE   LYS  29          2HE       LYS  29  12.951   2.067  -2.240
  226   1HZ   LYS  29          1HZ       LYS  29  10.988   1.448  -0.799
  227   2HZ   LYS  29          2HZ       LYS  29  10.205   0.954  -2.225
  228   3HZ   LYS  29          3HZ       LYS  29  11.640   0.193  -1.740
  229    H    TRP  30           H        TRP  30   6.186   2.844  -5.439
  230    HA   TRP  30           HA       TRP  30   7.727   3.149  -7.723
  231   1HB   TRP  30          1HB       TRP  30   5.021   2.928  -7.037
  232   2HB   TRP  30          2HB       TRP  30   5.100   4.403  -7.999
  233    HD1  TRP  30           HD1      TRP  30   4.048   1.272  -8.751
  234    HE1  TRP  30           HE1      TRP  30   4.839   0.351 -11.025
  235    HE3  TRP  30           HE3      TRP  30   7.999   4.385  -9.651
  236    HZ2  TRP  30           HZ2      TRP  30   6.872   0.865 -12.967
  237    HZ3  TRP  30           HZ3      TRP  30   9.342   4.148 -11.716
  238    HH2  TRP  30           HH2      TRP  30   8.784   2.393 -13.376
  239    H    LYS  31           H        LYS  31   5.822   5.779  -6.195
  240    HA   LYS  31           HA       LYS  31   7.308   7.802  -7.771
  241   1HB   LYS  31          1HB       LYS  31   4.783   7.527  -6.313
  242   2HB   LYS  31          2HB       LYS  31   5.586   9.064  -5.986
  243   1HG   LYS  31          1HG       LYS  31   5.564   8.225  -8.828
  244   2HG   LYS  31          2HG       LYS  31   3.991   8.644  -8.148
  245   1HD   LYS  31          1HD       LYS  31   5.944  10.567  -7.271
  246   2HD   LYS  31          2HD       LYS  31   6.017  10.422  -9.027
  247   1HE   LYS  31          1HE       LYS  31   3.899  11.280  -9.318
  248   2HE   LYS  31          2HE       LYS  31   3.291  10.554  -7.817
  249   1HZ   LYS  31          1HZ       LYS  31   4.664  12.124  -6.567
  250   2HZ   LYS  31          2HZ       LYS  31   5.165  12.853  -8.014
  251   3HZ   LYS  31          3HZ       LYS  31   3.534  12.934  -7.544
  252    H    HIS  32           H        HIS  32   8.547   9.480  -6.724
  253    HA   HIS  32           HA       HIS  32  10.224   8.686  -4.575
  254   1HB   HIS  32          1HB       HIS  32  10.204  10.641  -6.423
  255   2HB   HIS  32          2HB       HIS  32   9.640  11.576  -5.039
  256    HD1  HIS  32           HD1      HIS  32  11.347   9.791  -2.953
  257    HD2  HIS  32           HD2      HIS  32  12.819  11.784  -6.306
  258    HE1  HIS  32           HE1      HIS  32  13.817  10.163  -2.538
  259    H    ILE  33           H        ILE  33   8.944   7.970  -2.779
  260    HA   ILE  33           HA       ILE  33   7.343  10.110  -1.420
  261    HB   ILE  33           HB       ILE  33   7.127   7.087  -1.368
  262   1HG1  ILE  33          1HG1      ILE  33   4.886   8.777  -2.288
  263   2HG1  ILE  33          2HG1      ILE  33   6.308   8.810  -3.332
  264   1HG2  ILE  33          1HG2      ILE  33   5.783   9.286   0.169
  265   2HG2  ILE  33          2HG2      ILE  33   4.857   7.844  -0.251
  266   3HG2  ILE  33          3HG2      ILE  33   6.317   7.700   0.728
  267   1HD1  ILE  33          1HD1      ILE  33   5.758   6.109  -2.452
  268   2HD1  ILE  33          2HD1      ILE  33   4.338   6.810  -3.232
  269   3HD1  ILE  33          3HD1      ILE  33   5.874   6.741  -4.095
  270    H    GLY  34           H        GLY  34   9.807   7.612  -1.055
  271   1HA   GLY  34          1HA       GLY  34  11.603   7.795   0.557
  272   2HA   GLY  34          2HA       GLY  34  10.571   8.829   1.543
  273    H    GLY  35           H        GLY  35   9.714   5.713   0.098
  274   1HA   GLY  35          1HA       GLY  35   8.795   4.772   2.728
  275   2HA   GLY  35          2HA       GLY  35   8.591   3.923   1.195
  276    H    SER  36           H        SER  36  10.085   3.636   4.075
  277    HA   SER  36           HA       SER  36  12.767   2.836   3.366
  278   1HB   SER  36          1HB       SER  36  12.801   2.065   5.660
  279   2HB   SER  36          2HB       SER  36  11.842   3.542   5.616
  280    HG   SER  36           HG       SER  36  10.400   2.311   6.538
  281    H    TYR  37           H        TYR  37   9.763   0.975   3.986
  282    HA   TYR  37           HA       TYR  37  10.505  -1.085   2.068
  283   1HB   TYR  37          1HB       TYR  37  11.695  -1.199   4.592
  284   2HB   TYR  37          2HB       TYR  37  10.360  -2.346   4.698
  285    HD1  TYR  37           HD1      TYR  37  10.089  -3.618   2.198
  286    HD2  TYR  37           HD2      TYR  37  13.705  -2.238   4.062
  287    HE1  TYR  37           HE1      TYR  37  11.396  -5.261   0.878
  288    HE2  TYR  37           HE2      TYR  37  15.013  -3.883   2.745
  289    HH   TYR  37           HH       TYR  37  13.807  -6.471   1.317
  290    H    GLY  38           H        GLY  38   8.710  -2.416   1.621
  291   1HA   GLY  38          1HA       GLY  38   6.398  -2.349   3.474
  292   2HA   GLY  38          2HA       GLY  38   6.137  -1.742   1.838
  293    H    TYR  39           H        TYR  39   5.160  -4.241   3.331
  294    HA   TYR  39           HA       TYR  39   5.757  -6.132   1.096
  295   1HB   TYR  39          1HB       TYR  39   5.899  -7.895   3.014
  296   2HB   TYR  39          2HB       TYR  39   7.294  -6.853   2.740
  297    HD1  TYR  39           HD1      TYR  39   4.010  -6.575   4.560
  298    HD2  TYR  39           HD2      TYR  39   8.270  -6.037   4.677
  299    HE1  TYR  39           HE1      TYR  39   3.838  -5.698   6.875
  300    HE2  TYR  39           HE2      TYR  39   8.095  -5.165   6.994
  301    HH   TYR  39           HH       TYR  39   4.954  -4.592   8.505
  302    H    CYS  40           H        CYS  40   4.281  -8.220   1.616
  303    HA   CYS  40           HA       CYS  40   1.518  -7.210   1.749
  304   1HB   CYS  40          1HB       CYS  40   2.404  -8.861   0.068
  305   2HB   CYS  40          2HB       CYS  40   2.628 -10.014   1.385
  306    H    TYR  41           H        TYR  41   0.991  -6.772   3.917
  307    HA   TYR  41           HA       TYR  41   1.350  -9.022   5.873
  308   1HB   TYR  41          1HB       TYR  41   2.654  -7.033   6.407
  309   2HB   TYR  41          2HB       TYR  41   1.231  -6.008   6.219
  310    HD1  TYR  41           HD1      TYR  41   1.148  -9.363   7.772
  311    HD2  TYR  41           HD2      TYR  41   1.216  -5.126   8.479
  312    HE1  TYR  41           HE1      TYR  41   0.557  -9.750  10.149
  313    HE2  TYR  41           HE2      TYR  41   0.624  -5.513  10.856
  314    HH   TYR  41           HH       TYR  41   1.029  -7.830  12.497
  315    H    GLY  42           H        GLY  42  -0.597 -10.018   6.232
  316   1HA   GLY  42          1HA       GLY  42  -2.878 -10.240   6.787
  317   2HA   GLY  42          2HA       GLY  42  -2.935  -8.491   7.015
  318    H    PHE  43           H        PHE  43  -1.893 -10.139   4.072
  319    HA   PHE  43           HA       PHE  43  -2.749 -10.032   1.878
  320   1HB   PHE  43          1HB       PHE  43  -5.321  -9.722   3.466
  321   2HB   PHE  43          2HB       PHE  43  -5.213 -10.211   1.774
  322    HD1  PHE  43           HD1      PHE  43  -4.517 -11.215   5.261
  323    HD2  PHE  43           HD2      PHE  43  -4.426 -12.420   1.138
  324    HE1  PHE  43           HE1      PHE  43  -4.145 -13.567   5.955
  325    HE2  PHE  43           HE2      PHE  43  -4.058 -14.771   1.833
  326    HZ   PHE  43           HZ       PHE  43  -3.917 -15.346   4.241
  327    H    GLY  44           H        GLY  44  -1.563  -7.759   2.395
  328   1HA   GLY  44          1HA       GLY  44  -2.912  -5.755   0.889
  329   2HA   GLY  44          2HA       GLY  44  -3.082  -5.366   2.604
  330    H    CYS  45           H        CYS  45  -1.371  -4.222   0.269
  331    HA   CYS  45           HA       CYS  45   1.389  -4.703   0.952
  332   1HB   CYS  45          1HB       CYS  45   0.050  -2.328  -0.376
  333   2HB   CYS  45          2HB       CYS  45   1.746  -2.773  -0.520
  334    H    TYR  46           H        TYR  46   1.908  -4.302   3.126
  335    HA   TYR  46           HA       TYR  46   1.014  -1.755   4.376
  336   1HB   TYR  46          1HB       TYR  46   1.056  -4.217   5.344
  337   2HB   TYR  46          2HB       TYR  46   2.750  -3.842   5.665
  338    HD1  TYR  46           HD1      TYR  46  -0.360  -1.748   5.790
  339    HD2  TYR  46           HD2      TYR  46   2.998  -3.349   7.937
  340    HE1  TYR  46           HE1      TYR  46  -1.029  -0.455   7.798
  341    HE2  TYR  46           HE2      TYR  46   2.330  -2.056   9.945
  342    HH   TYR  46           HH       TYR  46   1.026  -0.053  10.489
  343    H    CYS  47           H        CYS  47   2.417  -0.025   4.527
  344    HA   CYS  47           HA       CYS  47   5.298  -0.515   3.833
  345   1HB   CYS  47          1HB       CYS  47   3.438   1.845   3.445
  346   2HB   CYS  47          2HB       CYS  47   5.161   1.890   3.076
  347    H    GLU  48           H        GLU  48   6.835   1.006   4.924
  348    HA   GLU  48           HA       GLU  48   5.823   1.950   7.585
  349   1HB   GLU  48          1HB       GLU  48   8.367   0.445   6.890
  350   2HB   GLU  48          2HB       GLU  48   7.995   1.092   8.490
  351   1HG   GLU  48          1HG       GLU  48   6.493  -0.557   8.944
  352   2HG   GLU  48          2HG       GLU  48   5.853  -0.558   7.301
  353    H    GLY  49           H        GLY  49   6.161   4.125   7.725
  354   1HA   GLY  49          1HA       GLY  49   7.837   5.940   7.885
  355   2HA   GLY  49          2HA       GLY  49   8.629   5.251   6.467
  356    H    LEU  50           H        LEU  50   5.259   5.115   6.204
  357    HA   LEU  50           HA       LEU  50   5.103   6.797   3.918
  358   1HB   LEU  50          1HB       LEU  50   3.117   5.734   5.933
  359   2HB   LEU  50          2HB       LEU  50   2.600   6.667   4.529
  360    HG   LEU  50           HG       LEU  50   4.085   4.028   4.538
  361   1HD1  LEU  50          1HD1      LEU  50   1.514   4.222   4.778
  362   2HD1  LEU  50          2HD1      LEU  50   1.534   4.759   3.099
  363   3HD1  LEU  50          3HD1      LEU  50   2.136   3.157   3.519
  364   1HD2  LEU  50          1HD2      LEU  50   3.850   6.158   2.465
  365   2HD2  LEU  50          2HD2      LEU  50   5.126   4.966   2.712
  366   3HD2  LEU  50          3HD2      LEU  50   3.619   4.496   1.925
  367    HA   PRO  51           HA       PRO  51   5.425  10.671   6.272
  368   1HB   PRO  51          1HB       PRO  51   5.076  12.035   3.755
  369   2HB   PRO  51          2HB       PRO  51   6.552  11.871   4.710
  370   1HG   PRO  51          1HG       PRO  51   5.940  10.600   2.224
  371   2HG   PRO  51          2HG       PRO  51   7.382  10.383   3.220
  372   1HD   PRO  51          1HD       PRO  51   5.203   8.521   2.804
  373   2HD   PRO  51          2HD       PRO  51   6.683   8.281   3.763
  374    H    ASP  52           H        ASP  52   3.897  12.590   6.427
  375    HA   ASP  52           HA       ASP  52   1.135  11.727   6.397
  376   1HB   ASP  52          1HB       ASP  52   2.695  13.641   7.640
  377   2HB   ASP  52          2HB       ASP  52   1.684  14.610   6.565
  378    H    SER  53           H        SER  53   3.166  13.159   4.006
  379    HA   SER  53           HA       SER  53   1.015  14.508   2.529
  380   1HB   SER  53          1HB       SER  53   3.940  13.891   2.111
  381   2HB   SER  53          2HB       SER  53   2.975  14.617   0.830
  382    HG   SER  53           HG       SER  53   3.912  15.687   3.188
  383    H    THR  54           H        THR  54   2.270  11.299   2.734
  384    HA   THR  54           HA       THR  54   1.496  10.523   0.003
  385    HB   THR  54           HB       THR  54   2.404   8.961   2.440
  386    HG1  THR  54           HG1      THR  54   4.200   9.899   1.920
  387   1HG2  THR  54          1HG2      THR  54   1.227   8.008   0.105
  388   2HG2  THR  54          2HG2      THR  54   2.956   7.841  -0.197
  389   3HG2  THR  54          3HG2      THR  54   2.230   7.075   1.217
  390    H    GLN  55           H        GLN  55  -0.432   9.554  -0.554
  391    HA   GLN  55           HA       GLN  55  -2.537   9.339   1.523
  392   1HB   GLN  55          1HB       GLN  55  -2.821  10.510  -0.690
  393   2HB   GLN  55          2HB       GLN  55  -2.637   8.946  -1.484
  394   1HG   GLN  55          1HG       GLN  55  -5.014   9.447  -1.215
  395   2HG   GLN  55          2HG       GLN  55  -4.575   8.088  -0.180
  396   1HE2  GLN  55          2HE2      GLN  55  -6.489   8.722   1.185
  397   2HE2  GLN  55          1HE2      GLN  55  -6.329  10.002   2.288
  398    H    THR  56           H        THR  56  -3.461   7.352   2.126
  399    HA   THR  56           HA       THR  56  -2.690   4.897   0.644
  400    HB   THR  56           HB       THR  56  -2.256   4.245   3.318
  401    HG1  THR  56           HG1      THR  56  -1.635   5.990   4.263
  402   1HG2  THR  56          1HG2      THR  56  -0.957   4.032   0.919
  403   2HG2  THR  56          2HG2      THR  56   0.116   5.115   1.804
  404   3HG2  THR  56          3HG2      THR  56  -0.277   3.529   2.467
  405    H    TRP  57           H        TRP  57  -3.681   2.949   2.080
  406    HA   TRP  57           HA       TRP  57  -6.569   3.553   2.374
  407   1HB   TRP  57          1HB       TRP  57  -5.066   1.593   1.187
  408   2HB   TRP  57          2HB       TRP  57  -5.435   0.840   2.732
  409    HD1  TRP  57           HD1      TRP  57  -7.443   2.837   0.073
  410    HE1  TRP  57           HE1      TRP  57  -9.724   1.677  -0.232
  411    HE3  TRP  57           HE3      TRP  57  -6.958  -0.967   3.449
  412    HZ2  TRP  57           HZ2      TRP  57 -11.155  -0.570   0.816
  413    HZ3  TRP  57           HZ3      TRP  57  -8.793  -2.600   3.774
  414    HH2  TRP  57           HH2      TRP  57 -10.889  -2.407   2.463
  415    HA   PRO  58           HA       PRO  58  -8.216   2.424   3.198
  416   1HB   PRO  58          1HB       PRO  58  -9.968   3.249   5.243
  417   2HB   PRO  58          2HB       PRO  58  -9.642   1.583   4.755
  418   1HG   PRO  58          1HG       PRO  58  -8.860   2.930   7.202
  419   2HG   PRO  58          2HG       PRO  58  -8.682   1.225   6.777
  420   1HD   PRO  58          1HD       PRO  58  -6.629   3.264   6.871
  421   2HD   PRO  58          2HD       PRO  58  -6.444   1.533   6.488
  422    H    LEU  59           H        LEU  59  -9.829   4.147   2.541
  423    HA   LEU  59           HA       LEU  59  -8.618   6.836   2.784
  424   1HB   LEU  59          1HB       LEU  59  -9.636   7.187   0.731
  425   2HB   LEU  59          2HB       LEU  59  -9.527   5.437   0.698
  426    HG   LEU  59           HG       LEU  59 -11.974   6.818   1.806
  427   1HD1  LEU  59          1HD1      LEU  59 -11.347   6.092  -1.066
  428   2HD1  LEU  59          2HD1      LEU  59 -12.969   6.445  -0.474
  429   3HD1  LEU  59          3HD1      LEU  59 -11.725   7.695  -0.435
  430   1HD2  LEU  59          1HD2      LEU  59 -11.438   4.095   0.570
  431   2HD2  LEU  59          2HD2      LEU  59 -11.672   4.420   2.288
  432   3HD2  LEU  59          3HD2      LEU  59 -13.005   4.652   1.158
  433    HA   PRO  60           HA       PRO  60 -11.526   8.784   5.450
  434   1HB   PRO  60          1HB       PRO  60 -12.876  10.351   3.396
  435   2HB   PRO  60          2HB       PRO  60 -11.776  10.898   4.666
  436   1HG   PRO  60          1HG       PRO  60 -11.212  10.699   1.890
  437   2HG   PRO  60          2HG       PRO  60 -10.070  11.072   3.184
  438   1HD   PRO  60          1HD       PRO  60 -10.232   8.664   1.595
  439   2HD   PRO  60          2HD       PRO  60  -9.064   9.047   2.883
  440    H    ASN  61           H        ASN  61 -14.105   9.428   5.443
  441    HA   ASN  61           HA       ASN  61 -15.600   7.058   5.429
  442   1HB   ASN  61          1HB       ASN  61 -16.462   8.972   6.535
  443   2HB   ASN  61          2HB       ASN  61 -16.285   9.985   5.102
  444   1HD2  ASN  61          2HD2      ASN  61 -17.625   6.724   4.842
  445   2HD2  ASN  61          1HD2      ASN  61 -19.218   7.211   4.512
  446    H    LYS  62           H        LYS  62 -14.806   9.215   2.785
  447    HA   LYS  62           HA       LYS  62 -16.734   8.327   0.862
  448   1HB   LYS  62          1HB       LYS  62 -14.772  10.208   1.013
  449   2HB   LYS  62          2HB       LYS  62 -13.980   9.019  -0.021
  450   1HG   LYS  62          1HG       LYS  62 -15.138  10.462  -1.515
  451   2HG   LYS  62          2HG       LYS  62 -16.142   9.017  -1.404
  452   1HD   LYS  62          1HD       LYS  62 -16.708  11.081   0.631
  453   2HD   LYS  62          2HD       LYS  62 -17.078  11.553  -1.027
  454   1HE   LYS  62          1HE       LYS  62 -18.900  10.206  -1.078
  455   2HE   LYS  62          2HE       LYS  62 -17.958   8.823  -0.491
  456   1HZ   LYS  62          1HZ       LYS  62 -18.095  10.535   1.647
  457   2HZ   LYS  62          2HZ       LYS  62 -19.651  10.601   0.973
  458   3HZ   LYS  62          3HZ       LYS  62 -18.992   9.110   1.448
  459    H    THR  63           H        THR  63 -16.487   6.692  -0.798
  460    HA   THR  63           HA       THR  63 -14.492   4.571  -0.104
  461    HB   THR  63           HB       THR  63 -17.052   4.245  -1.668
  462    HG1  THR  63           HG1      THR  63 -17.586   5.217   0.293
  463   1HG2  THR  63          1HG2      THR  63 -15.375   2.404  -1.618
  464   2HG2  THR  63          2HG2      THR  63 -15.513   2.369   0.139
  465   3HG2  THR  63          3HG2      THR  63 -16.905   1.957  -0.862
  466    H    CYS  64           H        CYS  64 -13.659   3.340  -1.992
  467    HA   CYS  64           HA       CYS  64 -12.630   4.990  -4.077
  468   1HB   CYS  64          1HB       CYS  64 -11.526   2.963  -3.442
  469   2HB   CYS  64          2HB       CYS  64 -12.986   2.007  -3.700
  Start of MODEL   33
    1   1H    LYS   1          1H        LYS   1   4.657   7.889   6.895
    2   2H    LYS   1          2H        LYS   1   4.208   9.332   7.665
    3   3H    LYS   1          3H        LYS   1   5.355   8.307   8.386
    4    HA   LYS   1           HA       LYS   1   3.649   7.489   9.572
    5   1HB   LYS   1          1HB       LYS   1   1.436   8.248   9.160
    6   2HB   LYS   1          2HB       LYS   1   2.454   9.551   8.547
    7   1HG   LYS   1          1HG       LYS   1   2.291   8.517   6.261
    8   2HG   LYS   1          2HG       LYS   1   1.132   7.362   6.918
    9   1HD   LYS   1          1HD       LYS   1  -0.522   8.957   7.177
   10   2HD   LYS   1          2HD       LYS   1   0.634  10.270   7.400
   11   1HE   LYS   1          1HE       LYS   1   1.216  10.174   4.993
   12   2HE   LYS   1          2HE       LYS   1   0.034   8.869   4.768
   13   1HZ   LYS   1          1HZ       LYS   1  -0.904  11.220   6.198
   14   2HZ   LYS   1          2HZ       LYS   1  -0.597  11.444   4.542
   15   3HZ   LYS   1          3HZ       LYS   1  -1.704  10.260   5.052
   16    H    ASP   2           H        ASP   2   2.748   5.399   9.621
   17    HA   ASP   2           HA       ASP   2   3.150   3.757   7.190
   18   1HB   ASP   2          1HB       ASP   2   2.344   3.109  10.048
   19   2HB   ASP   2          2HB       ASP   2   2.760   1.915   8.818
   20    H    GLY   3           H        GLY   3   1.421   2.739   6.091
   21   1HA   GLY   3          1HA       GLY   3  -1.281   2.701   7.143
   22   2HA   GLY   3          2HA       GLY   3  -1.074   3.965   5.935
   23    H    TYR   4           H        TYR   4  -2.685   2.641   4.753
   24    HA   TYR   4           HA       TYR   4  -1.474   0.247   3.415
   25   1HB   TYR   4          1HB       TYR   4  -4.288   1.186   3.999
   26   2HB   TYR   4          2HB       TYR   4  -3.972  -0.096   2.831
   27    HD1  TYR   4           HD1      TYR   4  -2.682  -2.155   3.591
   28    HD2  TYR   4           HD2      TYR   4  -4.257   0.754   6.331
   29    HE1  TYR   4           HE1      TYR   4  -2.499  -3.797   5.441
   30    HE2  TYR   4           HE2      TYR   4  -4.074  -0.886   8.181
   31    HH   TYR   4           HH       TYR   4  -3.665  -4.148   7.708
   32    H    LEU   5           H        LEU   5  -1.368   0.232   1.136
   33    HA   LEU   5           HA       LEU   5  -1.578   2.849  -0.199
   34   1HB   LEU   5          1HB       LEU   5  -0.219   0.311  -0.511
   35   2HB   LEU   5          2HB       LEU   5  -0.997   0.769  -2.027
   36    HG   LEU   5           HG       LEU   5   0.560   2.823  -0.484
   37   1HD1  LEU   5          1HD1      LEU   5   1.629   0.463  -1.955
   38   2HD1  LEU   5          2HD1      LEU   5   2.404   2.017  -2.270
   39   3HD1  LEU   5          3HD1      LEU   5   2.341   1.379  -0.627
   40   1HD2  LEU   5          1HD2      LEU   5  -0.379   2.358  -3.299
   41   2HD2  LEU   5          2HD2      LEU   5  -0.531   3.803  -2.299
   42   3HD2  LEU   5          3HD2      LEU   5   1.026   3.388  -3.020
   43    H    VAL   6           H        VAL   6  -2.782   2.971  -2.333
   44    HA   VAL   6           HA       VAL   6  -5.298   1.331  -2.219
   45    HB   VAL   6           HB       VAL   6  -6.429   3.356  -2.976
   46   1HG1  VAL   6          1HG1      VAL   6  -4.462   3.777  -0.717
   47   2HG1  VAL   6          2HG1      VAL   6  -5.751   4.920  -1.088
   48   3HG1  VAL   6          3HG1      VAL   6  -6.147   3.274  -0.598
   49   1HG2  VAL   6          1HG2      VAL   6  -3.955   3.991  -4.086
   50   2HG2  VAL   6          2HG2      VAL   6  -5.357   5.058  -4.025
   51   3HG2  VAL   6          3HG2      VAL   6  -4.123   5.152  -2.769
   52    H    GLU   7           H        GLU   7  -6.418   1.939  -4.598
   53    HA   GLU   7           HA       GLU   7  -4.359   1.263  -6.671
   54   1HB   GLU   7          1HB       GLU   7  -5.947  -0.570  -5.667
   55   2HB   GLU   7          2HB       GLU   7  -7.172   0.194  -6.680
   56   1HG   GLU   7          1HG       GLU   7  -4.777  -0.119  -8.220
   57   2HG   GLU   7          2HG       GLU   7  -5.174  -1.666  -7.470
   58    H    LYS   8           H        LYS   8  -5.300   1.690  -8.945
   59    HA   LYS   8           HA       LYS   8  -6.036   4.370  -9.300
   60   1HB   LYS   8          1HB       LYS   8  -6.038   3.766 -11.519
   61   2HB   LYS   8          2HB       LYS   8  -5.378   2.263 -10.882
   62   1HG   LYS   8          1HG       LYS   8  -7.912   1.590 -10.633
   63   2HG   LYS   8          2HG       LYS   8  -8.164   2.853 -11.838
   64   1HD   LYS   8          1HD       LYS   8  -6.133   0.641 -12.199
   65   2HD   LYS   8          2HD       LYS   8  -7.797   0.505 -12.766
   66   1HE   LYS   8          1HE       LYS   8  -5.729   2.554 -13.631
   67   2HE   LYS   8          2HE       LYS   8  -6.521   1.327 -14.638
   68   1HZ   LYS   8          1HZ       LYS   8  -8.651   2.480 -13.621
   69   2HZ   LYS   8          2HZ       LYS   8  -7.602   3.815 -13.549
   70   3HZ   LYS   8          3HZ       LYS   8  -7.917   3.058 -15.037
   71    H    THR   9           H        THR   9  -8.053   1.632  -8.476
   72    HA   THR   9           HA       THR   9 -10.573   3.066  -9.029
   73    HB   THR   9           HB       THR   9 -11.444   0.892  -7.936
   74    HG1  THR   9           HG1      THR   9  -9.386   0.517  -6.882
   75   1HG2  THR   9          1HG2      THR   9  -9.718   0.905 -10.417
   76   2HG2  THR   9          2HG2      THR   9 -10.706  -0.478  -9.949
   77   3HG2  THR   9          3HG2      THR   9 -11.471   1.067 -10.319
   78    H    GLY  10           H        GLY  10  -8.303   2.907  -6.498
   79   1HA   GLY  10          1HA       GLY  10  -8.429   4.176  -4.467
   80   2HA   GLY  10          2HA       GLY  10 -10.178   4.293  -4.678
   81    H    CYS  11           H        CYS  11 -10.062   1.271  -5.307
   82    HA   CYS  11           HA       CYS  11 -10.771   0.364  -2.654
   83   1HB   CYS  11          1HB       CYS  11 -10.492  -0.730  -5.420
   84   2HB   CYS  11          2HB       CYS  11 -10.547  -1.891  -4.092
   85    H    LYS  12           H        LYS  12  -9.579  -0.977  -1.255
   86    HA   LYS  12           HA       LYS  12  -6.780  -0.690  -1.057
   87   1HB   LYS  12          1HB       LYS  12  -7.047  -2.683   0.488
   88   2HB   LYS  12          2HB       LYS  12  -8.194  -1.377   0.787
   89   1HG   LYS  12          1HG       LYS  12  -9.978  -2.633   0.151
   90   2HG   LYS  12          2HG       LYS  12  -9.106  -3.347  -1.206
   91   1HD   LYS  12          1HD       LYS  12  -9.255  -5.223   0.115
   92   2HD   LYS  12          2HD       LYS  12  -7.781  -4.541   0.802
   93   1HE   LYS  12          1HE       LYS  12  -8.908  -4.675   2.791
   94   2HE   LYS  12          2HE       LYS  12  -9.747  -3.216   2.225
   95   1HZ   LYS  12          1HZ       LYS  12 -10.648  -5.824   1.233
   96   2HZ   LYS  12          2HZ       LYS  12 -11.087  -5.376   2.813
   97   3HZ   LYS  12          3HZ       LYS  12 -11.539  -4.405   1.495
   98    H    LYS  13           H        LYS  13  -5.595  -3.118  -0.793
   99    HA   LYS  13           HA       LYS  13  -5.937  -4.603  -3.357
  100   1HB   LYS  13          1HB       LYS  13  -4.204  -2.574  -3.244
  101   2HB   LYS  13          2HB       LYS  13  -3.189  -3.799  -2.482
  102   1HG   LYS  13          1HG       LYS  13  -3.729  -5.315  -4.446
  103   2HG   LYS  13          2HG       LYS  13  -4.461  -3.913  -5.227
  104   1HD   LYS  13          1HD       LYS  13  -2.430  -2.825  -5.496
  105   2HD   LYS  13          2HD       LYS  13  -1.691  -3.645  -4.119
  106   1HE   LYS  13          1HE       LYS  13  -2.199  -5.774  -5.762
  107   2HE   LYS  13          2HE       LYS  13  -1.843  -4.500  -6.946
  108   1HZ   LYS  13          1HZ       LYS  13  -0.192  -5.060  -4.540
  109   2HZ   LYS  13          2HZ       LYS  13   0.177  -5.623  -6.100
  110   3HZ   LYS  13          3HZ       LYS  13   0.162  -3.955  -5.778
  111    H    THR  14           H        THR  14  -6.776  -5.909  -1.268
  112    HA   THR  14           HA       THR  14  -5.297  -7.069   0.720
  113    HB   THR  14           HB       THR  14  -7.091  -8.477  -1.285
  114    HG1  THR  14           HG1      THR  14  -7.518  -6.882   0.990
  115   1HG2  THR  14          1HG2      THR  14  -5.734  -9.948   0.282
  116   2HG2  THR  14          2HG2      THR  14  -6.603  -9.184   1.615
  117   3HG2  THR  14          3HG2      THR  14  -7.484 -10.122   0.410
  118    H    CYS  15           H        CYS  15  -3.629  -8.574   0.909
  119    HA   CYS  15           HA       CYS  15  -2.481  -9.672  -1.638
  120   1HB   CYS  15          1HB       CYS  15  -0.259  -9.295  -0.481
  121   2HB   CYS  15          2HB       CYS  15  -1.133  -7.813  -0.868
  122    H    TYR  16           H        TYR  16  -2.285 -11.880  -1.566
  123    HA   TYR  16           HA       TYR  16  -2.853 -13.316   0.936
  124   1HB   TYR  16          1HB       TYR  16  -2.437 -13.953  -1.972
  125   2HB   TYR  16          2HB       TYR  16  -2.402 -15.260  -0.787
  126    HD1  TYR  16           HD1      TYR  16  -4.367 -14.386   1.205
  127    HD2  TYR  16           HD2      TYR  16  -4.506 -14.136  -3.080
  128    HE1  TYR  16           HE1      TYR  16  -6.845 -14.376   1.287
  129    HE2  TYR  16           HE2      TYR  16  -6.985 -14.128  -2.999
  130    HH   TYR  16           HH       TYR  16  -8.774 -14.858  -1.473
  131    H    LYS  17           H        LYS  17  -0.042 -12.523  -1.031
  132    HA   LYS  17           HA       LYS  17   1.735 -14.488   0.183
  133   1HB   LYS  17          1HB       LYS  17   2.298 -11.894  -1.289
  134   2HB   LYS  17          2HB       LYS  17   3.436 -13.219  -1.055
  135   1HG   LYS  17          1HG       LYS  17   0.787 -13.760  -2.364
  136   2HG   LYS  17          2HG       LYS  17   2.092 -13.041  -3.308
  137   1HD   LYS  17          1HD       LYS  17   2.607 -15.484  -1.627
  138   2HD   LYS  17          2HD       LYS  17   1.900 -15.640  -3.236
  139   1HE   LYS  17          1HE       LYS  17   3.843 -14.995  -4.297
  140   2HE   LYS  17          2HE       LYS  17   4.309 -13.889  -2.989
  141   1HZ   LYS  17          1HZ       LYS  17   4.497 -16.006  -1.596
  142   2HZ   LYS  17          2HZ       LYS  17   4.533 -16.836  -3.078
  143   3HZ   LYS  17          3HZ       LYS  17   5.736 -15.693  -2.710
  144    H    LEU  18           H        LEU  18   0.992 -13.857   2.472
  145    HA   LEU  18           HA       LEU  18   1.598 -11.342   3.668
  146   1HB   LEU  18          1HB       LEU  18   1.236 -14.186   4.575
  147   2HB   LEU  18          2HB       LEU  18   1.717 -12.957   5.745
  148    HG   LEU  18           HG       LEU  18  -0.698 -12.742   3.927
  149   1HD1  LEU  18          1HD1      LEU  18  -0.312 -13.808   6.700
  150   2HD1  LEU  18          2HD1      LEU  18  -1.789 -12.911   6.342
  151   3HD1  LEU  18          3HD1      LEU  18  -1.398 -14.367   5.426
  152   1HD2  LEU  18          1HD2      LEU  18   0.760 -10.789   5.314
  153   2HD2  LEU  18          2HD2      LEU  18  -0.866 -10.613   4.656
  154   3HD2  LEU  18          3HD2      LEU  18  -0.643 -11.111   6.333
  155    H    GLY  19           H        GLY  19   3.376 -10.956   5.272
  156   1HA   GLY  19          1HA       GLY  19   5.611 -11.230   6.064
  157   2HA   GLY  19          2HA       GLY  19   5.816 -12.573   4.940
  158    H    GLU  20           H        GLU  20   7.921 -11.202   4.709
  159    HA   GLU  20           HA       GLU  20   8.095  -8.718   3.435
  160   1HB   GLU  20          1HB       GLU  20   9.771 -10.759   4.173
  161   2HB   GLU  20          2HB       GLU  20   9.889 -10.832   2.414
  162   1HG   GLU  20          1HG       GLU  20  10.251  -8.309   4.054
  163   2HG   GLU  20          2HG       GLU  20  11.573  -9.294   3.427
  164    H    ASN  21           H        ASN  21   6.281  -8.560   1.940
  165    HA   ASN  21           HA       ASN  21   6.199 -10.364  -0.394
  166   1HB   ASN  21          1HB       ASN  21   4.205  -9.454   0.859
  167   2HB   ASN  21          2HB       ASN  21   4.624  -7.854   0.243
  168   1HD2  ASN  21          2HD2      ASN  21   2.354  -9.983  -0.360
  169   2HD2  ASN  21          1HD2      ASN  21   2.298  -9.974  -2.058
  170    H    ASP  22           H        ASP  22   8.288  -9.788  -1.368
  171    HA   ASP  22           HA       ASP  22   9.325  -7.288  -1.978
  172   1HB   ASP  22          1HB       ASP  22   9.116  -9.731  -3.773
  173   2HB   ASP  22          2HB       ASP  22  10.312  -8.446  -3.930
  174    H    PHE  23           H        PHE  23   6.769  -9.029  -3.784
  175    HA   PHE  23           HA       PHE  23   6.373  -7.332  -5.961
  176   1HB   PHE  23          1HB       PHE  23   5.082  -9.446  -4.767
  177   2HB   PHE  23          2HB       PHE  23   3.915  -8.144  -4.535
  178    HD1  PHE  23           HD1      PHE  23   3.663  -6.556  -6.712
  179    HD2  PHE  23           HD2      PHE  23   4.919 -10.664  -6.740
  180    HE1  PHE  23           HE1      PHE  23   2.975  -6.750  -9.088
  181    HE2  PHE  23           HE2      PHE  23   4.233 -10.858  -9.115
  182    HZ   PHE  23           HZ       PHE  23   3.261  -8.902 -10.289
  183    H    CYS  24           H        CYS  24   4.547  -7.036  -2.886
  184    HA   CYS  24           HA       CYS  24   3.492  -4.439  -3.400
  185   1HB   CYS  24          1HB       CYS  24   2.849  -6.178  -1.644
  186   2HB   CYS  24          2HB       CYS  24   4.242  -5.629  -0.713
  187    H    ASN  25           H        ASN  25   6.448  -5.472  -1.691
  188    HA   ASN  25           HA       ASN  25   7.395  -3.002  -0.751
  189   1HB   ASN  25          1HB       ASN  25   8.303  -5.395  -0.514
  190   2HB   ASN  25          2HB       ASN  25   9.092  -5.134  -2.070
  191   1HD2  ASN  25          2HD2      ASN  25   9.683  -4.933   1.203
  192   2HD2  ASN  25          1HD2      ASN  25  10.891  -3.741   1.194
  193    H    ARG  26           H        ARG  26   7.952  -4.479  -3.967
  194    HA   ARG  26           HA       ARG  26   9.530  -2.416  -5.100
  195   1HB   ARG  26          1HB       ARG  26   8.229  -4.812  -5.855
  196   2HB   ARG  26          2HB       ARG  26   7.679  -3.581  -6.993
  197   1HG   ARG  26          1HG       ARG  26   9.635  -4.214  -8.043
  198   2HG   ARG  26          2HG       ARG  26  10.268  -2.947  -6.991
  199   1HD   ARG  26          1HD       ARG  26  10.172  -5.401  -5.505
  200   2HD   ARG  26          2HD       ARG  26  11.019  -5.695  -7.033
  201    HE   ARG  26           HE       ARG  26  12.060  -4.205  -4.829
  202   1HH1  ARG  26          1HH1      ARG  26  11.688  -3.936  -8.264
  203   2HH1  ARG  26          2HH1      ARG  26  12.862  -2.675  -8.408
  204   1HH2  ARG  26          1HH2      ARG  26  13.598  -2.586  -5.028
  205   2HH2  ARG  26          2HH2      ARG  26  13.945  -1.919  -6.588
  206    H    GLU  27           H        GLU  27   5.974  -2.860  -5.285
  207    HA   GLU  27           HA       GLU  27   5.419  -0.462  -6.728
  208   1HB   GLU  27          1HB       GLU  27   3.968  -2.410  -4.988
  209   2HB   GLU  27          2HB       GLU  27   3.153  -0.892  -5.367
  210   1HG   GLU  27          1HG       GLU  27   4.296  -2.850  -7.382
  211   2HG   GLU  27          2HG       GLU  27   2.584  -2.581  -7.049
  212    H    CYS  28           H        CYS  28   5.730  -1.100  -3.245
  213    HA   CYS  28           HA       CYS  28   4.772   1.448  -2.327
  214   1HB   CYS  28          1HB       CYS  28   5.115  -0.710  -1.037
  215   2HB   CYS  28          2HB       CYS  28   6.845  -0.365  -1.058
  216    H    LYS  29           H        LYS  29   7.979   0.296  -3.323
  217    HA   LYS  29           HA       LYS  29   9.328   2.777  -2.536
  218   1HB   LYS  29          1HB       LYS  29  10.340   0.485  -2.547
  219   2HB   LYS  29          2HB       LYS  29  10.209   0.474  -4.306
  220   1HG   LYS  29          1HG       LYS  29  12.014   1.816  -4.558
  221   2HG   LYS  29          2HG       LYS  29  11.493   2.896  -3.264
  222   1HD   LYS  29          1HD       LYS  29  13.587   1.830  -2.615
  223   2HD   LYS  29          2HD       LYS  29  12.286   1.211  -1.596
  224   1HE   LYS  29          1HE       LYS  29  13.247  -0.808  -2.213
  225   2HE   LYS  29          2HE       LYS  29  12.155  -0.602  -3.596
  226   1HZ   LYS  29          1HZ       LYS  29  14.305   0.944  -4.229
  227   2HZ   LYS  29          2HZ       LYS  29  15.019  -0.411  -3.500
  228   3HZ   LYS  29          3HZ       LYS  29  13.994  -0.611  -4.840
  229    H    TRP  30           H        TRP  30   8.929   1.175  -5.728
  230    HA   TRP  30           HA       TRP  30   8.599   2.121  -7.872
  231   1HB   TRP  30          1HB       TRP  30   7.176   3.677  -5.923
  232   2HB   TRP  30          2HB       TRP  30   7.833   4.771  -7.136
  233    HD1  TRP  30           HD1      TRP  30   4.849   2.937  -6.535
  234    HE1  TRP  30           HE1      TRP  30   3.585   2.356  -8.707
  235    HE3  TRP  30           HE3      TRP  30   8.539   3.795  -9.953
  236    HZ2  TRP  30           HZ2      TRP  30   4.078   2.272 -11.525
  237    HZ3  TRP  30           HZ3      TRP  30   8.118   3.462 -12.371
  238    HH2  TRP  30           HH2      TRP  30   5.894   2.702 -13.161
  239    H    LYS  31           H        LYS  31   9.031   4.928  -8.556
  240    HA   LYS  31           HA       LYS  31  11.984   5.116  -8.058
  241   1HB   LYS  31          1HB       LYS  31  10.381   4.901 -10.430
  242   2HB   LYS  31          2HB       LYS  31  11.180   6.474 -10.434
  243   1HG   LYS  31          1HG       LYS  31  12.503   4.559 -11.480
  244   2HG   LYS  31          2HG       LYS  31  13.344   5.481 -10.234
  245   1HD   LYS  31          1HD       LYS  31  13.195   3.768  -8.670
  246   2HD   LYS  31          2HD       LYS  31  11.762   3.066  -9.423
  247   1HE   LYS  31          1HE       LYS  31  13.149   2.304 -11.339
  248   2HE   LYS  31          2HE       LYS  31  14.588   2.971 -10.545
  249   1HZ   LYS  31          1HZ       LYS  31  12.750   0.963  -9.348
  250   2HZ   LYS  31          2HZ       LYS  31  14.274   0.613 -10.008
  251   3HZ   LYS  31          3HZ       LYS  31  14.152   1.592  -8.624
  252    H    HIS  32           H        HIS  32   9.192   6.528  -7.115
  253    HA   HIS  32           HA       HIS  32  10.473   9.048  -6.422
  254   1HB   HIS  32          1HB       HIS  32   9.598   8.924  -8.984
  255   2HB   HIS  32          2HB       HIS  32   8.122   9.476  -8.192
  256    HD1  HIS  32           HD1      HIS  32   8.679  11.763  -9.574
  257    HD2  HIS  32           HD2      HIS  32  11.244  10.839  -6.420
  258    HE1  HIS  32           HE1      HIS  32   9.928  13.895  -9.017
  259    H    ILE  33           H        ILE  33   9.342   7.355  -4.661
  260    HA   ILE  33           HA       ILE  33   6.760   8.694  -3.953
  261    HB   ILE  33           HB       ILE  33   7.501   5.786  -4.176
  262   1HG1  ILE  33          1HG1      ILE  33   5.042   7.435  -4.852
  263   2HG1  ILE  33          2HG1      ILE  33   6.247   6.845  -5.997
  264   1HG2  ILE  33          1HG2      ILE  33   5.917   7.032  -2.021
  265   2HG2  ILE  33          2HG2      ILE  33   5.081   5.733  -2.872
  266   3HG2  ILE  33          3HG2      ILE  33   6.637   5.423  -2.102
  267   1HD1  ILE  33          1HD1      ILE  33   4.965   4.817  -4.232
  268   2HD1  ILE  33          2HD1      ILE  33   3.963   5.513  -5.505
  269   3HD1  ILE  33          3HD1      ILE  33   5.464   4.685  -5.919
  270    H    GLY  34           H        GLY  34   9.106   6.359  -2.550
  271   1HA   GLY  34          1HA       GLY  34  10.587   7.168  -0.704
  272   2HA   GLY  34          2HA       GLY  34   9.223   8.132  -0.146
  273    H    GLY  35           H        GLY  35   9.710   4.711  -1.044
  274   1HA   GLY  35          1HA       GLY  35   8.047   3.952   1.305
  275   2HA   GLY  35          2HA       GLY  35   8.440   2.892  -0.050
  276    H    SER  36           H        SER  36   9.258   3.671   3.128
  277    HA   SER  36           HA       SER  36  12.074   2.779   2.928
  278   1HB   SER  36          1HB       SER  36  11.123   3.053   5.611
  279   2HB   SER  36          2HB       SER  36  12.194   4.134   4.726
  280    HG   SER  36           HG       SER  36  10.460   5.293   4.044
  281    H    TYR  37           H        TYR  37   8.930   1.507   3.823
  282    HA   TYR  37           HA       TYR  37   9.989  -1.218   3.959
  283   1HB   TYR  37          1HB       TYR  37  10.119   0.381   6.243
  284   2HB   TYR  37          2HB       TYR  37   8.663  -0.582   6.488
  285    HD1  TYR  37           HD1      TYR  37  11.717  -1.560   4.586
  286    HD2  TYR  37           HD2      TYR  37   9.372  -2.136   8.140
  287    HE1  TYR  37           HE1      TYR  37  13.112  -3.518   5.189
  288    HE2  TYR  37           HE2      TYR  37  10.768  -4.096   8.743
  289    HH   TYR  37           HH       TYR  37  13.672  -4.904   6.937
  290    H    GLY  38           H        GLY  38   8.347  -2.106   2.712
  291   1HA   GLY  38          1HA       GLY  38   5.587  -1.876   3.767
  292   2HA   GLY  38          2HA       GLY  38   5.852  -1.390   2.094
  293    H    TYR  39           H        TYR  39   4.369  -3.713   3.397
  294    HA   TYR  39           HA       TYR  39   5.041  -5.696   1.385
  295   1HB   TYR  39          1HB       TYR  39   5.512  -7.397   3.384
  296   2HB   TYR  39          2HB       TYR  39   6.813  -6.434   2.690
  297    HD1  TYR  39           HD1      TYR  39   4.055  -5.757   5.152
  298    HD2  TYR  39           HD2      TYR  39   8.265  -5.627   4.313
  299    HE1  TYR  39           HE1      TYR  39   4.467  -4.719   7.364
  300    HE2  TYR  39           HE2      TYR  39   8.676  -4.590   6.527
  301    HH   TYR  39           HH       TYR  39   6.001  -4.034   8.817
  302    H    CYS  40           H        CYS  40   3.864  -7.945   2.475
  303    HA   CYS  40           HA       CYS  40   1.053  -7.089   2.652
  304   1HB   CYS  40          1HB       CYS  40   1.927  -8.975   1.244
  305   2HB   CYS  40          2HB       CYS  40   2.314  -9.845   2.727
  306    H    TYR  41           H        TYR  41   0.411  -6.411   4.680
  307    HA   TYR  41           HA       TYR  41   1.072  -8.203   6.994
  308   1HB   TYR  41          1HB       TYR  41   1.971  -5.656   6.618
  309   2HB   TYR  41          2HB       TYR  41   0.467  -5.339   7.481
  310    HD1  TYR  41           HD1      TYR  41   0.771  -8.294   8.816
  311    HD2  TYR  41           HD2      TYR  41   3.159  -4.727   8.645
  312    HE1  TYR  41           HE1      TYR  41   1.879  -8.932  10.940
  313    HE2  TYR  41           HE2      TYR  41   4.266  -5.366  10.767
  314    HH   TYR  41           HH       TYR  41   4.656  -7.829  11.967
  315    H    GLY  42           H        GLY  42  -0.865  -9.284   7.313
  316   1HA   GLY  42          1HA       GLY  42  -3.080  -9.445   8.150
  317   2HA   GLY  42          2HA       GLY  42  -3.213  -7.688   8.049
  318    H    PHE  43           H        PHE  43  -2.425 -10.118   5.549
  319    HA   PHE  43           HA       PHE  43  -3.373 -10.427   3.407
  320   1HB   PHE  43          1HB       PHE  43  -5.666  -9.850   5.280
  321   2HB   PHE  43          2HB       PHE  43  -5.965 -10.182   3.574
  322    HD1  PHE  43           HD1      PHE  43  -3.960 -11.546   6.442
  323    HD2  PHE  43           HD2      PHE  43  -6.273 -12.402   2.925
  324    HE1  PHE  43           HE1      PHE  43  -3.711 -13.978   6.869
  325    HE2  PHE  43           HE2      PHE  43  -6.023 -14.832   3.352
  326    HZ   PHE  43           HZ       PHE  43  -4.741 -15.620   5.324
  327    H    GLY  44           H        GLY  44  -2.353  -7.731   4.097
  328   1HA   GLY  44          1HA       GLY  44  -3.649  -6.262   1.911
  329   2HA   GLY  44          2HA       GLY  44  -3.823  -5.512   3.498
  330    H    CYS  45           H        CYS  45  -2.397  -4.238   1.420
  331    HA   CYS  45           HA       CYS  45   0.480  -4.701   1.946
  332   1HB   CYS  45          1HB       CYS  45  -1.247  -3.360  -0.043
  333   2HB   CYS  45          2HB       CYS  45   0.272  -2.527   0.288
  334    H    TYR  46           H        TYR  46   1.371  -3.693   3.697
  335    HA   TYR  46           HA       TYR  46   0.330  -0.979   4.454
  336   1HB   TYR  46          1HB       TYR  46  -0.043  -3.070   5.950
  337   2HB   TYR  46          2HB       TYR  46   1.684  -2.957   6.292
  338    HD1  TYR  46           HD1      TYR  46  -1.432  -0.877   6.245
  339    HD2  TYR  46           HD2      TYR  46   2.445  -1.521   7.979
  340    HE1  TYR  46           HE1      TYR  46  -1.877   0.911   7.906
  341    HE2  TYR  46           HE2      TYR  46   2.000   0.267   9.638
  342    HH   TYR  46           HH       TYR  46  -0.881   1.377  10.414
  343    H    CYS  47           H        CYS  47   1.869   0.604   4.162
  344    HA   CYS  47           HA       CYS  47   4.741  -0.236   4.007
  345   1HB   CYS  47          1HB       CYS  47   3.058   1.956   2.812
  346   2HB   CYS  47          2HB       CYS  47   4.811   2.123   2.874
  347    H    GLU  48           H        GLU  48   6.330   1.292   4.959
  348    HA   GLU  48           HA       GLU  48   5.190   2.858   7.252
  349   1HB   GLU  48          1HB       GLU  48   7.760   1.245   7.126
  350   2HB   GLU  48          2HB       GLU  48   7.108   2.057   8.550
  351   1HG   GLU  48          1HG       GLU  48   4.974   0.589   8.035
  352   2HG   GLU  48          2HG       GLU  48   6.134  -0.423   7.172
  353    H    GLY  49           H        GLY  49   5.602   4.252   4.933
  354   1HA   GLY  49          1HA       GLY  49   7.580   6.191   5.700
  355   2HA   GLY  49          2HA       GLY  49   8.190   5.210   4.368
  356    H    LEU  50           H        LEU  50   4.762   5.903   4.668
  357    HA   LEU  50           HA       LEU  50   4.820   7.232   2.039
  358   1HB   LEU  50          1HB       LEU  50   2.448   6.861   3.869
  359   2HB   LEU  50          2HB       LEU  50   2.474   6.899   2.107
  360    HG   LEU  50           HG       LEU  50   3.388   4.695   3.951
  361   1HD1  LEU  50          1HD1      LEU  50   1.503   4.943   1.598
  362   2HD1  LEU  50          2HD1      LEU  50   2.022   3.383   2.234
  363   3HD1  LEU  50          3HD1      LEU  50   1.111   4.493   3.257
  364   1HD2  LEU  50          1HD2      LEU  50   4.312   5.350   1.166
  365   2HD2  LEU  50          2HD2      LEU  50   5.238   4.707   2.522
  366   3HD2  LEU  50          3HD2      LEU  50   4.129   3.659   1.636
  367    HA   PRO  51           HA       PRO  51   5.344  11.196   4.167
  368   1HB   PRO  51          1HB       PRO  51   4.755  12.413   1.605
  369   2HB   PRO  51          2HB       PRO  51   6.298  12.347   2.461
  370   1HG   PRO  51          1HG       PRO  51   5.537  10.887   0.122
  371   2HG   PRO  51          2HG       PRO  51   7.060  10.785   1.010
  372   1HD   PRO  51          1HD       PRO  51   4.971   8.811   0.875
  373   2HD   PRO  51          2HD       PRO  51   6.479   8.734   1.820
  374    H    ASP  52           H        ASP  52   3.846  12.985   4.614
  375    HA   ASP  52           HA       ASP  52   1.113  12.251   4.853
  376   1HB   ASP  52          1HB       ASP  52   2.722  14.786   4.993
  377   2HB   ASP  52          2HB       ASP  52   0.964  14.870   5.118
  378    H    SER  53           H        SER  53   2.869  13.589   2.160
  379    HA   SER  53           HA       SER  53   0.578  14.728   0.774
  380   1HB   SER  53          1HB       SER  53   2.188  15.029  -0.992
  381   2HB   SER  53          2HB       SER  53   3.049  15.288   0.521
  382    HG   SER  53           HG       SER  53   3.452  12.884   0.301
  383    H    THR  54           H        THR  54   2.088  11.563   0.978
  384    HA   THR  54           HA       THR  54   0.753  10.448  -1.368
  385    HB   THR  54           HB       THR  54   1.884   8.911   0.967
  386    HG1  THR  54           HG1      THR  54   3.502  10.284   0.709
  387   1HG2  THR  54          1HG2      THR  54   1.675   8.557  -2.017
  388   2HG2  THR  54          2HG2      THR  54   2.842   7.631  -1.073
  389   3HG2  THR  54          3HG2      THR  54   1.116   7.478  -0.739
  390    H    GLN  55           H        GLN  55  -1.183   9.275  -1.385
  391    HA   GLN  55           HA       GLN  55  -2.878   9.498   1.043
  392   1HB   GLN  55          1HB       GLN  55  -3.584  10.248  -1.251
  393   2HB   GLN  55          2HB       GLN  55  -3.513   8.564  -1.772
  394   1HG   GLN  55          1HG       GLN  55  -5.789   8.916  -1.197
  395   2HG   GLN  55          2HG       GLN  55  -5.103   8.070   0.190
  396   1HE2  GLN  55          2HE2      GLN  55  -6.455   9.006   1.822
  397   2HE2  GLN  55          1HE2      GLN  55  -6.436  10.663   2.193
  398    H    THR  56           H        THR  56  -3.819   7.681   2.048
  399    HA   THR  56           HA       THR  56  -2.802   4.996   1.166
  400    HB   THR  56           HB       THR  56  -1.607   5.575   3.140
  401    HG1  THR  56           HG1      THR  56  -3.748   4.389   4.443
  402   1HG2  THR  56          1HG2      THR  56  -4.237   6.758   4.024
  403   2HG2  THR  56          2HG2      THR  56  -2.952   6.411   5.181
  404   3HG2  THR  56          3HG2      THR  56  -2.672   7.557   3.869
  405    H    TRP  57           H        TRP  57  -4.244   3.221   2.272
  406    HA   TRP  57           HA       TRP  57  -7.059   3.861   1.638
  407   1HB   TRP  57          1HB       TRP  57  -5.589   1.778   1.005
  408   2HB   TRP  57          2HB       TRP  57  -5.989   1.226   2.631
  409    HD1  TRP  57           HD1      TRP  57  -7.676   2.227  -0.675
  410    HE1  TRP  57           HE1      TRP  57 -10.009   1.135  -0.764
  411    HE3  TRP  57           HE3      TRP  57  -7.866   0.164   3.996
  412    HZ2  TRP  57           HZ2      TRP  57 -11.728  -0.411   0.920
  413    HZ3  TRP  57           HZ3      TRP  57  -9.861  -1.113   4.724
  414    HH2  TRP  57           HH2      TRP  57 -11.790  -1.403   3.194
  415    HA   PRO  58           HA       PRO  58  -9.005   3.140   2.025
  416   1HB   PRO  58          1HB       PRO  58 -10.997   4.733   3.266
  417   2HB   PRO  58          2HB       PRO  58 -11.000   2.975   3.094
  418   1HG   PRO  58          1HG       PRO  58 -10.639   4.537   5.500
  419   2HG   PRO  58          2HG       PRO  58 -10.758   2.783   5.337
  420   1HD   PRO  58          1HD       PRO  58  -8.397   4.362   5.883
  421   2HD   PRO  58          2HD       PRO  58  -8.525   2.591   5.748
  422    H    LEU  59           H        LEU  59 -10.186   5.076   0.823
  423    HA   LEU  59           HA       LEU  59  -8.249   7.278   0.614
  424   1HB   LEU  59          1HB       LEU  59 -10.418   6.040  -0.918
  425   2HB   LEU  59          2HB       LEU  59 -10.446   7.801  -1.023
  426    HG   LEU  59           HG       LEU  59  -7.729   7.026  -1.253
  427   1HD1  LEU  59          1HD1      LEU  59  -8.641   4.756  -1.801
  428   2HD1  LEU  59          2HD1      LEU  59  -9.527   5.480  -3.143
  429   3HD1  LEU  59          3HD1      LEU  59  -7.763   5.492  -3.142
  430   1HD2  LEU  59          1HD2      LEU  59  -9.718   8.578  -2.614
  431   2HD2  LEU  59          2HD2      LEU  59  -7.963   8.697  -2.748
  432   3HD2  LEU  59          3HD2      LEU  59  -8.857   7.610  -3.811
  433    HA   PRO  60           HA       PRO  60 -10.243  10.515   2.830
  434   1HB   PRO  60          1HB       PRO  60 -10.956  12.103   0.505
  435   2HB   PRO  60          2HB       PRO  60  -9.689  12.398   1.699
  436   1HG   PRO  60          1HG       PRO  60  -9.337  11.559  -0.989
  437   2HG   PRO  60          2HG       PRO  60  -8.093  11.684   0.258
  438   1HD   PRO  60          1HD       PRO  60  -9.216   9.284  -0.911
  439   2HD   PRO  60          2HD       PRO  60  -7.917   9.411   0.298
  440    H    ASN  61           H        ASN  61 -12.372  12.177   2.117
  441    HA   ASN  61           HA       ASN  61 -14.683  10.776   2.771
  442   1HB   ASN  61          1HB       ASN  61 -14.048  13.333   2.290
  443   2HB   ASN  61          2HB       ASN  61 -14.845  12.984   0.756
  444   1HD2  ASN  61          2HD2      ASN  61 -15.403  12.642   4.306
  445   2HD2  ASN  61          1HD2      ASN  61 -17.083  12.869   4.209
  446    H    LYS  62           H        LYS  62 -13.162  11.155  -0.383
  447    HA   LYS  62           HA       LYS  62 -15.372   9.765  -1.777
  448   1HB   LYS  62          1HB       LYS  62 -12.832  11.197  -2.454
  449   2HB   LYS  62          2HB       LYS  62 -13.474  10.055  -3.636
  450   1HG   LYS  62          1HG       LYS  62 -15.612  11.221  -3.673
  451   2HG   LYS  62          2HG       LYS  62 -15.075  12.308  -2.392
  452   1HD   LYS  62          1HD       LYS  62 -14.439  13.676  -4.089
  453   2HD   LYS  62          2HD       LYS  62 -13.062  12.584  -4.243
  454   1HE   LYS  62          1HE       LYS  62 -14.076  12.801  -6.441
  455   2HE   LYS  62          2HE       LYS  62 -14.487  11.186  -5.829
  456   1HZ   LYS  62          1HZ       LYS  62 -16.251  13.350  -5.022
  457   2HZ   LYS  62          2HZ       LYS  62 -16.321  12.928  -6.663
  458   3HZ   LYS  62          3HZ       LYS  62 -16.626  11.755  -5.472
  459    H    THR  63           H        THR  63 -15.103   7.732  -0.496
  460    HA   THR  63           HA       THR  63 -12.619   6.204  -0.765
  461    HB   THR  63           HB       THR  63 -15.337   5.226   0.124
  462    HG1  THR  63           HG1      THR  63 -15.192   6.424   1.851
  463   1HG2  THR  63          1HG2      THR  63 -12.501   4.413   0.427
  464   2HG2  THR  63          2HG2      THR  63 -13.511   4.250   1.864
  465   3HG2  THR  63          3HG2      THR  63 -13.958   3.421   0.373
  466    H    CYS  64           H        CYS  64 -13.097   3.742  -1.450
  467    HA   CYS  64           HA       CYS  64 -13.886   3.843  -4.286
  468   1HB   CYS  64          1HB       CYS  64 -11.852   2.690  -3.361
  469   2HB   CYS  64          2HB       CYS  64 -12.921   1.555  -2.539
  Start of MODEL   34
    1   1H    LYS   1          1H        LYS   1   6.219   3.636  11.304
    2   2H    LYS   1          2H        LYS   1   6.067   4.641  12.663
    3   3H    LYS   1          3H        LYS   1   5.118   3.238  12.535
    4    HA   LYS   1           HA       LYS   1   3.591   4.819  11.901
    5   1HB   LYS   1          1HB       LYS   1   4.466   6.780  10.478
    6   2HB   LYS   1          2HB       LYS   1   5.040   6.701  12.144
    7   1HG   LYS   1          1HG       LYS   1   7.105   5.593  11.395
    8   2HG   LYS   1          2HG       LYS   1   6.532   5.638   9.727
    9   1HD   LYS   1          1HD       LYS   1   6.743   8.164  11.360
   10   2HD   LYS   1          2HD       LYS   1   8.143   7.518  10.505
   11   1HE   LYS   1          1HE       LYS   1   7.177   7.862   8.392
   12   2HE   LYS   1          2HE       LYS   1   5.526   7.882   9.047
   13   1HZ   LYS   1          1HZ       LYS   1   7.467   9.854  10.025
   14   2HZ   LYS   1          2HZ       LYS   1   6.748  10.112   8.506
   15   3HZ   LYS   1          3HZ       LYS   1   5.780   9.978   9.897
   16    H    ASP   2           H        ASP   2   3.487   2.528  10.721
   17    HA   ASP   2           HA       ASP   2   3.987   2.807   7.791
   18   1HB   ASP   2          1HB       ASP   2   2.966   0.355   9.223
   19   2HB   ASP   2          2HB       ASP   2   3.960   0.447   7.771
   20    H    GLY   3           H        GLY   3   2.140   1.753   6.426
   21   1HA   GLY   3          1HA       GLY   3  -0.541   1.781   7.510
   22   2HA   GLY   3          2HA       GLY   3  -0.210   3.254   6.597
   23    H    TYR   4           H        TYR   4  -2.134   1.939   5.445
   24    HA   TYR   4           HA       TYR   4  -0.933   0.108   3.398
   25   1HB   TYR   4          1HB       TYR   4  -3.764   0.590   4.381
   26   2HB   TYR   4          2HB       TYR   4  -3.348  -0.530   3.086
   27    HD1  TYR   4           HD1      TYR   4  -2.102  -2.587   3.542
   28    HD2  TYR   4           HD2      TYR   4  -3.167   0.121   6.701
   29    HE1  TYR   4           HE1      TYR   4  -1.575  -4.336   5.220
   30    HE2  TYR   4           HE2      TYR   4  -2.639  -1.627   8.379
   31    HH   TYR   4           HH       TYR   4  -0.826  -4.112   7.932
   32    H    LEU   5           H        LEU   5  -0.120   1.968   2.105
   33    HA   LEU   5           HA       LEU   5  -1.590   4.196   1.232
   34   1HB   LEU   5          1HB       LEU   5   0.584   2.465   0.091
   35   2HB   LEU   5          2HB       LEU   5  -0.093   3.754  -0.904
   36    HG   LEU   5           HG       LEU   5   0.718   4.369   1.918
   37   1HD1  LEU   5          1HD1      LEU   5   2.511   3.666  -0.348
   38   2HD1  LEU   5          2HD1      LEU   5   2.936   5.111   0.570
   39   3HD1  LEU   5          3HD1      LEU   5   2.795   3.555   1.389
   40   1HD2  LEU   5          1HD2      LEU   5  -0.492   6.037   0.545
   41   2HD2  LEU   5          2HD2      LEU   5   1.146   6.580   0.908
   42   3HD2  LEU   5          3HD2      LEU   5   0.766   5.931  -0.687
   43    H    VAL   6           H        VAL   6  -2.598   4.512  -0.976
   44    HA   VAL   6           HA       VAL   6  -4.353   2.183  -1.617
   45    HB   VAL   6           HB       VAL   6  -5.845   3.891  -2.490
   46   1HG1  VAL   6          1HG1      VAL   6  -5.154   3.645   0.133
   47   2HG1  VAL   6          2HG1      VAL   6  -4.854   5.364  -0.121
   48   3HG1  VAL   6          3HG1      VAL   6  -6.453   4.692  -0.440
   49   1HG2  VAL   6          1HG2      VAL   6  -3.340   5.521  -2.389
   50   2HG2  VAL   6          2HG2      VAL   6  -4.602   5.483  -3.620
   51   3HG2  VAL   6          3HG2      VAL   6  -4.870   6.352  -2.108
   52    H    GLU   7           H        GLU   7  -5.134   2.690  -4.141
   53    HA   GLU   7           HA       GLU   7  -2.607   2.505  -5.744
   54   1HB   GLU   7          1HB       GLU   7  -4.549   0.664  -5.398
   55   2HB   GLU   7          2HB       GLU   7  -5.239   1.539  -6.763
   56   1HG   GLU   7          1HG       GLU   7  -2.378   1.001  -7.087
   57   2HG   GLU   7          2HG       GLU   7  -3.336  -0.470  -6.931
   58    H    LYS   8           H        LYS   8  -3.273   3.073  -8.211
   59    HA   LYS   8           HA       LYS   8  -3.559   5.802  -8.534
   60   1HB   LYS   8          1HB       LYS   8  -3.127   3.899 -10.219
   61   2HB   LYS   8          2HB       LYS   8  -4.882   3.799 -10.376
   62   1HG   LYS   8          1HG       LYS   8  -4.942   5.633 -11.685
   63   2HG   LYS   8          2HG       LYS   8  -3.983   6.555 -10.527
   64   1HD   LYS   8          1HD       LYS   8  -1.924   5.754 -11.453
   65   2HD   LYS   8          2HD       LYS   8  -2.759   4.539 -12.423
   66   1HE   LYS   8          1HE       LYS   8  -2.446   6.190 -14.039
   67   2HE   LYS   8          2HE       LYS   8  -4.007   6.720 -13.377
   68   1HZ   LYS   8          1HZ       LYS   8  -1.365   7.588 -12.330
   69   2HZ   LYS   8          2HZ       LYS   8  -2.307   8.505 -13.407
   70   3HZ   LYS   8          3HZ       LYS   8  -2.890   8.163 -11.851
   71    H    THR   9           H        THR   9  -6.319   3.537  -8.932
   72    HA   THR   9           HA       THR   9  -8.300   5.639  -8.873
   73    HB   THR   9           HB       THR   9  -9.831   3.763  -8.953
   74    HG1  THR   9           HG1      THR   9  -7.719   1.993  -8.425
   75   1HG2  THR   9          1HG2      THR   9  -8.082   4.212 -10.856
   76   2HG2  THR   9          2HG2      THR   9  -7.400   2.672 -10.336
   77   3HG2  THR   9          3HG2      THR   9  -9.065   2.749 -10.911
   78    H    GLY  10           H        GLY  10  -6.726   3.705  -6.409
   79   1HA   GLY  10          1HA       GLY  10  -6.803   4.801  -4.121
   80   2HA   GLY  10          2HA       GLY  10  -8.548   4.914  -4.364
   81    H    CYS  11           H        CYS  11  -8.570   2.217  -5.693
   82    HA   CYS  11           HA       CYS  11  -9.328   0.587  -3.534
   83   1HB   CYS  11          1HB       CYS  11  -8.383   0.173  -6.348
   84   2HB   CYS  11          2HB       CYS  11  -8.607  -1.245  -5.324
   85    H    LYS  12           H        LYS  12  -8.142  -0.430  -1.949
   86    HA   LYS  12           HA       LYS  12  -5.299  -0.161  -1.717
   87   1HB   LYS  12          1HB       LYS  12  -5.661  -1.823   0.128
   88   2HB   LYS  12          2HB       LYS  12  -6.785  -0.468   0.180
   89   1HG   LYS  12          1HG       LYS  12  -8.586  -1.784  -0.265
   90   2HG   LYS  12          2HG       LYS  12  -7.703  -2.742  -1.456
   91   1HD   LYS  12          1HD       LYS  12  -6.520  -3.895   0.423
   92   2HD   LYS  12          2HD       LYS  12  -7.544  -3.015   1.559
   93   1HE   LYS  12          1HE       LYS  12  -9.546  -3.994   0.256
   94   2HE   LYS  12          2HE       LYS  12  -8.369  -5.115  -0.457
   95   1HZ   LYS  12          1HZ       LYS  12  -8.735  -4.643   2.456
   96   2HZ   LYS  12          2HZ       LYS  12  -9.312  -5.998   1.607
   97   3HZ   LYS  12          3HZ       LYS  12  -7.641  -5.731   1.751
   98    H    LYS  13           H        LYS  13  -4.304  -2.628  -1.066
   99    HA   LYS  13           HA       LYS  13  -4.664  -4.307  -3.520
  100   1HB   LYS  13          1HB       LYS  13  -2.186  -3.060  -2.334
  101   2HB   LYS  13          2HB       LYS  13  -2.080  -4.480  -3.376
  102   1HG   LYS  13          1HG       LYS  13  -3.722  -2.953  -4.879
  103   2HG   LYS  13          2HG       LYS  13  -2.816  -1.682  -4.057
  104   1HD   LYS  13          1HD       LYS  13  -0.838  -2.239  -5.079
  105   2HD   LYS  13          2HD       LYS  13  -1.233  -3.958  -5.136
  106   1HE   LYS  13          1HE       LYS  13  -3.025  -2.307  -6.788
  107   2HE   LYS  13          2HE       LYS  13  -1.330  -2.270  -7.316
  108   1HZ   LYS  13          1HZ       LYS  13  -1.499  -4.813  -6.775
  109   2HZ   LYS  13          2HZ       LYS  13  -3.150  -4.558  -7.070
  110   3HZ   LYS  13          3HZ       LYS  13  -2.009  -4.213  -8.281
  111    H    THR  14           H        THR  14  -5.625  -6.058  -2.387
  112    HA   THR  14           HA       THR  14  -4.490  -7.031   0.137
  113    HB   THR  14           HB       THR  14  -6.424  -8.471  -1.686
  114    HG1  THR  14           HG1      THR  14  -8.021  -7.147  -0.974
  115   1HG2  THR  14          1HG2      THR  14  -5.579  -9.498   0.463
  116   2HG2  THR  14          2HG2      THR  14  -6.358  -8.173   1.326
  117   3HG2  THR  14          3HG2      THR  14  -7.330  -9.305   0.385
  118    H    CYS  15           H        CYS  15  -3.072  -8.779   0.348
  119    HA   CYS  15           HA       CYS  15  -2.303 -10.239  -2.155
  120   1HB   CYS  15          1HB       CYS  15   0.067 -10.004  -1.279
  121   2HB   CYS  15          2HB       CYS  15  -0.683  -8.491  -1.786
  122    H    TYR  16           H        TYR  16  -2.018 -12.428  -1.844
  123    HA   TYR  16           HA       TYR  16  -2.465 -13.489   0.902
  124   1HB   TYR  16          1HB       TYR  16  -2.374 -14.936  -1.759
  125   2HB   TYR  16          2HB       TYR  16  -3.142 -15.482  -0.267
  126    HD1  TYR  16           HD1      TYR  16  -4.478 -12.995   0.647
  127    HD2  TYR  16           HD2      TYR  16  -4.166 -14.702  -3.283
  128    HE1  TYR  16           HE1      TYR  16  -6.574 -11.849  -0.018
  129    HE2  TYR  16           HE2      TYR  16  -6.264 -13.555  -3.946
  130    HH   TYR  16           HH       TYR  16  -7.509 -11.371  -3.099
  131    H    LYS  17           H        LYS  17   0.026 -13.055  -1.454
  132    HA   LYS  17           HA       LYS  17   1.739 -15.249  -0.528
  133   1HB   LYS  17          1HB       LYS  17   1.520 -13.915  -2.829
  134   2HB   LYS  17          2HB       LYS  17   2.724 -12.877  -2.067
  135   1HG   LYS  17          1HG       LYS  17   3.295 -15.740  -1.753
  136   2HG   LYS  17          2HG       LYS  17   3.284 -15.209  -3.436
  137   1HD   LYS  17          1HD       LYS  17   4.647 -13.289  -1.724
  138   2HD   LYS  17          2HD       LYS  17   5.383 -14.888  -1.616
  139   1HE   LYS  17          1HE       LYS  17   4.974 -14.684  -4.321
  140   2HE   LYS  17          2HE       LYS  17   5.338 -13.001  -3.888
  141   1HZ   LYS  17          1HZ       LYS  17   7.110 -14.228  -2.382
  142   2HZ   LYS  17          2HZ       LYS  17   7.000 -15.388  -3.613
  143   3HZ   LYS  17          3HZ       LYS  17   7.450 -13.793  -3.989
  144    H    LEU  18           H        LEU  18   1.694 -14.591   1.809
  145    HA   LEU  18           HA       LEU  18   2.620 -12.133   2.847
  146   1HB   LEU  18          1HB       LEU  18   2.809 -15.008   3.779
  147   2HB   LEU  18          2HB       LEU  18   3.281 -13.649   4.800
  148    HG   LEU  18           HG       LEU  18   0.547 -14.157   3.600
  149   1HD1  LEU  18          1HD1      LEU  18   1.783 -14.376   6.315
  150   2HD1  LEU  18          2HD1      LEU  18   0.103 -13.845   6.209
  151   3HD1  LEU  18          3HD1      LEU  18   0.577 -15.408   5.546
  152   1HD2  LEU  18          1HD2      LEU  18   1.801 -11.730   4.844
  153   2HD2  LEU  18          2HD2      LEU  18   0.690 -11.834   3.478
  154   3HD2  LEU  18          3HD2      LEU  18   0.090 -12.048   5.122
  155    H    GLY  19           H        GLY  19   4.737 -11.479   3.570
  156   1HA   GLY  19          1HA       GLY  19   7.144 -11.915   3.796
  157   2HA   GLY  19          2HA       GLY  19   7.011 -13.059   2.467
  158    H    GLU  20           H        GLU  20   8.842 -11.767   1.618
  159    HA   GLU  20           HA       GLU  20   8.668  -9.037   0.845
  160   1HB   GLU  20          1HB       GLU  20  10.085 -11.267  -0.638
  161   2HB   GLU  20          2HB       GLU  20  10.582  -9.579  -0.504
  162   1HG   GLU  20          1HG       GLU  20  10.304 -10.457   2.146
  163   2HG   GLU  20          2HG       GLU  20  11.106 -11.787   1.309
  164    H    ASN  21           H        ASN  21   6.420  -8.863   0.026
  165    HA   ASN  21           HA       ASN  21   5.699 -10.268  -2.453
  166   1HB   ASN  21          1HB       ASN  21   4.228  -9.464  -0.453
  167   2HB   ASN  21          2HB       ASN  21   4.307  -7.884  -1.234
  168   1HD2  ASN  21          2HD2      ASN  21   2.568 -10.807  -1.189
  169   2HD2  ASN  21          1HD2      ASN  21   1.768 -10.638  -2.676
  170    H    ASP  22           H        ASP  22   7.391  -9.508  -3.900
  171    HA   ASP  22           HA       ASP  22   8.282  -6.922  -4.385
  172   1HB   ASP  22          1HB       ASP  22   7.623  -9.229  -6.231
  173   2HB   ASP  22          2HB       ASP  22   8.489  -7.794  -6.779
  174    H    PHE  23           H        PHE  23   5.357  -8.430  -5.826
  175    HA   PHE  23           HA       PHE  23   4.449  -6.438  -7.506
  176   1HB   PHE  23          1HB       PHE  23   3.435  -8.709  -6.322
  177   2HB   PHE  23          2HB       PHE  23   2.382  -7.455  -5.667
  178    HD1  PHE  23           HD1      PHE  23   1.485  -5.691  -7.394
  179    HD2  PHE  23           HD2      PHE  23   3.001  -9.565  -8.462
  180    HE1  PHE  23           HE1      PHE  23   0.279  -5.568  -9.557
  181    HE2  PHE  23           HE2      PHE  23   1.796  -9.441 -10.626
  182    HZ   PHE  23           HZ       PHE  23   0.435  -7.441 -11.174
  183    H    CYS  24           H        CYS  24   3.764  -6.536  -3.978
  184    HA   CYS  24           HA       CYS  24   2.462  -4.003  -3.838
  185   1HB   CYS  24          1HB       CYS  24   2.636  -5.922  -2.135
  186   2HB   CYS  24          2HB       CYS  24   4.203  -5.243  -1.695
  187    H    ASN  25           H        ASN  25   5.861  -4.825  -3.019
  188    HA   ASN  25           HA       ASN  25   6.859  -2.268  -2.492
  189   1HB   ASN  25          1HB       ASN  25   7.951  -4.768  -3.761
  190   2HB   ASN  25          2HB       ASN  25   8.979  -3.341  -3.630
  191   1HD2  ASN  25          2HD2      ASN  25   8.141  -6.134  -1.983
  192   2HD2  ASN  25          1HD2      ASN  25   8.519  -5.638  -0.405
  193    H    ARG  26           H        ARG  26   6.798  -3.889  -5.692
  194    HA   ARG  26           HA       ARG  26   7.766  -1.725  -7.238
  195   1HB   ARG  26          1HB       ARG  26   7.566  -3.917  -8.177
  196   2HB   ARG  26          2HB       ARG  26   5.853  -4.011  -7.765
  197   1HG   ARG  26          1HG       ARG  26   6.805  -1.808  -9.562
  198   2HG   ARG  26          2HG       ARG  26   6.578  -3.425 -10.231
  199   1HD   ARG  26          1HD       ARG  26   4.277  -3.083  -8.743
  200   2HD   ARG  26          2HD       ARG  26   4.556  -1.455  -9.387
  201    HE   ARG  26           HE       ARG  26   3.665  -3.711 -10.906
  202   1HH1  ARG  26          1HH1      ARG  26   5.977  -1.144 -11.054
  203   2HH1  ARG  26          2HH1      ARG  26   6.270  -1.343 -12.745
  204   1HH2  ARG  26          1HH2      ARG  26   4.021  -3.950 -13.112
  205   2HH2  ARG  26          2HH2      ARG  26   5.156  -2.914 -13.912
  206    H    GLU  27           H        GLU  27   4.520  -2.432  -6.024
  207    HA   GLU  27           HA       GLU  27   3.243  -0.258  -7.512
  208   1HB   GLU  27          1HB       GLU  27   2.497  -2.244  -5.374
  209   2HB   GLU  27          2HB       GLU  27   1.391  -0.935  -5.788
  210   1HG   GLU  27          1HG       GLU  27   2.534  -2.957  -7.739
  211   2HG   GLU  27          2HG       GLU  27   0.887  -2.958  -7.107
  212    H    CYS  28           H        CYS  28   3.542  -0.846  -3.992
  213    HA   CYS  28           HA       CYS  28   2.917   1.775  -3.146
  214   1HB   CYS  28          1HB       CYS  28   3.097  -0.379  -1.829
  215   2HB   CYS  28          2HB       CYS  28   4.848  -0.165  -1.849
  216    H    LYS  29           H        LYS  29   5.857   0.585  -4.598
  217    HA   LYS  29           HA       LYS  29   7.430   2.906  -3.609
  218   1HB   LYS  29          1HB       LYS  29   8.335   0.571  -3.674
  219   2HB   LYS  29          2HB       LYS  29   8.182   0.598  -5.431
  220   1HG   LYS  29          1HG       LYS  29  10.478   1.176  -4.767
  221   2HG   LYS  29          2HG       LYS  29   9.691   2.563  -5.521
  222   1HD   LYS  29          1HD       LYS  29   9.184   3.508  -3.320
  223   2HD   LYS  29          2HD       LYS  29   9.889   2.098  -2.530
  224   1HE   LYS  29          1HE       LYS  29  11.431   4.126  -2.685
  225   2HE   LYS  29          2HE       LYS  29  12.096   2.639  -3.389
  226   1HZ   LYS  29          1HZ       LYS  29  10.457   4.467  -5.024
  227   2HZ   LYS  29          2HZ       LYS  29  12.112   4.779  -4.804
  228   3HZ   LYS  29          3HZ       LYS  29  11.613   3.330  -5.530
  229    H    TRP  30           H        TRP  30   5.234   2.460  -6.019
  230    HA   TRP  30           HA       TRP  30   6.736   3.773  -8.186
  231   1HB   TRP  30          1HB       TRP  30   4.885   3.180  -9.497
  232   2HB   TRP  30          2HB       TRP  30   4.950   1.897  -8.297
  233    HD1  TRP  30           HD1      TRP  30   2.298   2.684  -9.817
  234    HE1  TRP  30           HE1      TRP  30   0.232   3.427  -8.479
  235    HE3  TRP  30           HE3      TRP  30   4.522   4.180  -5.441
  236    HZ2  TRP  30           HZ2      TRP  30  -0.408   4.508  -5.923
  237    HZ3  TRP  30           HZ3      TRP  30   3.147   5.053  -3.584
  238    HH2  TRP  30           HH2      TRP  30   0.687   5.223  -3.816
  239    H    LYS  31           H        LYS  31   6.649   5.443  -5.931
  240    HA   LYS  31           HA       LYS  31   5.041   7.702  -7.015
  241   1HB   LYS  31          1HB       LYS  31   4.541   6.146  -4.584
  242   2HB   LYS  31          2HB       LYS  31   4.679   7.875  -4.266
  243   1HG   LYS  31          1HG       LYS  31   2.944   6.765  -6.482
  244   2HG   LYS  31          2HG       LYS  31   2.337   7.041  -4.848
  245   1HD   LYS  31          1HD       LYS  31   2.967   9.414  -4.998
  246   2HD   LYS  31          2HD       LYS  31   3.610   9.150  -6.619
  247   1HE   LYS  31          1HE       LYS  31   0.811   8.240  -6.190
  248   2HE   LYS  31          2HE       LYS  31   1.071   9.996  -6.187
  249   1HZ   LYS  31          1HZ       LYS  31   2.515   9.581  -8.212
  250   2HZ   LYS  31          2HZ       LYS  31   1.805   8.042  -8.289
  251   3HZ   LYS  31          3HZ       LYS  31   0.837   9.430  -8.438
  252    H    HIS  32           H        HIS  32   5.546   9.641  -5.256
  253    HA   HIS  32           HA       HIS  32   8.463   9.569  -4.598
  254   1HB   HIS  32          1HB       HIS  32   7.319  10.792  -6.833
  255   2HB   HIS  32          2HB       HIS  32   7.523  12.116  -5.686
  256    HD1  HIS  32           HD1      HIS  32   9.879  12.935  -5.246
  257    HD2  HIS  32           HD2      HIS  32   9.815   9.403  -7.457
  258    HE1  HIS  32           HE1      HIS  32  12.257  12.533  -6.017
  259    H    ILE  33           H        ILE  33   6.602   9.256  -2.630
  260    HA   ILE  33           HA       ILE  33   6.238  11.983  -1.436
  261    HB   ILE  33           HB       ILE  33   4.807   9.419  -0.700
  262   1HG1  ILE  33          1HG1      ILE  33   4.435   9.708  -3.077
  263   2HG1  ILE  33          2HG1      ILE  33   2.984  10.255  -2.235
  264   1HG2  ILE  33          1HG2      ILE  33   4.760  11.556   0.740
  265   2HG2  ILE  33          2HG2      ILE  33   3.815  12.270  -0.567
  266   3HG2  ILE  33          3HG2      ILE  33   3.204  10.857   0.295
  267   1HD1  ILE  33          1HD1      ILE  33   4.610  12.524  -2.343
  268   2HD1  ILE  33          2HD1      ILE  33   4.812  11.767  -3.925
  269   3HD1  ILE  33          3HD1      ILE  33   3.201  12.202  -3.354
  270    H    GLY  34           H        GLY  34   7.175   8.613  -0.711
  271   1HA   GLY  34          1HA       GLY  34   9.372   8.939   0.834
  272   2HA   GLY  34          2HA       GLY  34   8.106   9.393   1.975
  273    H    GLY  35           H        GLY  35   9.678   6.757   0.391
  274   1HA   GLY  35          1HA       GLY  35   8.082   4.876   2.051
  275   2HA   GLY  35          2HA       GLY  35   8.212   4.551   0.320
  276    H    SER  36           H        SER  36   9.499   3.610   3.163
  277    HA   SER  36           HA       SER  36  12.302   3.420   2.165
  278   1HB   SER  36          1HB       SER  36  12.824   3.636   4.359
  279   2HB   SER  36          2HB       SER  36  11.130   4.037   4.612
  280    HG   SER  36           HG       SER  36  12.506   1.872   5.406
  281    H    TYR  37           H        TYR  37   9.703   1.354   3.526
  282    HA   TYR  37           HA       TYR  37  10.818  -0.930   1.965
  283   1HB   TYR  37          1HB       TYR  37  11.580  -0.607   4.492
  284   2HB   TYR  37          2HB       TYR  37  10.008  -1.332   4.824
  285    HD1  TYR  37           HD1      TYR  37  13.168  -1.837   2.896
  286    HD2  TYR  37           HD2      TYR  37   9.682  -3.662   4.617
  287    HE1  TYR  37           HE1      TYR  37  14.099  -4.081   2.402
  288    HE2  TYR  37           HE2      TYR  37  10.612  -5.907   4.122
  289    HH   TYR  37           HH       TYR  37  13.156  -6.420   2.024
  290    H    GLY  38           H        GLY  38   9.211  -2.397   1.318
  291   1HA   GLY  38          1HA       GLY  38   6.473  -2.039   2.420
  292   2HA   GLY  38          2HA       GLY  38   6.699  -1.878   0.679
  293    H    TYR  39           H        TYR  39   5.221  -3.938   2.308
  294    HA   TYR  39           HA       TYR  39   6.048  -6.260   0.759
  295   1HB   TYR  39          1HB       TYR  39   6.938  -7.568   2.562
  296   2HB   TYR  39          2HB       TYR  39   7.739  -6.001   2.658
  297    HD1  TYR  39           HD1      TYR  39   6.288  -4.184   4.055
  298    HD2  TYR  39           HD2      TYR  39   6.145  -8.445   4.570
  299    HE1  TYR  39           HE1      TYR  39   5.431  -3.875   6.361
  300    HE2  TYR  39           HE2      TYR  39   5.288  -8.137   6.878
  301    HH   TYR  39           HH       TYR  39   5.556  -5.503   8.598
  302    H    CYS  40           H        CYS  40   4.657  -8.198   1.400
  303    HA   CYS  40           HA       CYS  40   1.916  -7.289   1.916
  304   1HB   CYS  40          1HB       CYS  40   2.491  -8.931   0.176
  305   2HB   CYS  40          2HB       CYS  40   3.153 -10.013   1.402
  306    H    TYR  41           H        TYR  41   1.154  -7.118   3.981
  307    HA   TYR  41           HA       TYR  41   2.077  -9.132   6.002
  308   1HB   TYR  41          1HB       TYR  41   3.140  -6.921   6.316
  309   2HB   TYR  41          2HB       TYR  41   1.548  -6.162   6.352
  310    HD1  TYR  41           HD1      TYR  41   0.005  -6.545   8.237
  311    HD2  TYR  41           HD2      TYR  41   3.959  -8.225   8.196
  312    HE1  TYR  41           HE1      TYR  41  -0.173  -7.027  10.664
  313    HE2  TYR  41           HE2      TYR  41   3.778  -8.708  10.621
  314    HH   TYR  41           HH       TYR  41   0.987  -7.628  12.507
  315    H    GLY  42           H        GLY  42   0.436  -9.835   7.454
  316   1HA   GLY  42          1HA       GLY  42  -1.789 -10.464   7.924
  317   2HA   GLY  42          2HA       GLY  42  -2.049  -8.720   7.982
  318    H    PHE  43           H        PHE  43  -1.040 -10.446   5.085
  319    HA   PHE  43           HA       PHE  43  -2.144 -10.749   3.016
  320   1HB   PHE  43          1HB       PHE  43  -4.659 -10.440   4.675
  321   2HB   PHE  43          2HB       PHE  43  -4.451 -11.380   3.196
  322    HD1  PHE  43           HD1      PHE  43  -2.069 -12.908   3.530
  323    HD2  PHE  43           HD2      PHE  43  -4.996 -11.857   6.494
  324    HE1  PHE  43           HE1      PHE  43  -1.417 -14.888   4.877
  325    HE2  PHE  43           HE2      PHE  43  -4.343 -13.836   7.840
  326    HZ   PHE  43           HZ       PHE  43  -2.555 -15.351   7.031
  327    H    GLY  44           H        GLY  44  -1.228  -8.311   2.996
  328   1HA   GLY  44          1HA       GLY  44  -3.081  -6.737   1.530
  329   2HA   GLY  44          2HA       GLY  44  -3.057  -6.130   3.186
  330    H    CYS  45           H        CYS  45  -2.170  -4.537   1.057
  331    HA   CYS  45           HA       CYS  45   0.756  -4.682   0.870
  332   1HB   CYS  45          1HB       CYS  45  -1.504  -3.319  -0.360
  333   2HB   CYS  45          2HB       CYS  45  -0.178  -2.200  -0.043
  334    H    TYR  46           H        TYR  46   1.733  -4.245   2.858
  335    HA   TYR  46           HA       TYR  46   0.861  -1.778   4.326
  336   1HB   TYR  46          1HB       TYR  46   0.952  -4.239   5.262
  337   2HB   TYR  46          2HB       TYR  46   2.686  -3.938   5.372
  338    HD1  TYR  46           HD1      TYR  46  -0.252  -1.668   5.923
  339    HD2  TYR  46           HD2      TYR  46   3.197  -3.585   7.626
  340    HE1  TYR  46           HE1      TYR  46  -0.603  -0.425   8.041
  341    HE2  TYR  46           HE2      TYR  46   2.843  -2.342   9.743
  342    HH   TYR  46           HH       TYR  46   1.331   0.239  10.124
  343    H    CYS  47           H        CYS  47   2.235  -0.039   4.059
  344    HA   CYS  47           HA       CYS  47   5.071  -0.593   3.254
  345   1HB   CYS  47          1HB       CYS  47   3.322   1.861   2.886
  346   2HB   CYS  47          2HB       CYS  47   4.940   1.634   2.219
  347    H    GLU  48           H        GLU  48   6.720   0.279   4.493
  348    HA   GLU  48           HA       GLU  48   5.900   1.738   6.977
  349   1HB   GLU  48          1HB       GLU  48   8.337   0.046   6.326
  350   2HB   GLU  48          2HB       GLU  48   7.970   0.747   7.903
  351   1HG   GLU  48          1HG       GLU  48   6.528  -0.917   8.402
  352   2HG   GLU  48          2HG       GLU  48   5.712  -0.763   6.845
  353    H    GLY  49           H        GLY  49   6.244   3.922   6.630
  354   1HA   GLY  49          1HA       GLY  49   8.383   5.416   6.702
  355   2HA   GLY  49          2HA       GLY  49   8.680   4.729   5.108
  356    H    LEU  50           H        LEU  50   5.363   5.358   5.970
  357    HA   LEU  50           HA       LEU  50   5.227   7.399   3.849
  358   1HB   LEU  50          1HB       LEU  50   3.011   6.366   5.629
  359   2HB   LEU  50          2HB       LEU  50   2.874   7.003   3.995
  360    HG   LEU  50           HG       LEU  50   2.762   4.773   3.491
  361   1HD1  LEU  50          1HD1      LEU  50   5.166   5.832   2.856
  362   2HD1  LEU  50          2HD1      LEU  50   5.684   4.444   3.812
  363   3HD1  LEU  50          3HD1      LEU  50   4.672   4.205   2.388
  364   1HD2  LEU  50          1HD2      LEU  50   3.391   4.459   6.164
  365   2HD2  LEU  50          2HD2      LEU  50   3.028   3.152   5.036
  366   3HD2  LEU  50          3HD2      LEU  50   4.702   3.612   5.344
  367    HA   PRO  51           HA       PRO  51   5.799  10.630   6.946
  368   1HB   PRO  51          1HB       PRO  51   4.585  12.419   4.990
  369   2HB   PRO  51          2HB       PRO  51   6.254  12.381   5.568
  370   1HG   PRO  51          1HG       PRO  51   5.311  11.547   3.021
  371   2HG   PRO  51          2HG       PRO  51   6.942  11.347   3.671
  372   1HD   PRO  51          1HD       PRO  51   4.956   9.298   3.192
  373   2HD   PRO  51          2HD       PRO  51   6.609   9.095   3.822
  374    H    ASP  52           H        ASP  52   4.318  11.940   8.233
  375    HA   ASP  52           HA       ASP  52   1.740  10.832   8.689
  376   1HB   ASP  52          1HB       ASP  52   3.243  13.320   9.431
  377   2HB   ASP  52          2HB       ASP  52   1.530  13.221   9.840
  378    H    SER  53           H        SER  53   2.789  13.511   6.629
  379    HA   SER  53           HA       SER  53   0.147  14.548   6.072
  380   1HB   SER  53          1HB       SER  53   2.197  14.897   4.006
  381   2HB   SER  53          2HB       SER  53   1.388  16.111   4.991
  382    HG   SER  53           HG       SER  53   3.577  16.038   5.511
  383    H    THR  54           H        THR  54   1.989  11.850   4.858
  384    HA   THR  54           HA       THR  54   0.730  11.575   2.278
  385    HB   THR  54           HB       THR  54   1.830   9.362   4.027
  386    HG1  THR  54           HG1      THR  54   3.283  11.219   2.455
  387   1HG2  THR  54          1HG2      THR  54   1.591   9.898   1.073
  388   2HG2  THR  54          2HG2      THR  54   2.786   8.759   1.691
  389   3HG2  THR  54          3HG2      THR  54   1.069   8.480   1.982
  390    H    GLN  55           H        GLN  55  -1.103  10.369   1.688
  391    HA   GLN  55           HA       GLN  55  -3.081   9.880   3.810
  392   1HB   GLN  55          1HB       GLN  55  -3.352  10.894   1.416
  393   2HB   GLN  55          2HB       GLN  55  -3.361   9.212   0.883
  394   1HG   GLN  55          1HG       GLN  55  -5.657  10.070   1.313
  395   2HG   GLN  55          2HG       GLN  55  -5.243   8.716   2.366
  396   1HE2  GLN  55          2HE2      GLN  55  -6.246   9.191   4.345
  397   2HE2  GLN  55          1HE2      GLN  55  -6.102  10.671   5.164
  398    H    THR  56           H        THR  56  -4.309   7.745   3.742
  399    HA   THR  56           HA       THR  56  -2.753   5.412   2.793
  400    HB   THR  56           HB       THR  56  -3.366   4.827   5.471
  401    HG1  THR  56           HG1      THR  56  -2.807   6.554   6.610
  402   1HG2  THR  56          1HG2      THR  56  -1.145   4.892   3.716
  403   2HG2  THR  56          2HG2      THR  56  -0.653   5.733   5.187
  404   3HG2  THR  56          3HG2      THR  56  -1.259   4.079   5.276
  405    H    TRP  57           H        TRP  57  -4.037   3.485   2.755
  406    HA   TRP  57           HA       TRP  57  -6.878   3.861   2.380
  407   1HB   TRP  57          1HB       TRP  57  -5.055   2.192   1.426
  408   2HB   TRP  57          2HB       TRP  57  -5.538   1.208   2.806
  409    HD1  TRP  57           HD1      TRP  57  -6.882   2.699  -0.442
  410    HE1  TRP  57           HE1      TRP  57  -9.073   1.492  -1.065
  411    HE3  TRP  57           HE3      TRP  57  -7.551  -0.140   3.751
  412    HZ2  TRP  57           HZ2      TRP  57 -10.868  -0.424   0.062
  413    HZ3  TRP  57           HZ3      TRP  57  -9.510  -1.647   3.947
  414    HH2  TRP  57           HH2      TRP  57 -11.168  -1.792   2.110
  415    HA   PRO  58           HA       PRO  58  -8.641   2.833   2.417
  416   1HB   PRO  58          1HB       PRO  58 -11.014   3.494   3.790
  417   2HB   PRO  58          2HB       PRO  58 -10.561   1.898   3.186
  418   1HG   PRO  58          1HG       PRO  58 -10.740   2.788   5.929
  419   2HG   PRO  58          2HG       PRO  58 -10.385   1.168   5.324
  420   1HD   PRO  58          1HD       PRO  58  -8.545   3.097   6.486
  421   2HD   PRO  58          2HD       PRO  58  -8.215   1.421   5.980
  422    H    LEU  59           H        LEU  59  -9.966   4.713   1.533
  423    HA   LEU  59           HA       LEU  59  -8.816   7.273   2.464
  424   1HB   LEU  59          1HB       LEU  59 -10.602   6.498   0.136
  425   2HB   LEU  59          2HB       LEU  59  -9.808   8.055   0.331
  426    HG   LEU  59           HG       LEU  59  -8.093   5.621   0.475
  427   1HD1  LEU  59          1HD1      LEU  59  -9.880   5.976  -1.670
  428   2HD1  LEU  59          2HD1      LEU  59  -8.326   6.571  -2.254
  429   3HD1  LEU  59          3HD1      LEU  59  -8.466   4.924  -1.638
  430   1HD2  LEU  59          1HD2      LEU  59  -7.754   8.412   0.332
  431   2HD2  LEU  59          2HD2      LEU  59  -6.490   7.188   0.212
  432   3HD2  LEU  59          3HD2      LEU  59  -7.263   7.803  -1.249
  433    HA   PRO  60           HA       PRO  60 -12.383   8.791   4.553
  434   1HB   PRO  60          1HB       PRO  60 -12.553  11.254   3.094
  435   2HB   PRO  60          2HB       PRO  60 -11.826  10.980   4.680
  436   1HG   PRO  60          1HG       PRO  60 -10.486  11.522   2.200
  437   2HG   PRO  60          2HG       PRO  60  -9.765  11.256   3.790
  438   1HD   PRO  60          1HD       PRO  60  -9.732   9.486   1.514
  439   2HD   PRO  60          2HD       PRO  60  -9.016   9.210   3.120
  440    H    ASN  61           H        ASN  61 -14.372  10.499   3.548
  441    HA   ASN  61           HA       ASN  61 -16.329   8.907   2.449
  442   1HB   ASN  61          1HB       ASN  61 -15.625  11.804   2.358
  443   2HB   ASN  61          2HB       ASN  61 -16.890  11.265   1.252
  444   1HD2  ASN  61          2HD2      ASN  61 -16.401   9.596   4.319
  445   2HD2  ASN  61          1HD2      ASN  61 -17.818  10.159   5.061
  446    H    LYS  62           H        LYS  62 -13.599  10.353   0.807
  447    HA   LYS  62           HA       LYS  62 -14.583   9.544  -1.874
  448   1HB   LYS  62          1HB       LYS  62 -12.440  10.651  -2.564
  449   2HB   LYS  62          2HB       LYS  62 -13.460  11.695  -1.574
  450   1HG   LYS  62          1HG       LYS  62 -11.933  11.780   0.090
  451   2HG   LYS  62          2HG       LYS  62 -11.663  10.037   0.031
  452   1HD   LYS  62          1HD       LYS  62  -9.693  10.414  -0.987
  453   2HD   LYS  62          2HD       LYS  62 -10.568  11.102  -2.355
  454   1HE   LYS  62          1HE       LYS  62  -9.325  12.970  -1.784
  455   2HE   LYS  62          2HE       LYS  62 -10.668  13.211  -0.648
  456   1HZ   LYS  62          1HZ       LYS  62  -9.219  11.461   0.706
  457   2HZ   LYS  62          2HZ       LYS  62  -7.970  12.229  -0.145
  458   3HZ   LYS  62          3HZ       LYS  62  -8.997  13.139   0.857
  459    H    THR  63           H        THR  63 -14.553   7.189  -1.479
  460    HA   THR  63           HA       THR  63 -11.815   6.023  -1.166
  461    HB   THR  63           HB       THR  63 -13.701   5.461   0.426
  462    HG1  THR  63           HG1      THR  63 -12.267   3.905   0.484
  463   1HG2  THR  63          1HG2      THR  63 -15.263   5.356  -1.760
  464   2HG2  THR  63          2HG2      THR  63 -14.835   3.648  -1.638
  465   3HG2  THR  63          3HG2      THR  63 -15.635   4.455  -0.289
  466    H    CYS  64           H        CYS  64 -12.292   3.541  -2.224
  467    HA   CYS  64           HA       CYS  64 -12.429   4.143  -5.138
  468   1HB   CYS  64          1HB       CYS  64 -10.474   2.994  -3.996
  469   2HB   CYS  64          2HB       CYS  64 -11.549   1.631  -3.685
  Start of MODEL   35
    1   1H    LYS   1          1H        LYS   1   6.424   7.826   7.997
    2   2H    LYS   1          2H        LYS   1   5.491   9.143   8.524
    3   3H    LYS   1          3H        LYS   1   6.656   8.465   9.553
    4    HA   LYS   1           HA       LYS   1   5.319   6.784  10.209
    5   1HB   LYS   1          1HB       LYS   1   3.070   7.622  10.384
    6   2HB   LYS   1          2HB       LYS   1   4.127   9.034  10.364
    7   1HG   LYS   1          1HG       LYS   1   3.744   9.194   7.878
    8   2HG   LYS   1          2HG       LYS   1   2.545   7.911   8.037
    9   1HD   LYS   1          1HD       LYS   1   1.326   9.324   9.708
   10   2HD   LYS   1          2HD       LYS   1   2.469  10.627   9.380
   11   1HE   LYS   1          1HE       LYS   1   1.392   9.550   6.897
   12   2HE   LYS   1          2HE       LYS   1   0.098  10.126   7.967
   13   1HZ   LYS   1          1HZ       LYS   1   1.831  12.048   8.361
   14   2HZ   LYS   1          2HZ       LYS   1   2.343  11.606   6.805
   15   3HZ   LYS   1          3HZ       LYS   1   0.737  12.101   7.063
   16    H    ASP   2           H        ASP   2   4.728   4.770   9.468
   17    HA   ASP   2           HA       ASP   2   4.525   4.269   6.602
   18   1HB   ASP   2          1HB       ASP   2   3.874   2.412   8.904
   19   2HB   ASP   2          2HB       ASP   2   4.478   1.980   7.304
   20    H    GLY   3           H        GLY   3   2.613   3.078   5.686
   21   1HA   GLY   3          1HA       GLY   3   0.047   3.471   7.089
   22   2HA   GLY   3          2HA       GLY   3   0.254   4.383   5.595
   23    H    TYR   4           H        TYR   4  -1.634   3.025   4.937
   24    HA   TYR   4           HA       TYR   4  -0.755   0.309   4.003
   25   1HB   TYR   4          1HB       TYR   4  -3.031   1.280   5.486
   26   2HB   TYR   4          2HB       TYR   4  -3.581   0.575   3.965
   27    HD1  TYR   4           HD1      TYR   4  -1.946  -1.614   3.348
   28    HD2  TYR   4           HD2      TYR   4  -3.104  -0.240   7.248
   29    HE1  TYR   4           HE1      TYR   4  -1.570  -3.889   4.259
   30    HE2  TYR   4           HE2      TYR   4  -2.730  -2.515   8.161
   31    HH   TYR   4           HH       TYR   4  -2.381  -4.679   7.615
   32    H    LEU   5           H        LEU   5  -0.458   0.273   1.812
   33    HA   LEU   5           HA       LEU   5  -1.078   2.379   0.028
   34   1HB   LEU   5          1HB       LEU   5  -0.127  -0.384  -0.027
   35   2HB   LEU   5          2HB       LEU   5  -1.048   0.030  -1.473
   36    HG   LEU   5           HG       LEU   5   1.243   1.672  -0.358
   37   1HD1  LEU   5          1HD1      LEU   5   1.816  -0.615  -1.348
   38   2HD1  LEU   5          2HD1      LEU   5   1.208   0.005  -2.883
   39   3HD1  LEU   5          3HD1      LEU   5   2.596   0.771  -2.110
   40   1HD2  LEU   5          1HD2      LEU   5  -0.808   2.556  -1.893
   41   2HD2  LEU   5          2HD2      LEU   5   0.833   3.186  -2.033
   42   3HD2  LEU   5          3HD2      LEU   5   0.266   1.946  -3.152
   43    H    VAL   6           H        VAL   6  -2.750   2.615  -1.528
   44    HA   VAL   6           HA       VAL   6  -5.287   1.136  -0.902
   45    HB   VAL   6           HB       VAL   6  -6.382   3.210  -1.620
   46   1HG1  VAL   6          1HG1      VAL   6  -5.367   2.964   0.724
   47   2HG1  VAL   6          2HG1      VAL   6  -4.065   4.005   0.149
   48   3HG1  VAL   6          3HG1      VAL   6  -5.722   4.608   0.191
   49   1HG2  VAL   6          1HG2      VAL   6  -3.816   3.622  -2.883
   50   2HG2  VAL   6          2HG2      VAL   6  -5.324   4.503  -3.133
   51   3HG2  VAL   6          3HG2      VAL   6  -4.209   5.006  -1.863
   52    H    GLU   7           H        GLU   7  -6.744   1.759  -3.132
   53    HA   GLU   7           HA       GLU   7  -5.123   0.607  -5.383
   54   1HB   GLU   7          1HB       GLU   7  -7.296  -0.452  -4.036
   55   2HB   GLU   7          2HB       GLU   7  -8.044   0.279  -5.456
   56   1HG   GLU   7          1HG       GLU   7  -5.768  -0.963  -6.474
   57   2HG   GLU   7          2HG       GLU   7  -6.369  -2.105  -5.272
   58    H    LYS   8           H        LYS   8  -5.894   1.289  -7.567
   59    HA   LYS   8           HA       LYS   8  -6.010   4.019  -8.024
   60   1HB   LYS   8          1HB       LYS   8  -7.306   1.706  -9.494
   61   2HB   LYS   8          2HB       LYS   8  -7.153   3.324 -10.181
   62   1HG   LYS   8          1HG       LYS   8  -4.845   3.180 -10.365
   63   2HG   LYS   8          2HG       LYS   8  -4.709   2.019  -9.044
   64   1HD   LYS   8          1HD       LYS   8  -4.482   0.470 -10.685
   65   2HD   LYS   8          2HD       LYS   8  -6.229   0.628 -10.865
   66   1HE   LYS   8          1HE       LYS   8  -6.049   1.963 -12.768
   67   2HE   LYS   8          2HE       LYS   8  -4.444   2.569 -12.313
   68   1HZ   LYS   8          1HZ       LYS   8  -4.680  -0.308 -12.647
   69   2HZ   LYS   8          2HZ       LYS   8  -4.805   0.606 -14.074
   70   3HZ   LYS   8          3HZ       LYS   8  -3.420   0.734 -13.098
   71    H    THR   9           H        THR   9  -8.706   1.878  -7.181
   72    HA   THR   9           HA       THR   9 -10.696   4.036  -7.504
   73    HB   THR   9           HB       THR   9 -12.208   2.167  -6.742
   74    HG1  THR   9           HG1      THR   9  -9.988   0.478  -6.972
   75   1HG2  THR   9          1HG2      THR   9 -10.264   1.723  -9.011
   76   2HG2  THR   9          2HG2      THR   9 -11.655   0.672  -8.740
   77   3HG2  THR   9          3HG2      THR   9 -11.897   2.382  -9.096
   78    H    GLY  10           H        GLY  10  -8.649   2.757  -5.036
   79   1HA   GLY  10          1HA       GLY  10  -8.394   4.108  -2.979
   80   2HA   GLY  10          2HA       GLY  10 -10.138   4.366  -3.003
   81    H    CYS  11           H        CYS  11  -8.952   1.205  -3.803
   82    HA   CYS  11           HA       CYS  11 -10.124   0.190  -1.255
   83   1HB   CYS  11          1HB       CYS  11  -9.399  -1.140  -3.886
   84   2HB   CYS  11          2HB       CYS  11 -10.189  -1.949  -2.532
   85    H    LYS  12           H        LYS  12  -8.945  -1.821  -0.376
   86    HA   LYS  12           HA       LYS  12  -6.220  -1.122   0.270
   87   1HB   LYS  12          1HB       LYS  12  -7.785  -3.696   0.637
   88   2HB   LYS  12          2HB       LYS  12  -6.334  -3.238   1.525
   89   1HG   LYS  12          1HG       LYS  12  -7.445  -1.432   2.614
   90   2HG   LYS  12          2HG       LYS  12  -8.821  -1.523   1.514
   91   1HD   LYS  12          1HD       LYS  12  -8.430  -4.092   2.753
   92   2HD   LYS  12          2HD       LYS  12  -8.516  -2.849   4.002
   93   1HE   LYS  12          1HE       LYS  12 -10.788  -3.251   3.714
   94   2HE   LYS  12          2HE       LYS  12 -10.563  -2.015   2.460
   95   1HZ   LYS  12          1HZ       LYS  12 -10.227  -4.933   2.015
   96   2HZ   LYS  12          2HZ       LYS  12 -11.630  -4.062   1.612
   97   3HZ   LYS  12          3HZ       LYS  12 -10.158  -3.713   0.838
   98    H    LYS  13           H        LYS  13  -4.442  -2.832   0.015
   99    HA   LYS  13           HA       LYS  13  -4.528  -4.023  -2.740
  100   1HB   LYS  13          1HB       LYS  13  -2.714  -2.177  -1.353
  101   2HB   LYS  13          2HB       LYS  13  -1.870  -3.545  -2.081
  102   1HG   LYS  13          1HG       LYS  13  -3.945  -2.018  -3.643
  103   2HG   LYS  13          2HG       LYS  13  -2.283  -1.435  -3.546
  104   1HD   LYS  13          1HD       LYS  13  -2.392  -4.291  -4.122
  105   2HD   LYS  13          2HD       LYS  13  -3.248  -3.343  -5.338
  106   1HE   LYS  13          1HE       LYS  13  -1.233  -2.849  -6.253
  107   2HE   LYS  13          2HE       LYS  13  -0.866  -1.913  -4.790
  108   1HZ   LYS  13          1HZ       LYS  13  -0.673  -4.826  -4.624
  109   2HZ   LYS  13          2HZ       LYS  13   0.555  -4.018  -5.469
  110   3HZ   LYS  13          3HZ       LYS  13   0.250  -3.634  -3.842
  111    H    THR  14           H        THR  14  -5.425  -5.746  -0.961
  112    HA   THR  14           HA       THR  14  -3.886  -7.129   0.867
  113    HB   THR  14           HB       THR  14  -5.563  -8.456  -1.270
  114    HG1  THR  14           HG1      THR  14  -6.921  -6.934  -0.687
  115   1HG2  THR  14          1HG2      THR  14  -4.298  -9.597   0.793
  116   2HG2  THR  14          2HG2      THR  14  -5.738  -9.044   1.648
  117   3HG2  THR  14          3HG2      THR  14  -5.894 -10.136   0.271
  118    H    CYS  15           H        CYS  15  -2.494  -8.989   0.734
  119    HA   CYS  15           HA       CYS  15  -1.129  -9.380  -1.909
  120   1HB   CYS  15          1HB       CYS  15   0.942  -9.684  -0.407
  121   2HB   CYS  15          2HB       CYS  15   0.320  -8.042  -0.553
  122    H    TYR  16           H        TYR  16  -0.252 -11.566  -2.187
  123    HA   TYR  16           HA       TYR  16  -1.674 -13.584  -0.492
  124   1HB   TYR  16          1HB       TYR  16  -0.705 -13.415  -3.334
  125   2HB   TYR  16          2HB       TYR  16  -0.975 -14.995  -2.603
  126    HD1  TYR  16           HD1      TYR  16  -3.100 -12.589  -1.079
  127    HD2  TYR  16           HD2      TYR  16  -2.698 -15.003  -4.613
  128    HE1  TYR  16           HE1      TYR  16  -5.532 -12.376  -1.502
  129    HE2  TYR  16           HE2      TYR  16  -5.133 -14.786  -5.032
  130    HH   TYR  16           HH       TYR  16  -7.209 -14.328  -3.622
  131    H    LYS  17           H        LYS  17   1.445 -12.317  -1.141
  132    HA   LYS  17           HA       LYS  17   2.739 -14.807  -0.084
  133   1HB   LYS  17          1HB       LYS  17   3.388 -12.764  -2.117
  134   2HB   LYS  17          2HB       LYS  17   4.742 -13.223  -1.084
  135   1HG   LYS  17          1HG       LYS  17   4.953 -15.198  -2.143
  136   2HG   LYS  17          2HG       LYS  17   3.250 -15.571  -1.871
  137   1HD   LYS  17          1HD       LYS  17   4.174 -13.691  -4.052
  138   2HD   LYS  17          2HD       LYS  17   3.969 -15.424  -4.315
  139   1HE   LYS  17          1HE       LYS  17   1.602 -15.269  -3.649
  140   2HE   LYS  17          2HE       LYS  17   1.796 -13.533  -3.333
  141   1HZ   LYS  17          1HZ       LYS  17   2.736 -14.539  -5.907
  142   2HZ   LYS  17          2HZ       LYS  17   1.052 -14.448  -5.694
  143   3HZ   LYS  17          3HZ       LYS  17   2.004 -13.054  -5.526
  144    H    LEU  18           H        LEU  18   2.407 -14.282   2.161
  145    HA   LEU  18           HA       LEU  18   2.912 -11.776   3.398
  146   1HB   LEU  18          1HB       LEU  18   3.095 -14.659   4.304
  147   2HB   LEU  18          2HB       LEU  18   3.290 -13.308   5.421
  148    HG   LEU  18           HG       LEU  18   0.861 -13.893   3.705
  149   1HD1  LEU  18          1HD1      LEU  18   1.662 -14.556   6.425
  150   2HD1  LEU  18          2HD1      LEU  18   0.170 -13.615   6.403
  151   3HD1  LEU  18          3HD1      LEU  18   0.273 -15.127   5.501
  152   1HD2  LEU  18          1HD2      LEU  18   1.843 -11.425   4.883
  153   2HD2  LEU  18          2HD2      LEU  18   0.443 -11.680   3.843
  154   3HD2  LEU  18          3HD2      LEU  18   0.293 -11.884   5.587
  155    H    GLY  19           H        GLY  19   4.808 -10.836   4.200
  156   1HA   GLY  19          1HA       GLY  19   7.161 -11.210   5.001
  157   2HA   GLY  19          2HA       GLY  19   7.355 -12.302   3.631
  158    H    GLU  20           H        GLU  20   9.238 -10.689   3.320
  159    HA   GLU  20           HA       GLU  20   8.824  -7.997   2.500
  160   1HB   GLU  20          1HB       GLU  20  10.983  -9.189   3.050
  161   2HB   GLU  20          2HB       GLU  20  10.884  -9.971   1.471
  162   1HG   GLU  20          1HG       GLU  20  10.654  -7.584   0.513
  163   2HG   GLU  20          2HG       GLU  20  11.232  -7.037   2.087
  164    H    ASN  21           H        ASN  21   6.798  -8.250   1.188
  165    HA   ASN  21           HA       ASN  21   6.791  -9.716  -1.305
  166   1HB   ASN  21          1HB       ASN  21   4.931  -8.637   0.299
  167   2HB   ASN  21          2HB       ASN  21   5.086  -7.305  -0.848
  168   1HD2  ASN  21          2HD2      ASN  21   3.533 -10.290  -0.335
  169   2HD2  ASN  21          1HD2      ASN  21   3.021 -10.574  -1.929
  170    H    ASP  22           H        ASP  22   8.839  -8.955  -2.299
  171    HA   ASP  22           HA       ASP  22   9.567  -6.296  -2.842
  172   1HB   ASP  22          1HB       ASP  22   9.967  -8.982  -4.056
  173   2HB   ASP  22          2HB       ASP  22  10.371  -7.600  -5.077
  174    H    PHE  23           H        PHE  23   7.026  -8.248  -4.291
  175    HA   PHE  23           HA       PHE  23   6.597  -6.719  -6.674
  176   1HB   PHE  23          1HB       PHE  23   5.428  -8.881  -5.205
  177   2HB   PHE  23          2HB       PHE  23   4.143  -7.739  -5.605
  178    HD1  PHE  23           HD1      PHE  23   5.155  -6.586  -8.138
  179    HD2  PHE  23           HD2      PHE  23   5.132 -10.652  -6.752
  180    HE1  PHE  23           HE1      PHE  23   5.176  -7.386 -10.485
  181    HE2  PHE  23           HE2      PHE  23   5.152 -11.452  -9.099
  182    HZ   PHE  23           HZ       PHE  23   5.175  -9.819 -10.966
  183    H    CYS  24           H        CYS  24   4.996  -6.535  -3.468
  184    HA   CYS  24           HA       CYS  24   3.473  -4.161  -4.091
  185   1HB   CYS  24          1HB       CYS  24   3.015  -5.849  -2.282
  186   2HB   CYS  24          2HB       CYS  24   4.432  -5.252  -1.419
  187    H    ASN  25           H        ASN  25   6.735  -4.771  -2.999
  188    HA   ASN  25           HA       ASN  25   7.422  -2.251  -1.872
  189   1HB   ASN  25          1HB       ASN  25   8.686  -4.491  -1.988
  190   2HB   ASN  25          2HB       ASN  25   9.186  -3.999  -3.606
  191   1HD2  ASN  25          2HD2      ASN  25  11.437  -3.733  -3.008
  192   2HD2  ASN  25          1HD2      ASN  25  11.951  -2.475  -1.991
  193    H    ARG  26           H        ARG  26   8.214  -3.376  -5.194
  194    HA   ARG  26           HA       ARG  26   8.868  -0.806  -6.228
  195   1HB   ARG  26          1HB       ARG  26   9.363  -3.040  -7.252
  196   2HB   ARG  26          2HB       ARG  26   7.652  -3.197  -7.655
  197   1HG   ARG  26          1HG       ARG  26   8.298  -0.681  -8.627
  198   2HG   ARG  26          2HG       ARG  26   9.737  -1.633  -8.991
  199   1HD   ARG  26          1HD       ARG  26   7.270  -3.101  -9.576
  200   2HD   ARG  26          2HD       ARG  26   7.416  -1.604 -10.517
  201    HE   ARG  26           HE       ARG  26   9.965  -2.742 -10.589
  202   1HH1  ARG  26          1HH1      ARG  26   6.745  -3.694 -11.403
  203   2HH1  ARG  26          2HH1      ARG  26   7.243  -4.752 -12.680
  204   1HH2  ARG  26          1HH2      ARG  26  10.623  -4.107 -12.263
  205   2HH2  ARG  26          2HH2      ARG  26   9.434  -4.978 -13.173
  206    H    GLU  27           H        GLU  27   5.775  -2.616  -6.274
  207    HA   GLU  27           HA       GLU  27   4.176  -0.829  -7.736
  208   1HB   GLU  27          1HB       GLU  27   3.859  -3.105  -6.200
  209   2HB   GLU  27          2HB       GLU  27   2.951  -1.904  -5.280
  210   1HG   GLU  27          1HG       GLU  27   1.264  -2.058  -6.757
  211   2HG   GLU  27          2HG       GLU  27   2.347  -1.511  -8.038
  212    H    CYS  28           H        CYS  28   5.181  -0.692  -4.330
  213    HA   CYS  28           HA       CYS  28   3.632   1.607  -3.575
  214   1HB   CYS  28          1HB       CYS  28   4.999  -0.160  -2.211
  215   2HB   CYS  28          2HB       CYS  28   6.370   0.909  -2.506
  216    H    LYS  29           H        LYS  29   6.746   1.157  -5.163
  217    HA   LYS  29           HA       LYS  29   7.085   4.127  -5.373
  218   1HB   LYS  29          1HB       LYS  29   8.840   2.591  -4.315
  219   2HB   LYS  29          2HB       LYS  29   9.092   1.927  -5.929
  220   1HG   LYS  29          1HG       LYS  29   9.792   4.050  -6.792
  221   2HG   LYS  29          2HG       LYS  29   9.264   4.887  -5.332
  222   1HD   LYS  29          1HD       LYS  29  11.145   2.734  -4.738
  223   2HD   LYS  29          2HD       LYS  29  11.837   3.939  -5.826
  224   1HE   LYS  29          1HE       LYS  29  11.550   5.690  -4.266
  225   2HE   LYS  29          2HE       LYS  29  10.347   4.778  -3.333
  226   1HZ   LYS  29          1HZ       LYS  29  12.385   3.084  -3.272
  227   2HZ   LYS  29          2HZ       LYS  29  13.250   4.541  -3.339
  228   3HZ   LYS  29          3HZ       LYS  29  12.142   4.270  -2.080
  229    H    TRP  30           H        TRP  30   5.164   2.921  -7.045
  230    HA   TRP  30           HA       TRP  30   6.399   2.304  -9.651
  231   1HB   TRP  30          1HB       TRP  30   4.104   1.613  -8.283
  232   2HB   TRP  30          2HB       TRP  30   3.499   2.774  -9.461
  233    HD1  TRP  30           HD1      TRP  30   2.931  -0.392  -9.577
  234    HE1  TRP  30           HE1      TRP  30   3.599  -1.681 -11.704
  235    HE3  TRP  30           HE3      TRP  30   6.404   2.821 -11.504
  236    HZ2  TRP  30           HZ2      TRP  30   5.366  -1.386 -13.935
  237    HZ3  TRP  30           HZ3      TRP  30   7.560   2.293 -13.631
  238    HH2  TRP  30           HH2      TRP  30   7.047   0.196 -14.848
  239    H    LYS  31           H        LYS  31   5.930   5.154  -8.062
  240    HA   LYS  31           HA       LYS  31   5.929   6.693 -10.560
  241   1HB   LYS  31          1HB       LYS  31   3.864   8.004  -9.664
  242   2HB   LYS  31          2HB       LYS  31   3.585   6.446 -10.437
  243   1HG   LYS  31          1HG       LYS  31   3.828   5.507  -7.982
  244   2HG   LYS  31          2HG       LYS  31   3.445   7.165  -7.525
  245   1HD   LYS  31          1HD       LYS  31   1.282   6.514  -7.745
  246   2HD   LYS  31          2HD       LYS  31   1.575   6.674  -9.478
  247   1HE   LYS  31          1HE       LYS  31   2.144   4.302  -9.648
  248   2HE   LYS  31          2HE       LYS  31   1.991   4.114  -7.890
  249   1HZ   LYS  31          1HZ       LYS  31  -0.309   5.137  -8.220
  250   2HZ   LYS  31          2HZ       LYS  31  -0.120   4.752  -9.861
  251   3HZ   LYS  31          3HZ       LYS  31  -0.101   3.518  -8.693
  252    H    HIS  32           H        HIS  32   7.593   6.293  -8.114
  253    HA   HIS  32           HA       HIS  32   8.721   7.584  -6.470
  254   1HB   HIS  32          1HB       HIS  32   8.344   9.354  -8.898
  255   2HB   HIS  32          2HB       HIS  32   9.427   9.774  -7.570
  256    HD1  HIS  32           HD1      HIS  32  11.729   8.819  -7.682
  257    HD2  HIS  32           HD2      HIS  32   9.066   6.705 -10.092
  258    HE1  HIS  32           HE1      HIS  32  13.106   7.102  -8.935
  259    H    ILE  33           H        ILE  33   6.649   7.617  -5.101
  260    HA   ILE  33           HA       ILE  33   5.491  10.382  -4.993
  261    HB   ILE  33           HB       ILE  33   4.437   7.624  -4.349
  262   1HG1  ILE  33          1HG1      ILE  33   4.305   8.591  -6.681
  263   2HG1  ILE  33          2HG1      ILE  33   2.736   8.215  -5.967
  264   1HG2  ILE  33          1HG2      ILE  33   3.881   9.225  -2.499
  265   2HG2  ILE  33          2HG2      ILE  33   3.108  10.269  -3.692
  266   3HG2  ILE  33          3HG2      ILE  33   2.462   8.658  -3.380
  267   1HD1  ILE  33          1HD1      ILE  33   3.495  10.885  -5.214
  268   2HD1  ILE  33          2HD1      ILE  33   3.627  10.719  -6.965
  269   3HD1  ILE  33          3HD1      ILE  33   2.099  10.365  -6.158
  270    H    GLY  34           H        GLY  34   6.746   7.673  -3.052
  271   1HA   GLY  34          1HA       GLY  34   8.274   8.924  -1.217
  272   2HA   GLY  34          2HA       GLY  34   6.670   9.321  -0.605
  273    H    GLY  35           H        GLY  35   8.700   6.557  -1.534
  274   1HA   GLY  35          1HA       GLY  35   7.502   5.049   0.726
  275   2HA   GLY  35          2HA       GLY  35   7.452   4.311  -0.875
  276    H    SER  36           H        SER  36   9.077   3.996   1.847
  277    HA   SER  36           HA       SER  36  11.795   3.831   0.609
  278   1HB   SER  36          1HB       SER  36  12.419   4.666   2.616
  279   2HB   SER  36          2HB       SER  36  10.724   4.723   3.089
  280    HG   SER  36           HG       SER  36  11.784   3.415   4.537
  281    H    TYR  37           H        TYR  37   9.891   1.966   3.012
  282    HA   TYR  37           HA       TYR  37  10.915  -0.546   1.722
  283   1HB   TYR  37          1HB       TYR  37  11.210   0.494   4.340
  284   2HB   TYR  37          2HB       TYR  37  10.068  -0.843   4.472
  285    HD1  TYR  37           HD1      TYR  37  10.789  -2.919   2.817
  286    HD2  TYR  37           HD2      TYR  37  13.440  -0.083   4.657
  287    HE1  TYR  37           HE1      TYR  37  12.657  -4.540   2.625
  288    HE2  TYR  37           HE2      TYR  37  15.308  -1.703   4.461
  289    HH   TYR  37           HH       TYR  37  15.752  -3.962   4.146
  290    H    GLY  38           H        GLY  38   9.260  -1.745   0.839
  291   1HA   GLY  38          1HA       GLY  38   6.576  -1.574   2.135
  292   2HA   GLY  38          2HA       GLY  38   6.722  -1.394   0.387
  293    H    TYR  39           H        TYR  39   5.484  -3.522   2.232
  294    HA   TYR  39           HA       TYR  39   6.289  -5.815   0.579
  295   1HB   TYR  39          1HB       TYR  39   6.911  -7.128   2.667
  296   2HB   TYR  39          2HB       TYR  39   8.049  -5.854   2.230
  297    HD1  TYR  39           HD1      TYR  39   4.898  -6.291   4.226
  298    HD2  TYR  39           HD2      TYR  39   8.742  -4.402   3.909
  299    HE1  TYR  39           HE1      TYR  39   4.558  -5.230   6.441
  300    HE2  TYR  39           HE2      TYR  39   8.403  -3.340   6.125
  301    HH   TYR  39           HH       TYR  39   5.465  -3.987   8.040
  302    H    CYS  40           H        CYS  40   5.173  -7.849   2.106
  303    HA   CYS  40           HA       CYS  40   2.312  -7.005   2.204
  304   1HB   CYS  40          1HB       CYS  40   2.751  -8.798   0.693
  305   2HB   CYS  40          2HB       CYS  40   3.795  -9.618   1.853
  306    H    TYR  41           H        TYR  41   1.179  -7.099   4.121
  307    HA   TYR  41           HA       TYR  41   2.348  -8.554   6.447
  308   1HB   TYR  41          1HB       TYR  41   2.795  -5.892   6.031
  309   2HB   TYR  41          2HB       TYR  41   1.302  -5.829   6.967
  310    HD1  TYR  41           HD1      TYR  41   4.292  -8.098   7.054
  311    HD2  TYR  41           HD2      TYR  41   1.770  -5.363   9.202
  312    HE1  TYR  41           HE1      TYR  41   5.580  -8.538   9.128
  313    HE2  TYR  41           HE2      TYR  41   3.057  -5.802  11.273
  314    HH   TYR  41           HH       TYR  41   4.516  -7.374  12.232
  315    H    GLY  42           H        GLY  42   0.699  -9.720   7.362
  316   1HA   GLY  42          1HA       GLY  42  -1.480 -10.420   7.885
  317   2HA   GLY  42          2HA       GLY  42  -1.816  -8.705   8.128
  318    H    PHE  43           H        PHE  43  -0.932 -10.473   5.157
  319    HA   PHE  43           HA       PHE  43  -2.026 -10.549   3.063
  320   1HB   PHE  43          1HB       PHE  43  -4.303 -10.420   5.059
  321   2HB   PHE  43          2HB       PHE  43  -4.557 -10.709   3.338
  322    HD1  PHE  43           HD1      PHE  43  -2.488 -11.963   6.205
  323    HD2  PHE  43           HD2      PHE  43  -4.515 -12.902   2.537
  324    HE1  PHE  43           HE1      PHE  43  -1.967 -14.365   6.533
  325    HE2  PHE  43           HE2      PHE  43  -3.995 -15.304   2.865
  326    HZ   PHE  43           HZ       PHE  43  -2.722 -16.036   4.863
  327    H    GLY  44           H        GLY  44  -1.053  -8.000   3.734
  328   1HA   GLY  44          1HA       GLY  44  -2.910  -6.311   2.210
  329   2HA   GLY  44          2HA       GLY  44  -2.623  -5.778   3.865
  330    H    CYS  45           H        CYS  45  -1.859  -4.298   1.512
  331    HA   CYS  45           HA       CYS  45   1.081  -4.631   1.294
  332   1HB   CYS  45          1HB       CYS  45  -1.131  -3.448  -0.215
  333   2HB   CYS  45          2HB       CYS  45   0.273  -2.383  -0.139
  334    H    TYR  46           H        TYR  46   2.155  -3.767   3.038
  335    HA   TYR  46           HA       TYR  46   1.224  -1.144   4.138
  336   1HB   TYR  46          1HB       TYR  46   1.564  -3.444   5.409
  337   2HB   TYR  46          2HB       TYR  46   3.256  -2.951   5.405
  338    HD1  TYR  46           HD1      TYR  46  -0.175  -1.842   6.364
  339    HD2  TYR  46           HD2      TYR  46   4.051  -1.300   6.908
  340    HE1  TYR  46           HE1      TYR  46  -0.616  -0.318   8.271
  341    HE2  TYR  46           HE2      TYR  46   3.611   0.223   8.814
  342    HH   TYR  46           HH       TYR  46   0.958   0.364  10.479
  343    H    CYS  47           H        CYS  47   2.518   0.627   3.774
  344    HA   CYS  47           HA       CYS  47   5.319   0.146   2.807
  345   1HB   CYS  47          1HB       CYS  47   3.107   2.024   2.032
  346   2HB   CYS  47          2HB       CYS  47   4.778   2.525   1.778
  347    H    GLU  48           H        GLU  48   6.947   1.448   3.761
  348    HA   GLU  48           HA       GLU  48   6.047   3.113   6.090
  349   1HB   GLU  48          1HB       GLU  48   8.601   1.527   5.661
  350   2HB   GLU  48          2HB       GLU  48   8.162   2.397   7.131
  351   1HG   GLU  48          1HG       GLU  48   7.092   0.552   7.848
  352   2HG   GLU  48          2HG       GLU  48   5.955   0.742   6.513
  353    H    GLY  49           H        GLY  49   6.383   5.263   5.678
  354   1HA   GLY  49          1HA       GLY  49   8.271   6.932   5.442
  355   2HA   GLY  49          2HA       GLY  49   8.766   6.002   4.030
  356    H    LEU  50           H        LEU  50   5.442   6.842   4.922
  357    HA   LEU  50           HA       LEU  50   5.102   8.107   2.259
  358   1HB   LEU  50          1HB       LEU  50   3.169   7.354   4.474
  359   2HB   LEU  50          2HB       LEU  50   2.715   7.864   2.846
  360    HG   LEU  50           HG       LEU  50   4.239   5.910   2.052
  361   1HD1  LEU  50          1HD1      LEU  50   4.030   5.478   4.997
  362   2HD1  LEU  50          2HD1      LEU  50   3.889   4.059   3.960
  363   3HD1  LEU  50          3HD1      LEU  50   5.339   5.059   3.891
  364   1HD2  LEU  50          1HD2      LEU  50   1.728   6.030   1.954
  365   2HD2  LEU  50          2HD2      LEU  50   2.363   4.395   2.135
  366   3HD2  LEU  50          3HD2      LEU  50   1.686   5.238   3.530
  367    HA   PRO  51           HA       PRO  51   5.793  12.009   4.526
  368   1HB   PRO  51          1HB       PRO  51   5.217  13.308   2.008
  369   2HB   PRO  51          2HB       PRO  51   6.768  13.168   2.842
  370   1HG   PRO  51          1HG       PRO  51   5.910  11.790   0.473
  371   2HG   PRO  51          2HG       PRO  51   7.460  11.655   1.307
  372   1HD   PRO  51          1HD       PRO  51   5.374   9.691   1.187
  373   2HD   PRO  51          2HD       PRO  51   6.891   9.605   2.111
  374    H    ASP  52           H        ASP  52   4.370  13.991   4.751
  375    HA   ASP  52           HA       ASP  52   1.641  13.318   5.228
  376   1HB   ASP  52          1HB       ASP  52   3.103  15.160   6.217
  377   2HB   ASP  52          2HB       ASP  52   2.806  16.071   4.736
  378    H    SER  53           H        SER  53   3.226  14.056   2.283
  379    HA   SER  53           HA       SER  53   0.814  15.170   0.974
  380   1HB   SER  53          1HB       SER  53   2.493  15.075  -0.999
  381   2HB   SER  53          2HB       SER  53   2.862  16.171   0.328
  382    HG   SER  53           HG       SER  53   4.077  13.795  -0.445
  383    H    THR  54           H        THR  54   2.326  12.103   1.485
  384    HA   THR  54           HA       THR  54   1.211  10.819  -0.910
  385    HB   THR  54           HB       THR  54   2.388   9.616   1.614
  386    HG1  THR  54           HG1      THR  54   3.945  10.931   0.911
  387   1HG2  THR  54          1HG2      THR  54   1.221   8.102  -0.033
  388   2HG2  THR  54          2HG2      THR  54   2.402   8.609  -1.242
  389   3HG2  THR  54          3HG2      THR  54   2.931   7.738   0.198
  390    H    GLN  55           H        GLN  55  -0.681   9.597  -0.981
  391    HA   GLN  55           HA       GLN  55  -2.520   9.850   1.337
  392   1HB   GLN  55          1HB       GLN  55  -3.276  10.511  -0.889
  393   2HB   GLN  55          2HB       GLN  55  -2.837   8.931  -1.539
  394   1HG   GLN  55          1HG       GLN  55  -5.156   8.739  -1.171
  395   2HG   GLN  55          2HG       GLN  55  -4.456   7.986   0.263
  396   1HE2  GLN  55          2HE2      GLN  55  -5.947   8.565   1.891
  397   2HE2  GLN  55          1HE2      GLN  55  -6.390  10.165   2.244
  398    H    THR  56           H        THR  56  -3.376   8.027   2.406
  399    HA   THR  56           HA       THR  56  -2.361   5.341   1.559
  400    HB   THR  56           HB       THR  56  -0.858   6.042   3.273
  401    HG1  THR  56           HG1      THR  56  -2.018   4.877   5.199
  402   1HG2  THR  56          1HG2      THR  56  -3.344   7.125   4.606
  403   2HG2  THR  56          2HG2      THR  56  -1.813   6.947   5.464
  404   3HG2  THR  56          3HG2      THR  56  -1.924   8.022   4.070
  405    H    TRP  57           H        TRP  57  -3.487   3.686   3.226
  406    HA   TRP  57           HA       TRP  57  -6.406   4.142   2.951
  407   1HB   TRP  57          1HB       TRP  57  -4.895   2.056   2.328
  408   2HB   TRP  57          2HB       TRP  57  -5.081   1.671   4.038
  409    HD1  TRP  57           HD1      TRP  57  -7.210   2.324   0.896
  410    HE1  TRP  57           HE1      TRP  57  -9.479   1.133   1.197
  411    HE3  TRP  57           HE3      TRP  57  -6.680   0.611   5.678
  412    HZ2  TRP  57           HZ2      TRP  57 -10.881  -0.348   3.204
  413    HZ3  TRP  57           HZ3      TRP  57  -8.493  -0.685   6.760
  414    HH2  TRP  57           HH2      TRP  57 -10.591  -1.168   5.529
  415    HA   PRO  58           HA       PRO  58  -8.156   3.367   3.707
  416   1HB   PRO  58          1HB       PRO  58 -10.170   4.654   5.186
  417   2HB   PRO  58          2HB       PRO  58  -9.844   2.917   5.161
  418   1HG   PRO  58          1HG       PRO  58  -9.420   4.793   7.326
  419   2HG   PRO  58          2HG       PRO  58  -9.229   3.037   7.338
  420   1HD   PRO  58          1HD       PRO  58  -7.151   5.070   7.271
  421   2HD   PRO  58          2HD       PRO  58  -6.962   3.303   7.391
  422    H    LEU  59           H        LEU  59  -9.748   4.972   2.611
  423    HA   LEU  59           HA       LEU  59  -8.348   7.555   2.221
  424   1HB   LEU  59          1HB       LEU  59  -9.925   5.677   0.707
  425   2HB   LEU  59          2HB       LEU  59 -10.679   7.268   0.611
  426    HG   LEU  59           HG       LEU  59  -8.124   8.007   0.247
  427   1HD1  LEU  59          1HD1      LEU  59  -8.216   5.097  -0.195
  428   2HD1  LEU  59          2HD1      LEU  59  -7.523   6.005  -1.539
  429   3HD1  LEU  59          3HD1      LEU  59  -6.827   6.150   0.075
  430   1HD2  LEU  59          1HD2      LEU  59 -10.265   7.092  -1.634
  431   2HD2  LEU  59          2HD2      LEU  59  -9.591   8.706  -1.404
  432   3HD2  LEU  59          3HD2      LEU  59  -8.684   7.492  -2.306
  433    HA   PRO  60           HA       PRO  60 -11.172  10.279   4.215
  434   1HB   PRO  60          1HB       PRO  60 -12.464  11.311   1.823
  435   2HB   PRO  60          2HB       PRO  60 -11.303  12.112   2.885
  436   1HG   PRO  60          1HG       PRO  60 -10.831  11.107   0.260
  437   2HG   PRO  60          2HG       PRO  60  -9.651  11.810   1.368
  438   1HD   PRO  60          1HD       PRO  60  -9.875   9.058   0.552
  439   2HD   PRO  60          2HD       PRO  60  -8.709   9.760   1.700
  440    H    ASN  61           H        ASN  61 -13.766  11.050   3.740
  441    HA   ASN  61           HA       ASN  61 -15.372   8.898   4.525
  442   1HB   ASN  61          1HB       ASN  61 -15.826  11.433   4.406
  443   2HB   ASN  61          2HB       ASN  61 -16.306  11.150   2.731
  444   1HD2  ASN  61          2HD2      ASN  61 -17.912  11.835   5.307
  445   2HD2  ASN  61          1HD2      ASN  61 -19.162  10.687   5.308
  446    H    LYS  62           H        LYS  62 -14.317   9.826   1.312
  447    HA   LYS  62           HA       LYS  62 -16.133   7.933  -0.042
  448   1HB   LYS  62          1HB       LYS  62 -15.174   8.883  -2.029
  449   2HB   LYS  62          2HB       LYS  62 -15.326  10.214  -0.882
  450   1HG   LYS  62          1HG       LYS  62 -12.845   9.197  -0.256
  451   2HG   LYS  62          2HG       LYS  62 -12.903   8.982  -2.006
  452   1HD   LYS  62          1HD       LYS  62 -13.647  11.590  -0.666
  453   2HD   LYS  62          2HD       LYS  62 -12.004  11.231  -1.196
  454   1HE   LYS  62          1HE       LYS  62 -12.530  11.484  -3.411
  455   2HE   LYS  62          2HE       LYS  62 -14.125  10.730  -3.215
  456   1HZ   LYS  62          1HZ       LYS  62 -13.777  13.200  -1.757
  457   2HZ   LYS  62          2HZ       LYS  62 -13.724  13.385  -3.445
  458   3HZ   LYS  62          3HZ       LYS  62 -15.082  12.681  -2.713
  459    H    THR  63           H        THR  63 -14.744   6.448   1.751
  460    HA   THR  63           HA       THR  63 -12.244   5.412   0.616
  461    HB   THR  63           HB       THR  63 -12.535   5.564   3.013
  462    HG1  THR  63           HG1      THR  63 -11.428   3.794   2.936
  463   1HG2  THR  63          1HG2      THR  63 -15.196   4.741   2.378
  464   2HG2  THR  63          2HG2      THR  63 -14.520   3.580   3.520
  465   3HG2  THR  63          3HG2      THR  63 -14.567   5.294   3.930
  466    H    CYS  64           H        CYS  64 -12.315   2.763   0.831
  467    HA   CYS  64           HA       CYS  64 -14.299   1.925  -1.235
  468   1HB   CYS  64          1HB       CYS  64 -11.865   1.677  -1.633
  469   2HB   CYS  64          2HB       CYS  64 -11.737   0.670  -0.192
  Start of MODEL   36
    1   1H    LYS   1          1H        LYS   1   5.925   5.550   8.785
    2   2H    LYS   1          2H        LYS   1   5.529   7.191   8.624
    3   3H    LYS   1          3H        LYS   1   6.035   6.582  10.128
    4    HA   LYS   1           HA       LYS   1   3.968   6.004  10.690
    5   1HB   LYS   1          1HB       LYS   1   3.897   8.001   8.717
    6   2HB   LYS   1          2HB       LYS   1   2.647   6.854   8.231
    7   1HG   LYS   1          1HG       LYS   1   1.851   6.924  10.668
    8   2HG   LYS   1          2HG       LYS   1   2.898   8.331  10.857
    9   1HD   LYS   1          1HD       LYS   1   0.555   8.964  10.293
   10   2HD   LYS   1          2HD       LYS   1   1.709   9.499   9.070
   11   1HE   LYS   1          1HE       LYS   1   1.007   7.896   7.513
   12   2HE   LYS   1          2HE       LYS   1   0.355   6.823   8.767
   13   1HZ   LYS   1          1HZ       LYS   1  -0.725   9.542   8.513
   14   2HZ   LYS   1          2HZ       LYS   1  -1.239   8.364   7.408
   15   3HZ   LYS   1          3HZ       LYS   1  -1.487   8.129   9.072
   16    H    ASP   2           H        ASP   2   3.839   3.757  10.700
   17    HA   ASP   2           HA       ASP   2   3.777   2.127   8.304
   18   1HB   ASP   2          1HB       ASP   2   2.802   1.458  11.096
   19   2HB   ASP   2          2HB       ASP   2   3.439   0.341   9.891
   20    H    GLY   3           H        GLY   3   2.005   1.810   6.986
   21   1HA   GLY   3          1HA       GLY   3  -0.675   1.596   8.129
   22   2HA   GLY   3          2HA       GLY   3  -0.449   3.046   7.154
   23    H    TYR   4           H        TYR   4  -2.203   1.886   5.914
   24    HA   TYR   4           HA       TYR   4  -1.052  -0.052   3.940
   25   1HB   TYR   4          1HB       TYR   4  -3.656   0.194   5.398
   26   2HB   TYR   4          2HB       TYR   4  -3.676  -0.509   3.782
   27    HD1  TYR   4           HD1      TYR   4  -2.099  -2.467   3.293
   28    HD2  TYR   4           HD2      TYR   4  -2.942  -1.070   7.265
   29    HE1  TYR   4           HE1      TYR   4  -1.302  -4.626   4.221
   30    HE2  TYR   4           HE2      TYR   4  -2.145  -3.226   8.195
   31    HH   TYR   4           HH       TYR   4  -1.970  -5.877   6.795
   32    H    LEU   5           H        LEU   5  -1.188   0.588   1.789
   33    HA   LEU   5           HA       LEU   5  -2.336   3.263   1.237
   34   1HB   LEU   5          1HB       LEU   5  -0.541   1.296  -0.183
   35   2HB   LEU   5          2HB       LEU   5  -1.214   2.684  -1.039
   36    HG   LEU   5           HG       LEU   5  -0.030   3.317   1.592
   37   1HD1  LEU   5          1HD1      LEU   5   1.646   2.317  -0.726
   38   2HD1  LEU   5          2HD1      LEU   5   2.292   3.269   0.609
   39   3HD1  LEU   5          3HD1      LEU   5   1.609   1.672   0.916
   40   1HD2  LEU   5          1HD2      LEU   5  -0.580   4.539  -0.979
   41   2HD2  LEU   5          2HD2      LEU   5  -0.211   5.317   0.560
   42   3HD2  LEU   5          3HD2      LEU   5   1.099   4.818  -0.512
   43    H    VAL   6           H        VAL   6  -3.841   3.587  -0.525
   44    HA   VAL   6           HA       VAL   6  -5.838   1.435  -0.778
   45    HB   VAL   6           HB       VAL   6  -7.176   3.216  -1.685
   46   1HG1  VAL   6          1HG1      VAL   6  -5.777   3.442   0.756
   47   2HG1  VAL   6          2HG1      VAL   6  -5.787   5.057   0.047
   48   3HG1  VAL   6          3HG1      VAL   6  -7.308   4.208   0.326
   49   1HG2  VAL   6          1HG2      VAL   6  -5.356   4.016  -3.258
   50   2HG2  VAL   6          2HG2      VAL   6  -6.247   5.314  -2.461
   51   3HG2  VAL   6          3HG2      VAL   6  -4.640   4.867  -1.888
   52    H    GLU   7           H        GLU   7  -6.814   1.841  -3.333
   53    HA   GLU   7           HA       GLU   7  -4.496   1.036  -5.064
   54   1HB   GLU   7          1HB       GLU   7  -5.875  -0.671  -5.996
   55   2HB   GLU   7          2HB       GLU   7  -6.130  -0.752  -4.256
   56   1HG   GLU   7          1HG       GLU   7  -8.267   0.180  -4.392
   57   2HG   GLU   7          2HG       GLU   7  -7.944   0.960  -5.938
   58    H    LYS   8           H        LYS   8  -5.820   0.849  -7.454
   59    HA   LYS   8           HA       LYS   8  -5.727   3.375  -8.608
   60   1HB   LYS   8          1HB       LYS   8  -6.376   0.742  -9.299
   61   2HB   LYS   8          2HB       LYS   8  -7.781   1.686  -9.788
   62   1HG   LYS   8          1HG       LYS   8  -4.931   2.417 -10.509
   63   2HG   LYS   8          2HG       LYS   8  -6.011   1.508 -11.567
   64   1HD   LYS   8          1HD       LYS   8  -7.669   3.466 -11.226
   65   2HD   LYS   8          2HD       LYS   8  -6.271   4.364 -10.630
   66   1HE   LYS   8          1HE       LYS   8  -5.744   2.926 -13.149
   67   2HE   LYS   8          2HE       LYS   8  -6.983   4.188 -13.290
   68   1HZ   LYS   8          1HZ       LYS   8  -4.822   5.004 -11.612
   69   2HZ   LYS   8          2HZ       LYS   8  -4.268   4.590 -13.160
   70   3HZ   LYS   8          3HZ       LYS   8  -5.472   5.775 -12.978
   71    H    THR   9           H        THR   9  -8.766   1.731  -7.584
   72    HA   THR   9           HA       THR   9 -10.250   4.249  -7.989
   73    HB   THR   9           HB       THR   9 -12.172   2.790  -7.650
   74    HG1  THR   9           HG1      THR   9 -11.661   1.438  -6.072
   75   1HG2  THR   9          1HG2      THR   9  -9.910   1.787  -9.351
   76   2HG2  THR   9          2HG2      THR   9 -11.428   0.893  -9.291
   77   3HG2  THR   9          3HG2      THR   9 -11.412   2.565  -9.849
   78    H    GLY  10           H        GLY  10  -8.528   2.881  -5.421
   79   1HA   GLY  10          1HA       GLY  10  -8.450   4.310  -3.369
   80   2HA   GLY  10          2HA       GLY  10 -10.207   4.416  -3.476
   81    H    CYS  11           H        CYS  11  -9.919   1.379  -4.341
   82    HA   CYS  11           HA       CYS  11 -10.549   0.333  -1.705
   83   1HB   CYS  11          1HB       CYS  11  -9.880  -1.121  -4.285
   84   2HB   CYS  11          2HB       CYS  11 -10.819  -1.753  -2.933
   85    H    LYS  12           H        LYS  12  -9.281  -1.979  -1.335
   86    HA   LYS  12           HA       LYS  12  -6.556  -1.199  -0.609
   87   1HB   LYS  12          1HB       LYS  12  -7.821  -3.945  -0.471
   88   2HB   LYS  12          2HB       LYS  12  -6.626  -3.241   0.617
   89   1HG   LYS  12          1HG       LYS  12  -8.574  -1.429   0.950
   90   2HG   LYS  12          2HG       LYS  12  -9.575  -2.813   0.512
   91   1HD   LYS  12          1HD       LYS  12  -7.418  -3.026   2.612
   92   2HD   LYS  12          2HD       LYS  12  -9.052  -2.497   3.014
   93   1HE   LYS  12          1HE       LYS  12  -9.539  -4.742   1.479
   94   2HE   LYS  12          2HE       LYS  12  -8.079  -5.200   2.379
   95   1HZ   LYS  12          1HZ       LYS  12 -10.370  -3.846   3.678
   96   2HZ   LYS  12          2HZ       LYS  12 -10.278  -5.539   3.567
   97   3HZ   LYS  12          3HZ       LYS  12  -9.086  -4.679   4.416
   98    H    LYS  13           H        LYS  13  -4.952  -3.291  -1.024
   99    HA   LYS  13           HA       LYS  13  -5.137  -4.101  -3.894
  100   1HB   LYS  13          1HB       LYS  13  -3.310  -2.193  -2.626
  101   2HB   LYS  13          2HB       LYS  13  -2.453  -3.482  -3.470
  102   1HG   LYS  13          1HG       LYS  13  -4.652  -2.653  -5.105
  103   2HG   LYS  13          2HG       LYS  13  -3.761  -1.214  -4.604
  104   1HD   LYS  13          1HD       LYS  13  -1.679  -2.147  -5.434
  105   2HD   LYS  13          2HD       LYS  13  -2.467  -3.683  -5.796
  106   1HE   LYS  13          1HE       LYS  13  -4.077  -2.111  -7.240
  107   2HE   LYS  13          2HE       LYS  13  -2.627  -1.087  -7.271
  108   1HZ   LYS  13          1HZ       LYS  13  -1.384  -3.223  -7.782
  109   2HZ   LYS  13          2HZ       LYS  13  -2.896  -3.905  -8.138
  110   3HZ   LYS  13          3HZ       LYS  13  -2.332  -2.577  -9.036
  111    H    THR  14           H        THR  14  -5.738  -6.030  -2.319
  112    HA   THR  14           HA       THR  14  -3.874  -7.378  -0.709
  113    HB   THR  14           HB       THR  14  -6.110  -8.273  -2.532
  114    HG1  THR  14           HG1      THR  14  -5.797  -7.444   0.075
  115   1HG2  THR  14          1HG2      THR  14  -4.529 -10.146  -2.284
  116   2HG2  THR  14          2HG2      THR  14  -4.568  -9.948  -0.531
  117   3HG2  THR  14          3HG2      THR  14  -6.020 -10.457  -1.392
  118    H    CYS  15           H        CYS  15  -2.426  -9.132  -1.145
  119    HA   CYS  15           HA       CYS  15  -1.399  -9.224  -3.963
  120   1HB   CYS  15          1HB       CYS  15   0.777  -9.463  -3.001
  121   2HB   CYS  15          2HB       CYS  15  -0.013  -8.201  -2.058
  122    H    TYR  16           H        TYR  16   0.233 -11.457  -3.638
  123    HA   TYR  16           HA       TYR  16  -1.701 -13.637  -2.915
  124   1HB   TYR  16          1HB       TYR  16   0.240 -13.770  -5.226
  125   2HB   TYR  16          2HB       TYR  16  -1.231 -14.709  -4.975
  126    HD1  TYR  16           HD1      TYR  16  -3.465 -13.639  -5.247
  127    HD2  TYR  16           HD2      TYR  16   0.179 -11.581  -6.211
  128    HE1  TYR  16           HE1      TYR  16  -4.756 -11.957  -6.533
  129    HE2  TYR  16           HE2      TYR  16  -1.109  -9.899  -7.498
  130    HH   TYR  16           HH       TYR  16  -3.668  -9.045  -7.355
  131    H    LYS  17           H        LYS  17   1.142 -12.257  -2.092
  132    HA   LYS  17           HA       LYS  17   2.235 -14.823  -1.051
  133   1HB   LYS  17          1HB       LYS  17   3.236 -14.199  -3.303
  134   2HB   LYS  17          2HB       LYS  17   3.891 -12.757  -2.528
  135   1HG   LYS  17          1HG       LYS  17   5.674 -14.221  -2.274
  136   2HG   LYS  17          2HG       LYS  17   4.803 -14.505  -0.766
  137   1HD   LYS  17          1HD       LYS  17   3.583 -16.387  -1.925
  138   2HD   LYS  17          2HD       LYS  17   4.681 -16.173  -3.290
  139   1HE   LYS  17          1HE       LYS  17   6.198 -16.301  -0.827
  140   2HE   LYS  17          2HE       LYS  17   5.156 -17.731  -0.986
  141   1HZ   LYS  17          1HZ       LYS  17   5.904 -17.679  -3.425
  142   2HZ   LYS  17          2HZ       LYS  17   7.186 -16.708  -2.872
  143   3HZ   LYS  17          3HZ       LYS  17   6.994 -18.282  -2.269
  144    H    LEU  18           H        LEU  18   1.824 -14.169   1.102
  145    HA   LEU  18           HA       LEU  18   2.214 -11.568   2.185
  146   1HB   LEU  18          1HB       LEU  18   2.286 -14.371   3.327
  147   2HB   LEU  18          2HB       LEU  18   2.381 -12.936   4.347
  148    HG   LEU  18           HG       LEU  18   0.166 -13.347   2.332
  149   1HD1  LEU  18          1HD1      LEU  18   0.145 -15.198   3.974
  150   2HD1  LEU  18          2HD1      LEU  18   0.178 -14.024   5.290
  151   3HD1  LEU  18          3HD1      LEU  18  -1.222 -14.109   4.219
  152   1HD2  LEU  18          1HD2      LEU  18   0.867 -11.376   4.452
  153   2HD2  LEU  18          2HD2      LEU  18   0.024 -11.130   2.924
  154   3HD2  LEU  18          3HD2      LEU  18  -0.837 -11.805   4.306
  155    H    GLY  19           H        GLY  19   4.047 -10.517   2.911
  156   1HA   GLY  19          1HA       GLY  19   6.311 -10.802   4.007
  157   2HA   GLY  19          2HA       GLY  19   6.621 -12.041   2.791
  158    H    GLU  20           H        GLU  20   8.524 -10.486   2.437
  159    HA   GLU  20           HA       GLU  20   8.262  -7.895   1.333
  160   1HB   GLU  20          1HB       GLU  20  10.479  -8.560   0.243
  161   2HB   GLU  20          2HB       GLU  20  10.391  -8.784   1.990
  162   1HG   GLU  20          1HG       GLU  20  10.304 -11.087   1.835
  163   2HG   GLU  20          2HG       GLU  20   9.538 -11.057   0.246
  164    H    ASN  21           H        ASN  21   6.289  -8.116  -0.036
  165    HA   ASN  21           HA       ASN  21   6.502  -9.751  -2.482
  166   1HB   ASN  21          1HB       ASN  21   4.435  -9.352  -1.031
  167   2HB   ASN  21          2HB       ASN  21   4.406  -7.714  -1.686
  168   1HD2  ASN  21          2HD2      ASN  21   3.029 -10.686  -2.159
  169   2HD2  ASN  21          1HD2      ASN  21   2.721 -10.599  -3.827
  170    H    ASP  22           H        ASP  22   8.319  -8.674  -3.533
  171    HA   ASP  22           HA       ASP  22   8.823  -6.003  -3.984
  172   1HB   ASP  22          1HB       ASP  22   9.167  -8.543  -5.437
  173   2HB   ASP  22          2HB       ASP  22   9.221  -7.118  -6.475
  174    H    PHE  23           H        PHE  23   6.614  -7.982  -6.003
  175    HA   PHE  23           HA       PHE  23   5.654  -6.093  -7.785
  176   1HB   PHE  23          1HB       PHE  23   5.006  -8.624  -7.018
  177   2HB   PHE  23          2HB       PHE  23   3.601  -7.744  -6.416
  178    HD1  PHE  23           HD1      PHE  23   2.213  -6.379  -7.973
  179    HD2  PHE  23           HD2      PHE  23   5.394  -8.901  -9.374
  180    HE1  PHE  23           HE1      PHE  23   1.301  -6.251 -10.274
  181    HE2  PHE  23           HE2      PHE  23   4.480  -8.776 -11.677
  182    HZ   PHE  23           HZ       PHE  23   2.434  -7.450 -12.126
  183    H    CYS  24           H        CYS  24   4.346  -6.646  -4.486
  184    HA   CYS  24           HA       CYS  24   2.613  -4.308  -4.582
  185   1HB   CYS  24          1HB       CYS  24   2.843  -6.607  -3.091
  186   2HB   CYS  24          2HB       CYS  24   3.475  -5.402  -1.971
  187    H    ASN  25           H        ASN  25   5.883  -5.002  -3.430
  188    HA   ASN  25           HA       ASN  25   6.381  -2.701  -1.850
  189   1HB   ASN  25          1HB       ASN  25   7.741  -4.900  -2.628
  190   2HB   ASN  25          2HB       ASN  25   8.482  -3.719  -3.708
  191   1HD2  ASN  25          2HD2      ASN  25   9.491  -5.131  -1.136
  192   2HD2  ASN  25          1HD2      ASN  25  10.068  -3.852  -0.179
  193    H    ARG  26           H        ARG  26   7.294  -3.175  -5.280
  194    HA   ARG  26           HA       ARG  26   8.014  -0.527  -5.904
  195   1HB   ARG  26          1HB       ARG  26   7.066  -2.969  -7.296
  196   2HB   ARG  26          2HB       ARG  26   6.867  -1.473  -8.204
  197   1HG   ARG  26          1HG       ARG  26   9.263  -0.950  -7.845
  198   2HG   ARG  26          2HG       ARG  26   9.458  -2.479  -6.986
  199   1HD   ARG  26          1HD       ARG  26   8.218  -3.249  -9.347
  200   2HD   ARG  26          2HD       ARG  26   9.332  -1.978  -9.877
  201    HE   ARG  26           HE       ARG  26  10.081  -4.608  -9.012
  202   1HH1  ARG  26          1HH1      ARG  26  10.958  -1.295  -8.535
  203   2HH1  ARG  26          2HH1      ARG  26  12.511  -1.678  -7.878
  204   1HH2  ARG  26          1HH2      ARG  26  12.103  -5.103  -8.184
  205   2HH2  ARG  26          2HH2      ARG  26  13.163  -3.826  -7.687
  206    H    GLU  27           H        GLU  27   4.812  -2.094  -6.250
  207    HA   GLU  27           HA       GLU  27   3.324   0.049  -7.282
  208   1HB   GLU  27          1HB       GLU  27   2.884  -2.497  -6.426
  209   2HB   GLU  27          2HB       GLU  27   2.075  -1.589  -5.148
  210   1HG   GLU  27          1HG       GLU  27   0.333  -1.695  -6.647
  211   2HG   GLU  27          2HG       GLU  27   1.121  -0.242  -7.264
  212    H    CYS  28           H        CYS  28   4.351  -0.511  -3.928
  213    HA   CYS  28           HA       CYS  28   2.670   1.529  -2.756
  214   1HB   CYS  28          1HB       CYS  28   3.574  -0.304  -1.460
  215   2HB   CYS  28          2HB       CYS  28   5.225   0.146  -1.893
  216    H    LYS  29           H        LYS  29   6.234   1.530  -3.308
  217    HA   LYS  29           HA       LYS  29   6.049   4.526  -3.467
  218   1HB   LYS  29          1HB       LYS  29   8.367   4.447  -2.549
  219   2HB   LYS  29          2HB       LYS  29   7.194   3.684  -1.477
  220   1HG   LYS  29          1HG       LYS  29   7.818   1.473  -2.308
  221   2HG   LYS  29          2HG       LYS  29   8.934   2.200  -3.467
  222   1HD   LYS  29          1HD       LYS  29  10.413   2.917  -1.779
  223   2HD   LYS  29          2HD       LYS  29   9.191   2.759  -0.517
  224   1HE   LYS  29          1HE       LYS  29   9.578   0.206  -1.833
  225   2HE   LYS  29          2HE       LYS  29  11.124   0.829  -1.221
  226   1HZ   LYS  29          1HZ       LYS  29   9.685   1.493   0.815
  227   2HZ   LYS  29          2HZ       LYS  29   8.634   0.284   0.250
  228   3HZ   LYS  29          3HZ       LYS  29  10.230  -0.110   0.667
  229    H    TRP  30           H        TRP  30   5.627   3.252  -5.859
  230    HA   TRP  30           HA       TRP  30   8.111   2.726  -7.281
  231   1HB   TRP  30          1HB       TRP  30   6.473   2.826  -9.271
  232   2HB   TRP  30          2HB       TRP  30   6.233   1.569  -8.071
  233    HD1  TRP  30           HD1      TRP  30   3.715   1.573  -9.103
  234    HE1  TRP  30           HE1      TRP  30   1.641   2.918  -8.396
  235    HE3  TRP  30           HE3      TRP  30   5.935   5.390  -6.483
  236    HZ2  TRP  30           HZ2      TRP  30   0.996   5.272  -6.939
  237    HZ3  TRP  30           HZ3      TRP  30   4.553   7.159  -5.463
  238    HH2  TRP  30           HH2      TRP  30   2.088   7.107  -5.682
  239    H    LYS  31           H        LYS  31   8.399   5.260  -6.131
  240    HA   LYS  31           HA       LYS  31   9.080   6.865  -8.431
  241   1HB   LYS  31          1HB       LYS  31   6.427   7.131  -7.158
  242   2HB   LYS  31          2HB       LYS  31   7.285   8.655  -7.382
  243   1HG   LYS  31          1HG       LYS  31   7.695   7.265  -9.777
  244   2HG   LYS  31          2HG       LYS  31   6.005   6.965  -9.372
  245   1HD   LYS  31          1HD       LYS  31   5.587   9.356  -9.152
  246   2HD   LYS  31          2HD       LYS  31   7.295   9.708  -9.414
  247   1HE   LYS  31          1HE       LYS  31   6.531   8.099 -11.602
  248   2HE   LYS  31          2HE       LYS  31   5.225   9.284 -11.391
  249   1HZ   LYS  31          1HZ       LYS  31   7.122  10.936 -11.016
  250   2HZ   LYS  31          2HZ       LYS  31   8.114   9.775 -11.761
  251   3HZ   LYS  31          3HZ       LYS  31   6.808  10.446 -12.612
  252    H    HIS  32           H        HIS  32   7.754   8.145  -5.391
  253    HA   HIS  32           HA       HIS  32  10.391   8.378  -4.122
  254   1HB   HIS  32          1HB       HIS  32  10.397  10.095  -5.932
  255   2HB   HIS  32          2HB       HIS  32   8.964  10.825  -5.212
  256    HD1  HIS  32           HD1      HIS  32  10.488  12.998  -4.860
  257    HD2  HIS  32           HD2      HIS  32  11.597   9.662  -2.618
  258    HE1  HIS  32           HE1      HIS  32  12.047  13.838  -3.051
  259    H    ILE  33           H        ILE  33   9.057   7.334  -2.422
  260    HA   ILE  33           HA       ILE  33   7.167   9.237  -1.084
  261    HB   ILE  33           HB       ILE  33   7.000   6.484  -1.898
  262   1HG1  ILE  33          1HG1      ILE  33   4.808   7.462  -0.246
  263   2HG1  ILE  33          2HG1      ILE  33   5.341   8.674  -1.413
  264   1HG2  ILE  33          1HG2      ILE  33   6.936   6.945   1.089
  265   2HG2  ILE  33          2HG2      ILE  33   6.036   5.632   0.332
  266   3HG2  ILE  33          3HG2      ILE  33   7.793   5.688   0.198
  267   1HD1  ILE  33          1HD1      ILE  33   4.840   5.808  -2.217
  268   2HD1  ILE  33          2HD1      ILE  33   3.551   7.011  -2.212
  269   3HD1  ILE  33          3HD1      ILE  33   4.957   7.229  -3.256
  270    H    GLY  34           H        GLY  34   9.933   7.074  -0.642
  271   1HA   GLY  34          1HA       GLY  34  11.656   7.395   0.989
  272   2HA   GLY  34          2HA       GLY  34  10.595   8.506   1.852
  273    H    GLY  35           H        GLY  35  10.044   5.157   0.782
  274   1HA   GLY  35          1HA       GLY  35   9.070   4.523   3.506
  275   2HA   GLY  35          2HA       GLY  35   8.867   3.507   2.080
  276    H    SER  36           H        SER  36  10.147   3.130   4.891
  277    HA   SER  36           HA       SER  36  12.916   2.383   4.133
  278   1HB   SER  36          1HB       SER  36  12.559   1.624   6.727
  279   2HB   SER  36          2HB       SER  36  12.997   3.261   6.248
  280    HG   SER  36           HG       SER  36  11.198   3.744   7.231
  281    H    TYR  37           H        TYR  37   9.802   0.948   4.336
  282    HA   TYR  37           HA       TYR  37  10.882  -1.685   3.635
  283   1HB   TYR  37          1HB       TYR  37  10.429  -0.935   6.358
  284   2HB   TYR  37          2HB       TYR  37   9.202  -2.124   5.916
  285    HD1  TYR  37           HD1      TYR  37  10.801  -3.605   3.797
  286    HD2  TYR  37           HD2      TYR  37  11.824  -2.287   7.755
  287    HE1  TYR  37           HE1      TYR  37  12.485  -5.418   3.966
  288    HE2  TYR  37           HE2      TYR  37  13.507  -4.101   7.925
  289    HH   TYR  37           HH       TYR  37  13.793  -6.448   6.791
  290    H    GLY  38           H        GLY  38   9.421  -2.477   2.170
  291   1HA   GLY  38          1HA       GLY  38   6.532  -1.851   2.590
  292   2HA   GLY  38          2HA       GLY  38   7.268  -1.620   1.006
  293    H    TYR  39           H        TYR  39   5.670  -3.840   2.993
  294    HA   TYR  39           HA       TYR  39   6.199  -6.002   1.009
  295   1HB   TYR  39          1HB       TYR  39   6.345  -7.553   3.055
  296   2HB   TYR  39          2HB       TYR  39   7.725  -6.490   2.777
  297    HD1  TYR  39           HD1      TYR  39   4.711  -7.055   4.845
  298    HD2  TYR  39           HD2      TYR  39   8.219  -4.647   4.263
  299    HE1  TYR  39           HE1      TYR  39   4.401  -6.059   7.096
  300    HE2  TYR  39           HE2      TYR  39   7.911  -3.653   6.515
  301    HH   TYR  39           HH       TYR  39   5.237  -4.695   8.632
  302    H    CYS  40           H        CYS  40   4.524  -7.810   1.310
  303    HA   CYS  40           HA       CYS  40   1.870  -6.590   1.627
  304   1HB   CYS  40          1HB       CYS  40   2.535  -8.158  -0.209
  305   2HB   CYS  40          2HB       CYS  40   2.713  -9.436   0.995
  306    H    TYR  41           H        TYR  41   0.921  -6.511   3.612
  307    HA   TYR  41           HA       TYR  41   1.424  -8.773   5.519
  308   1HB   TYR  41          1HB       TYR  41   2.485  -6.598   6.129
  309   2HB   TYR  41          2HB       TYR  41   0.894  -5.837   6.087
  310    HD1  TYR  41           HD1      TYR  41   1.554  -9.282   7.298
  311    HD2  TYR  41           HD2      TYR  41   0.738  -5.211   8.406
  312    HE1  TYR  41           HE1      TYR  41   1.144 -10.001   9.638
  313    HE2  TYR  41           HE2      TYR  41   0.327  -5.930  10.743
  314    HH   TYR  41           HH       TYR  41   0.201  -9.324  11.633
  315    H    GLY  42           H        GLY  42  -0.440  -9.914   5.868
  316   1HA   GLY  42          1HA       GLY  42  -2.724 -10.351   6.234
  317   2HA   GLY  42          2HA       GLY  42  -2.961  -8.613   6.430
  318    H    PHE  43           H        PHE  43  -1.531 -10.140   3.596
  319    HA   PHE  43           HA       PHE  43  -2.225 -10.148   1.341
  320   1HB   PHE  43          1HB       PHE  43  -4.682 -10.472   3.017
  321   2HB   PHE  43          2HB       PHE  43  -4.900 -10.181   1.291
  322    HD1  PHE  43           HD1      PHE  43  -3.958 -11.756  -0.384
  323    HD2  PHE  43           HD2      PHE  43  -3.736 -12.538   3.836
  324    HE1  PHE  43           HE1      PHE  43  -3.416 -14.132  -0.849
  325    HE2  PHE  43           HE2      PHE  43  -3.193 -14.911   3.367
  326    HZ   PHE  43           HZ       PHE  43  -3.035 -15.708   1.025
  327    H    GLY  44           H        GLY  44  -1.370  -7.702   2.020
  328   1HA   GLY  44          1HA       GLY  44  -2.972  -5.922   0.392
  329   2HA   GLY  44          2HA       GLY  44  -3.077  -5.497   2.102
  330    H    CYS  45           H        CYS  45  -1.783  -4.007  -0.131
  331    HA   CYS  45           HA       CYS  45   1.087  -4.231   0.105
  332   1HB   CYS  45          1HB       CYS  45  -0.884  -2.782  -1.351
  333   2HB   CYS  45          2HB       CYS  45   0.202  -1.597  -0.626
  334    H    TYR  46           H        TYR  46   1.543  -4.200   2.397
  335    HA   TYR  46           HA       TYR  46   0.781  -1.784   3.944
  336   1HB   TYR  46          1HB       TYR  46   0.661  -4.167   4.799
  337   2HB   TYR  46          2HB       TYR  46   2.422  -4.216   4.721
  338    HD1  TYR  46           HD1      TYR  46  -0.218  -1.840   5.953
  339    HD2  TYR  46           HD2      TYR  46   3.522  -3.811   6.727
  340    HE1  TYR  46           HE1      TYR  46  -0.089  -0.729   8.167
  341    HE2  TYR  46           HE2      TYR  46   3.649  -2.698   8.940
  342    HH   TYR  46           HH       TYR  46   1.434  -0.166   9.853
  343    H    CYS  47           H        CYS  47   2.246  -0.099   4.290
  344    HA   CYS  47           HA       CYS  47   5.109  -0.646   3.537
  345   1HB   CYS  47          1HB       CYS  47   3.128   1.210   2.483
  346   2HB   CYS  47          2HB       CYS  47   4.585   2.049   3.021
  347    H    GLU  48           H        GLU  48   6.686   0.663   4.655
  348    HA   GLU  48           HA       GLU  48   5.688   1.797   7.250
  349   1HB   GLU  48          1HB       GLU  48   7.432  -0.336   6.638
  350   2HB   GLU  48          2HB       GLU  48   8.468   0.970   7.213
  351   1HG   GLU  48          1HG       GLU  48   6.966   1.214   9.202
  352   2HG   GLU  48          2HG       GLU  48   6.066  -0.198   8.647
  353    H    GLY  49           H        GLY  49   6.005   4.000   7.343
  354   1HA   GLY  49          1HA       GLY  49   7.684   5.820   7.439
  355   2HA   GLY  49          2HA       GLY  49   8.446   5.106   6.021
  356    H    LEU  50           H        LEU  50   5.078   6.006   6.787
  357    HA   LEU  50           HA       LEU  50   4.896   7.301   4.105
  358   1HB   LEU  50          1HB       LEU  50   2.727   6.680   6.131
  359   2HB   LEU  50          2HB       LEU  50   2.515   7.018   4.414
  360    HG   LEU  50           HG       LEU  50   4.272   4.726   5.217
  361   1HD1  LEU  50          1HD1      LEU  50   1.597   4.957   6.103
  362   2HD1  LEU  50          2HD1      LEU  50   1.568   3.851   4.729
  363   3HD1  LEU  50          3HD1      LEU  50   2.607   3.511   6.112
  364   1HD2  LEU  50          1HD2      LEU  50   2.539   5.530   2.887
  365   2HD2  LEU  50          2HD2      LEU  50   4.245   5.081   2.895
  366   3HD2  LEU  50          3HD2      LEU  50   3.006   3.844   3.107
  367    HA   PRO  51           HA       PRO  51   5.553  11.079   6.588
  368   1HB   PRO  51          1HB       PRO  51   5.346  12.500   4.082
  369   2HB   PRO  51          2HB       PRO  51   6.784  12.225   5.071
  370   1HG   PRO  51          1HG       PRO  51   6.116  11.004   2.561
  371   2HG   PRO  51          2HG       PRO  51   7.548  10.727   3.557
  372   1HD   PRO  51          1HD       PRO  51   5.344   8.930   3.118
  373   2HD   PRO  51          2HD       PRO  51   6.759   8.680   4.170
  374    H    ASP  52           H        ASP  52   4.052  12.706   7.213
  375    HA   ASP  52           HA       ASP  52   1.303  12.262   7.066
  376   1HB   ASP  52          1HB       ASP  52   3.155  14.398   7.789
  377   2HB   ASP  52          2HB       ASP  52   1.627  15.040   7.188
  378    H    SER  53           H        SER  53   3.242  14.382   4.933
  379    HA   SER  53           HA       SER  53   1.330  15.562   3.336
  380   1HB   SER  53          1HB       SER  53   4.071  15.000   3.249
  381   2HB   SER  53          2HB       SER  53   3.445  14.355   1.734
  382    HG   SER  53           HG       SER  53   4.021  16.795   2.134
  383    H    THR  54           H        THR  54   2.123  12.138   3.445
  384    HA   THR  54           HA       THR  54   0.445  11.605   1.042
  385    HB   THR  54           HB       THR  54   1.683   9.385   2.549
  386    HG1  THR  54           HG1      THR  54   3.689  10.065   2.409
  387   1HG2  THR  54          1HG2      THR  54   0.683   9.570   0.114
  388   2HG2  THR  54          2HG2      THR  54   2.290  10.181  -0.278
  389   3HG2  THR  54          3HG2      THR  54   2.104   8.569   0.413
  390    H    GLN  55           H        GLN  55  -1.423  10.294   1.167
  391    HA   GLN  55           HA       GLN  55  -2.648  10.075   3.880
  392   1HB   GLN  55          1HB       GLN  55  -3.503  10.568   1.115
  393   2HB   GLN  55          2HB       GLN  55  -4.524   9.392   1.944
  394   1HG   GLN  55          1HG       GLN  55  -3.776  12.090   3.103
  395   2HG   GLN  55          2HG       GLN  55  -5.281  11.772   2.237
  396   1HE2  GLN  55          2HE2      GLN  55  -6.796  10.187   3.232
  397   2HE2  GLN  55          1HE2      GLN  55  -6.723   9.879   4.899
  398    H    THR  56           H        THR  56  -3.711   8.018   4.450
  399    HA   THR  56           HA       THR  56  -2.728   5.658   2.881
  400    HB   THR  56           HB       THR  56  -2.829   5.008   5.647
  401    HG1  THR  56           HG1      THR  56  -2.688   7.162   6.165
  402   1HG2  THR  56          1HG2      THR  56  -0.951   5.064   3.419
  403   2HG2  THR  56          2HG2      THR  56  -0.158   5.386   4.960
  404   3HG2  THR  56          3HG2      THR  56  -1.086   3.903   4.739
  405    H    TRP  57           H        TRP  57  -4.117   3.807   2.992
  406    HA   TRP  57           HA       TRP  57  -6.885   4.176   2.971
  407   1HB   TRP  57          1HB       TRP  57  -5.303   2.207   2.310
  408   2HB   TRP  57          2HB       TRP  57  -5.541   1.665   3.964
  409    HD1  TRP  57           HD1      TRP  57  -7.301   1.980   0.638
  410    HE1  TRP  57           HE1      TRP  57  -9.596   0.813   0.774
  411    HE3  TRP  57           HE3      TRP  57  -7.523   1.052   5.654
  412    HZ2  TRP  57           HZ2      TRP  57 -11.303  -0.357   2.753
  413    HZ3  TRP  57           HZ3      TRP  57  -9.491  -0.085   6.637
  414    HH2  TRP  57           HH2      TRP  57 -11.379  -0.791   5.194
  415    HA   PRO  58           HA       PRO  58  -8.752   3.309   3.416
  416   1HB   PRO  58          1HB       PRO  58 -10.858   4.742   4.643
  417   2HB   PRO  58          2HB       PRO  58 -10.694   2.985   4.547
  418   1HG   PRO  58          1HG       PRO  58 -10.430   4.696   6.870
  419   2HG   PRO  58          2HG       PRO  58 -10.416   2.931   6.795
  420   1HD   PRO  58          1HD       PRO  58  -8.175   4.706   7.220
  421   2HD   PRO  58          2HD       PRO  58  -8.164   2.926   7.157
  422    H    LEU  59           H        LEU  59 -10.225   5.128   2.302
  423    HA   LEU  59           HA       LEU  59  -8.548   7.591   2.160
  424   1HB   LEU  59          1HB       LEU  59 -10.389   6.058   0.363
  425   2HB   LEU  59          2HB       LEU  59 -10.186   7.783   0.066
  426    HG   LEU  59           HG       LEU  59  -7.772   6.037   0.467
  427   1HD1  LEU  59          1HD1      LEU  59  -9.624   6.115  -1.866
  428   2HD1  LEU  59          2HD1      LEU  59  -7.898   6.161  -2.219
  429   3HD1  LEU  59          3HD1      LEU  59  -8.575   4.811  -1.308
  430   1HD2  LEU  59          1HD2      LEU  59  -8.423   8.668  -0.866
  431   2HD2  LEU  59          2HD2      LEU  59  -7.251   8.349   0.413
  432   3HD2  LEU  59          3HD2      LEU  59  -6.932   7.804  -1.233
  433    HA   PRO  60           HA       PRO  60 -11.548  10.302   3.892
  434   1HB   PRO  60          1HB       PRO  60 -11.720  12.029   1.592
  435   2HB   PRO  60          2HB       PRO  60 -10.824  12.291   3.091
  436   1HG   PRO  60          1HG       PRO  60  -9.759  11.678   0.505
  437   2HG   PRO  60          2HG       PRO  60  -8.873  11.902   2.015
  438   1HD   PRO  60          1HD       PRO  60  -9.316   9.444   0.575
  439   2HD   PRO  60          2HD       PRO  60  -8.436   9.667   2.107
  440    H    ASN  61           H        ASN  61 -13.539  11.782   2.571
  441    HA   ASN  61           HA       ASN  61 -15.748  10.114   2.385
  442   1HB   ASN  61          1HB       ASN  61 -16.320  12.343   2.290
  443   2HB   ASN  61          2HB       ASN  61 -14.918  12.763   1.311
  444   1HD2  ASN  61          2HD2      ASN  61 -15.989  13.872  -0.396
  445   2HD2  ASN  61          1HD2      ASN  61 -17.133  13.136  -1.414
  446    H    LYS  62           H        LYS  62 -13.197  10.586   0.059
  447    HA   LYS  62           HA       LYS  62 -14.616   9.161  -2.103
  448   1HB   LYS  62          1HB       LYS  62 -13.121  11.120  -2.465
  449   2HB   LYS  62          2HB       LYS  62 -11.770  10.184  -1.826
  450   1HG   LYS  62          1HG       LYS  62 -12.589   8.443  -3.681
  451   2HG   LYS  62          2HG       LYS  62 -13.193   9.918  -4.435
  452   1HD   LYS  62          1HD       LYS  62 -11.083  10.088  -5.267
  453   2HD   LYS  62          2HD       LYS  62 -10.693  10.709  -3.664
  454   1HE   LYS  62          1HE       LYS  62 -10.527   8.039  -3.174
  455   2HE   LYS  62          2HE       LYS  62 -10.019   8.085  -4.874
  456   1HZ   LYS  62          1HZ       LYS  62  -8.499   9.893  -4.324
  457   2HZ   LYS  62          2HZ       LYS  62  -8.955   9.797  -2.689
  458   3HZ   LYS  62          3HZ       LYS  62  -8.135   8.503  -3.424
  459    H    THR  63           H        THR  63 -14.667   7.304  -0.233
  460    HA   THR  63           HA       THR  63 -12.165   5.713  -0.203
  461    HB   THR  63           HB       THR  63 -13.596   6.114   1.813
  462    HG1  THR  63           HG1      THR  63 -12.279   4.247   1.617
  463   1HG2  THR  63          1HG2      THR  63 -15.576   4.663   0.078
  464   2HG2  THR  63          2HG2      THR  63 -15.680   4.544   1.834
  465   3HG2  THR  63          3HG2      THR  63 -15.811   6.118   1.048
  466    H    CYS  64           H        CYS  64 -13.195   3.164  -0.112
  467    HA   CYS  64           HA       CYS  64 -13.840   2.688  -2.966
  468   1HB   CYS  64          1HB       CYS  64 -12.003   1.490  -1.868
  469   2HB   CYS  64          2HB       CYS  64 -13.105   0.893  -0.630
  Start of MODEL   37
    1   1H    LYS   1          1H        LYS   1   6.743   3.585  11.939
    2   2H    LYS   1          2H        LYS   1   6.604   4.999  12.869
    3   3H    LYS   1          3H        LYS   1   5.327   3.880  12.824
    4    HA   LYS   1           HA       LYS   1   4.652   5.619  11.398
    5   1HB   LYS   1          1HB       LYS   1   7.111   6.418  11.446
    6   2HB   LYS   1          2HB       LYS   1   7.342   5.379  10.040
    7   1HG   LYS   1          1HG       LYS   1   5.845   6.630   8.715
    8   2HG   LYS   1          2HG       LYS   1   5.098   7.391  10.121
    9   1HD   LYS   1          1HD       LYS   1   7.364   8.476  10.574
   10   2HD   LYS   1          2HD       LYS   1   7.846   7.922   8.971
   11   1HE   LYS   1          1HE       LYS   1   6.497   9.447   7.893
   12   2HE   LYS   1          2HE       LYS   1   5.246   9.377   9.150
   13   1HZ   LYS   1          1HZ       LYS   1   7.939  10.548   9.582
   14   2HZ   LYS   1          2HZ       LYS   1   6.584  11.471   9.151
   15   3HZ   LYS   1          3HZ       LYS   1   6.603  10.628  10.625
   16    H    ASP   2           H        ASP   2   3.282   3.831  10.743
   17    HA   ASP   2           HA       ASP   2   4.276   2.331   8.337
   18   1HB   ASP   2          1HB       ASP   2   2.230   1.575  10.448
   19   2HB   ASP   2          2HB       ASP   2   2.732   0.559   9.097
   20    H    GLY   3           H        GLY   3   2.325   1.644   6.910
   21   1HA   GLY   3          1HA       GLY   3  -0.069   3.285   7.040
   22   2HA   GLY   3          2HA       GLY   3   1.046   3.837   5.789
   23    H    TYR   4           H        TYR   4  -1.293   3.017   4.818
   24    HA   TYR   4           HA       TYR   4  -0.719   0.284   3.720
   25   1HB   TYR   4          1HB       TYR   4  -2.874   1.221   5.340
   26   2HB   TYR   4          2HB       TYR   4  -3.521   0.884   3.733
   27    HD1  TYR   4           HD1      TYR   4  -1.944  -1.319   2.741
   28    HD2  TYR   4           HD2      TYR   4  -3.360  -0.593   6.730
   29    HE1  TYR   4           HE1      TYR   4  -1.850  -3.751   3.217
   30    HE2  TYR   4           HE2      TYR   4  -3.268  -3.026   7.207
   31    HH   TYR   4           HH       TYR   4  -2.405  -5.010   6.456
   32    H    LEU   5           H        LEU   5  -0.156   0.682   1.601
   33    HA   LEU   5           HA       LEU   5  -0.981   2.985   0.095
   34   1HB   LEU   5          1HB       LEU   5   0.024   0.247  -0.755
   35   2HB   LEU   5          2HB       LEU   5  -0.015   1.675  -1.791
   36    HG   LEU   5           HG       LEU   5   1.301   2.060   0.831
   37   1HD1  LEU   5          1HD1      LEU   5   1.992  -0.260   0.124
   38   2HD1  LEU   5          2HD1      LEU   5   2.659   0.452  -1.345
   39   3HD1  LEU   5          3HD1      LEU   5   3.325   0.891   0.229
   40   1HD2  LEU   5          1HD2      LEU   5   1.166   3.325  -1.675
   41   2HD2  LEU   5          2HD2      LEU   5   2.216   3.770  -0.330
   42   3HD2  LEU   5          3HD2      LEU   5   2.804   2.677  -1.582
   43    H    VAL   6           H        VAL   6  -2.718   3.252  -1.293
   44    HA   VAL   6           HA       VAL   6  -4.882   1.214  -1.136
   45    HB   VAL   6           HB       VAL   6  -6.275   3.068  -1.902
   46   1HG1  VAL   6          1HG1      VAL   6  -4.613   3.147   0.426
   47   2HG1  VAL   6          2HG1      VAL   6  -4.812   4.797  -0.166
   48   3HG1  VAL   6          3HG1      VAL   6  -6.230   3.821   0.216
   49   1HG2  VAL   6          1HG2      VAL   6  -3.780   3.954  -3.024
   50   2HG2  VAL   6          2HG2      VAL   6  -5.398   4.592  -3.312
   51   3HG2  VAL   6          3HG2      VAL   6  -4.424   5.226  -1.986
   52    H    GLU   7           H        GLU   7  -6.238   1.603  -3.458
   53    HA   GLU   7           HA       GLU   7  -4.432   0.380  -5.463
   54   1HB   GLU   7          1HB       GLU   7  -7.080   0.043  -4.620
   55   2HB   GLU   7          2HB       GLU   7  -7.220   0.789  -6.213
   56   1HG   GLU   7          1HG       GLU   7  -5.214  -1.076  -6.592
   57   2HG   GLU   7          2HG       GLU   7  -6.315  -1.906  -5.491
   58    H    LYS   8           H        LYS   8  -4.746   1.154  -7.792
   59    HA   LYS   8           HA       LYS   8  -4.028   3.866  -8.109
   60   1HB   LYS   8          1HB       LYS   8  -4.723   1.551  -9.719
   61   2HB   LYS   8          2HB       LYS   8  -5.322   3.034 -10.466
   62   1HG   LYS   8          1HG       LYS   8  -2.802   3.774  -9.618
   63   2HG   LYS   8          2HG       LYS   8  -2.557   2.102 -10.124
   64   1HD   LYS   8          1HD       LYS   8  -2.228   3.333 -12.109
   65   2HD   LYS   8          2HD       LYS   8  -3.893   2.767 -12.244
   66   1HE   LYS   8          1HE       LYS   8  -3.932   5.110 -12.808
   67   2HE   LYS   8          2HE       LYS   8  -4.582   4.997 -11.162
   68   1HZ   LYS   8          1HZ       LYS   8  -1.851   5.069 -10.856
   69   2HZ   LYS   8          2HZ       LYS   8  -2.167   6.227 -12.054
   70   3HZ   LYS   8          3HZ       LYS   8  -2.935   6.340 -10.543
   71    H    THR   9           H        THR   9  -7.154   2.473  -7.551
   72    HA   THR   9           HA       THR   9  -8.517   4.981  -8.431
   73    HB   THR   9           HB       THR   9 -10.537   3.445  -8.178
   74    HG1  THR   9           HG1      THR   9  -9.527   1.144  -8.348
   75   1HG2  THR   9          1HG2      THR   9  -9.006   3.870 -10.282
   76   2HG2  THR   9          2HG2      THR   9  -8.549   2.186 -10.032
   77   3HG2  THR   9          3HG2      THR   9 -10.238   2.607 -10.327
   78    H    GLY  10           H        GLY  10  -7.582   3.151  -5.631
   79   1HA   GLY  10          1HA       GLY  10  -7.673   4.668  -3.552
   80   2HA   GLY  10          2HA       GLY  10  -9.389   4.817  -3.928
   81    H    CYS  11           H        CYS  11  -9.214   1.864  -4.855
   82    HA   CYS  11           HA       CYS  11 -10.256   0.683  -2.467
   83   1HB   CYS  11          1HB       CYS  11  -9.326  -0.206  -5.171
   84   2HB   CYS  11          2HB       CYS  11  -9.640  -1.441  -3.951
   85    H    LYS  12           H        LYS  12  -9.097  -1.653  -1.920
   86    HA   LYS  12           HA       LYS  12  -6.558  -0.896  -0.634
   87   1HB   LYS  12          1HB       LYS  12  -8.134  -3.491  -0.637
   88   2HB   LYS  12          2HB       LYS  12  -6.915  -3.004   0.538
   89   1HG   LYS  12          1HG       LYS  12  -8.312  -1.477   1.567
   90   2HG   LYS  12          2HG       LYS  12  -9.237  -1.176   0.096
   91   1HD   LYS  12          1HD       LYS  12  -9.364  -3.673   1.813
   92   2HD   LYS  12          2HD       LYS  12 -10.613  -2.434   1.677
   93   1HE   LYS  12          1HE       LYS  12 -10.440  -2.990  -0.914
   94   2HE   LYS  12          2HE       LYS  12  -9.815  -4.537  -0.308
   95   1HZ   LYS  12          1HZ       LYS  12 -11.746  -4.479   1.296
   96   2HZ   LYS  12          2HZ       LYS  12 -12.396  -3.235   0.339
   97   3HZ   LYS  12          3HZ       LYS  12 -12.144  -4.773  -0.328
   98    H    LYS  13           H        LYS  13  -5.078  -3.159  -0.616
   99    HA   LYS  13           HA       LYS  13  -4.662  -3.945  -3.473
  100   1HB   LYS  13          1HB       LYS  13  -2.774  -2.674  -1.492
  101   2HB   LYS  13          2HB       LYS  13  -2.151  -3.647  -2.825
  102   1HG   LYS  13          1HG       LYS  13  -3.734  -2.162  -4.297
  103   2HG   LYS  13          2HG       LYS  13  -3.665  -1.052  -2.927
  104   1HD   LYS  13          1HD       LYS  13  -1.892  -0.402  -4.399
  105   2HD   LYS  13          2HD       LYS  13  -1.128  -1.249  -3.053
  106   1HE   LYS  13          1HE       LYS  13  -0.129  -2.148  -5.048
  107   2HE   LYS  13          2HE       LYS  13  -1.296  -3.371  -4.510
  108   1HZ   LYS  13          1HZ       LYS  13  -2.360  -1.239  -6.172
  109   2HZ   LYS  13          2HZ       LYS  13  -1.317  -2.324  -6.960
  110   3HZ   LYS  13          3HZ       LYS  13  -2.713  -2.898  -6.181
  111    H    THR  14           H        THR  14  -5.831  -5.886  -2.337
  112    HA   THR  14           HA       THR  14  -4.393  -7.459  -0.397
  113    HB   THR  14           HB       THR  14  -6.870  -7.460  -1.843
  114    HG1  THR  14           HG1      THR  14  -6.815  -7.661   0.336
  115   1HG2  THR  14          1HG2      THR  14  -5.453 -10.144  -1.867
  116   2HG2  THR  14          2HG2      THR  14  -7.159  -9.889  -2.231
  117   3HG2  THR  14          3HG2      THR  14  -5.919  -9.212  -3.288
  118    H    CYS  15           H        CYS  15  -3.398  -9.602  -0.873
  119    HA   CYS  15           HA       CYS  15  -2.330  -9.896  -3.642
  120   1HB   CYS  15          1HB       CYS  15  -0.046 -10.118  -2.628
  121   2HB   CYS  15          2HB       CYS  15  -0.742  -8.513  -2.396
  122    H    TYR  16           H        TYR  16  -0.830 -12.026  -3.527
  123    HA   TYR  16           HA       TYR  16  -2.440 -14.103  -2.079
  124   1HB   TYR  16          1HB       TYR  16  -1.084 -13.871  -4.735
  125   2HB   TYR  16          2HB       TYR  16  -1.135 -15.467  -3.989
  126    HD1  TYR  16           HD1      TYR  16  -3.298 -16.559  -3.480
  127    HD2  TYR  16           HD2      TYR  16  -3.099 -12.795  -5.541
  128    HE1  TYR  16           HE1      TYR  16  -5.659 -16.825  -4.196
  129    HE2  TYR  16           HE2      TYR  16  -5.459 -13.062  -6.258
  130    HH   TYR  16           HH       TYR  16  -7.049 -15.075  -6.630
  131    H    LYS  17           H        LYS  17   0.799 -12.901  -2.781
  132    HA   LYS  17           HA       LYS  17   2.076 -15.084  -1.235
  133   1HB   LYS  17          1HB       LYS  17   2.734 -13.240  -3.340
  134   2HB   LYS  17          2HB       LYS  17   3.887 -13.032  -2.020
  135   1HG   LYS  17          1HG       LYS  17   4.215 -15.524  -2.001
  136   2HG   LYS  17          2HG       LYS  17   3.201 -15.619  -3.442
  137   1HD   LYS  17          1HD       LYS  17   5.608 -13.803  -3.332
  138   2HD   LYS  17          2HD       LYS  17   5.756 -15.496  -3.802
  139   1HE   LYS  17          1HE       LYS  17   3.535 -14.409  -5.239
  140   2HE   LYS  17          2HE       LYS  17   4.898 -13.290  -5.425
  141   1HZ   LYS  17          1HZ       LYS  17   5.638 -16.077  -5.527
  142   2HZ   LYS  17          2HZ       LYS  17   4.614 -15.605  -6.791
  143   3HZ   LYS  17          3HZ       LYS  17   6.089 -14.798  -6.548
  144    H    LEU  18           H        LEU  18   2.068 -14.811   0.972
  145    HA   LEU  18           HA       LEU  18   1.915 -12.146   2.192
  146   1HB   LEU  18          1HB       LEU  18   2.016 -15.016   3.114
  147   2HB   LEU  18          2HB       LEU  18   2.116 -13.689   4.274
  148    HG   LEU  18           HG       LEU  18  -0.112 -14.088   2.257
  149   1HD1  LEU  18          1HD1      LEU  18   0.311 -14.946   5.060
  150   2HD1  LEU  18          2HD1      LEU  18  -1.252 -14.199   4.728
  151   3HD1  LEU  18          3HD1      LEU  18  -0.745 -15.625   3.822
  152   1HD2  LEU  18          1HD2      LEU  18   0.799 -11.780   3.642
  153   2HD2  LEU  18          2HD2      LEU  18  -0.680 -11.954   2.697
  154   3HD2  LEU  18          3HD2      LEU  18  -0.694 -12.295   4.427
  155    H    GLY  19           H        GLY  19   3.657 -11.009   2.978
  156   1HA   GLY  19          1HA       GLY  19   5.833 -10.582   3.774
  157   2HA   GLY  19          2HA       GLY  19   6.116 -12.318   3.818
  158    H    GLU  20           H        GLU  20   8.032 -10.519   2.904
  159    HA   GLU  20           HA       GLU  20   9.321  -9.899   0.994
  160   1HB   GLU  20          1HB       GLU  20   9.066 -12.678   1.556
  161   2HB   GLU  20          2HB       GLU  20   9.153 -12.507  -0.197
  162   1HG   GLU  20          1HG       GLU  20  11.297 -11.711  -0.149
  163   2HG   GLU  20          2HG       GLU  20  11.047 -10.841   1.366
  164    H    ASN  21           H        ASN  21   6.393  -9.482   0.559
  165    HA   ASN  21           HA       ASN  21   5.813 -10.410  -2.157
  166   1HB   ASN  21          1HB       ASN  21   4.117 -10.027  -0.381
  167   2HB   ASN  21          2HB       ASN  21   4.518  -8.308  -0.391
  168   1HD2  ASN  21          2HD2      ASN  21   2.125 -10.212  -1.433
  169   2HD2  ASN  21          1HD2      ASN  21   1.738  -9.474  -2.912
  170    H    ASP  22           H        ASP  22   7.701  -9.505  -3.298
  171    HA   ASP  22           HA       ASP  22   8.530  -6.810  -3.307
  172   1HB   ASP  22          1HB       ASP  22   8.468  -9.037  -5.344
  173   2HB   ASP  22          2HB       ASP  22   9.165  -7.466  -5.746
  174    H    PHE  23           H        PHE  23   5.678  -8.272  -4.737
  175    HA   PHE  23           HA       PHE  23   4.972  -6.467  -6.754
  176   1HB   PHE  23          1HB       PHE  23   3.809  -8.531  -5.275
  177   2HB   PHE  23          2HB       PHE  23   2.749  -7.150  -4.985
  178    HD1  PHE  23           HD1      PHE  23   4.802  -7.837  -8.018
  179    HD2  PHE  23           HD2      PHE  23   0.857  -7.671  -6.327
  180    HE1  PHE  23           HE1      PHE  23   3.822  -8.109 -10.279
  181    HE2  PHE  23           HE2      PHE  23  -0.124  -7.944  -8.589
  182    HZ   PHE  23           HZ       PHE  23   1.360  -8.164 -10.565
  183    H    CYS  24           H        CYS  24   4.175  -6.154  -3.268
  184    HA   CYS  24           HA       CYS  24   3.003  -3.542  -3.502
  185   1HB   CYS  24          1HB       CYS  24   4.386  -4.857  -1.141
  186   2HB   CYS  24          2HB       CYS  24   3.152  -3.600  -1.069
  187    H    ASN  25           H        ASN  25   6.195  -4.469  -2.121
  188    HA   ASN  25           HA       ASN  25   7.325  -1.961  -1.761
  189   1HB   ASN  25          1HB       ASN  25   8.800  -3.573  -1.116
  190   2HB   ASN  25          2HB       ASN  25   8.207  -4.715  -2.315
  191   1HD2  ASN  25          2HD2      ASN  25   9.477  -5.014  -4.189
  192   2HD2  ASN  25          1HD2      ASN  25  10.854  -4.094  -4.559
  193    H    ARG  26           H        ARG  26   7.391  -3.835  -4.820
  194    HA   ARG  26           HA       ARG  26   8.754  -2.019  -6.466
  195   1HB   ARG  26          1HB       ARG  26   7.517  -4.402  -6.749
  196   2HB   ARG  26          2HB       ARG  26   6.319  -3.371  -7.532
  197   1HG   ARG  26          1HG       ARG  26   7.715  -2.837  -9.277
  198   2HG   ARG  26          2HG       ARG  26   9.166  -2.911  -8.277
  199   1HD   ARG  26          1HD       ARG  26   9.435  -5.184  -8.604
  200   2HD   ARG  26          2HD       ARG  26   7.692  -5.473  -8.749
  201    HE   ARG  26           HE       ARG  26   8.347  -3.849 -10.931
  202   1HH1  ARG  26          1HH1      ARG  26   9.312  -6.905  -9.641
  203   2HH1  ARG  26          2HH1      ARG  26   9.733  -7.568 -11.185
  204   1HH2  ARG  26          1HH2      ARG  26   8.891  -4.704 -12.948
  205   2HH2  ARG  26          2HH2      ARG  26   9.504  -6.321 -13.054
  206    H    GLU  27           H        GLU  27   5.230  -2.130  -5.803
  207    HA   GLU  27           HA       GLU  27   4.698   0.311  -7.306
  208   1HB   GLU  27          1HB       GLU  27   3.117  -1.602  -6.935
  209   2HB   GLU  27          2HB       GLU  27   3.046  -1.163  -5.228
  210   1HG   GLU  27          1HG       GLU  27   2.477   1.238  -6.248
  211   2HG   GLU  27          2HG       GLU  27   1.906   0.256  -7.598
  212    H    CYS  28           H        CYS  28   5.522  -0.476  -3.982
  213    HA   CYS  28           HA       CYS  28   4.593   1.945  -2.734
  214   1HB   CYS  28          1HB       CYS  28   5.379  -0.321  -1.750
  215   2HB   CYS  28          2HB       CYS  28   7.010   0.328  -1.915
  216    H    LYS  29           H        LYS  29   7.343   1.205  -4.732
  217    HA   LYS  29           HA       LYS  29   8.837   3.621  -3.905
  218   1HB   LYS  29          1HB       LYS  29  10.542   2.701  -5.337
  219   2HB   LYS  29          2HB       LYS  29   9.818   1.336  -4.485
  220   1HG   LYS  29          1HG       LYS  29   9.339   0.404  -6.477
  221   2HG   LYS  29          2HG       LYS  29   8.245   1.750  -6.803
  222   1HD   LYS  29          1HD       LYS  29   9.627   2.393  -8.460
  223   2HD   LYS  29          2HD       LYS  29  10.846   2.751  -7.236
  224   1HE   LYS  29          1HE       LYS  29  10.503  -0.102  -8.105
  225   2HE   LYS  29          2HE       LYS  29  11.399   1.014  -9.156
  226   1HZ   LYS  29          1HZ       LYS  29  11.882   0.755  -6.239
  227   2HZ   LYS  29          2HZ       LYS  29  12.788  -0.075  -7.412
  228   3HZ   LYS  29          3HZ       LYS  29  12.817   1.619  -7.364
  229    H    TRP  30           H        TRP  30   6.273   4.230  -4.976
  230    HA   TRP  30           HA       TRP  30   6.183   4.709  -7.774
  231   1HB   TRP  30          1HB       TRP  30   4.746   5.391  -5.357
  232   2HB   TRP  30          2HB       TRP  30   4.805   6.783  -6.441
  233    HD1  TRP  30           HD1      TRP  30   2.393   4.446  -5.773
  234    HE1  TRP  30           HE1      TRP  30   1.130   3.568  -7.844
  235    HE3  TRP  30           HE3      TRP  30   5.659   5.825  -9.447
  236    HZ2  TRP  30           HZ2      TRP  30   1.463   3.470 -10.687
  237    HZ3  TRP  30           HZ3      TRP  30   5.163   5.330 -11.822
  238    HH2  TRP  30           HH2      TRP  30   3.071   4.156 -12.447
  239    H    LYS  31           H        LYS  31   5.834   7.383  -8.231
  240    HA   LYS  31           HA       LYS  31   8.516   8.360  -8.510
  241   1HB   LYS  31          1HB       LYS  31   7.463  10.099  -9.677
  242   2HB   LYS  31          2HB       LYS  31   6.267   8.811  -9.791
  243   1HG   LYS  31          1HG       LYS  31   5.073   9.748  -7.839
  244   2HG   LYS  31          2HG       LYS  31   6.262  11.049  -7.744
  245   1HD   LYS  31          1HD       LYS  31   4.992  10.648 -10.397
  246   2HD   LYS  31          2HD       LYS  31   3.940  11.271  -9.126
  247   1HE   LYS  31          1HE       LYS  31   5.336  13.183  -8.767
  248   2HE   LYS  31          2HE       LYS  31   6.659  12.477  -9.717
  249   1HZ   LYS  31          1HZ       LYS  31   5.053  12.389 -11.616
  250   2HZ   LYS  31          2HZ       LYS  31   3.994  13.342 -10.697
  251   3HZ   LYS  31          3HZ       LYS  31   5.511  13.957 -11.151
  252    H    HIS  32           H        HIS  32   5.981   8.991  -6.096
  253    HA   HIS  32           HA       HIS  32   7.998  10.107  -4.274
  254   1HB   HIS  32          1HB       HIS  32   7.449  11.972  -5.810
  255   2HB   HIS  32          2HB       HIS  32   5.745  11.810  -5.384
  256    HD1  HIS  32           HD1      HIS  32   8.706  13.620  -4.428
  257    HD2  HIS  32           HD2      HIS  32   5.403  12.112  -2.380
  258    HE1  HIS  32           HE1      HIS  32   8.634  14.822  -2.200
  259    H    ILE  33           H        ILE  33   7.215   8.409  -2.866
  260    HA   ILE  33           HA       ILE  33   4.483   8.932  -1.734
  261    HB   ILE  33           HB       ILE  33   5.125   6.759  -3.139
  262   1HG1  ILE  33          1HG1      ILE  33   3.623   5.457  -1.400
  263   2HG1  ILE  33          2HG1      ILE  33   3.484   7.043  -0.643
  264   1HG2  ILE  33          1HG2      ILE  33   6.153   6.147  -0.354
  265   2HG2  ILE  33          2HG2      ILE  33   5.796   4.921  -1.567
  266   3HG2  ILE  33          3HG2      ILE  33   7.076   6.100  -1.857
  267   1HD1  ILE  33          1HD1      ILE  33   3.042   7.712  -3.239
  268   2HD1  ILE  33          2HD1      ILE  33   2.387   6.075  -3.223
  269   3HD1  ILE  33          3HD1      ILE  33   1.750   7.289  -2.114
  270    H    GLY  34           H        GLY  34   7.794   7.818  -1.102
  271   1HA   GLY  34          1HA       GLY  34   9.141   8.345   0.782
  272   2HA   GLY  34          2HA       GLY  34   7.737   9.086   1.546
  273    H    GLY  35           H        GLY  35   9.130   5.934   0.699
  274   1HA   GLY  35          1HA       GLY  35   8.018   4.860   3.232
  275   2HA   GLY  35          2HA       GLY  35   7.600   4.019   1.738
  276    H    SER  36           H        SER  36   9.309   3.198   4.106
  277    HA   SER  36           HA       SER  36  11.925   2.776   2.719
  278   1HB   SER  36          1HB       SER  36  12.217   1.873   5.281
  279   2HB   SER  36          2HB       SER  36  12.491   3.545   4.799
  280    HG   SER  36           HG       SER  36  10.742   2.668   6.522
  281    H    TYR  37           H        TYR  37   9.958   0.873   5.031
  282    HA   TYR  37           HA       TYR  37  10.735  -1.617   3.611
  283   1HB   TYR  37          1HB       TYR  37  10.276  -0.789   6.273
  284   2HB   TYR  37          2HB       TYR  37   8.969  -1.910   5.890
  285    HD1  TYR  37           HD1      TYR  37  12.639  -1.632   5.129
  286    HD2  TYR  37           HD2      TYR  37   9.398  -4.129   6.442
  287    HE1  TYR  37           HE1      TYR  37  14.206  -3.537   5.374
  288    HE2  TYR  37           HE2      TYR  37  10.969  -6.035   6.688
  289    HH   TYR  37           HH       TYR  37  13.253  -6.683   5.625
  290    H    GLY  38           H        GLY  38   9.209  -2.895   2.498
  291   1HA   GLY  38          1HA       GLY  38   6.347  -2.203   2.712
  292   2HA   GLY  38          2HA       GLY  38   7.083  -1.954   1.132
  293    H    TYR  39           H        TYR  39   5.247  -4.068   2.747
  294    HA   TYR  39           HA       TYR  39   5.830  -6.260   0.895
  295   1HB   TYR  39          1HB       TYR  39   6.471  -7.862   2.601
  296   2HB   TYR  39          2HB       TYR  39   7.522  -6.457   2.757
  297    HD1  TYR  39           HD1      TYR  39   7.202  -4.840   4.601
  298    HD2  TYR  39           HD2      TYR  39   4.834  -8.409   4.288
  299    HE1  TYR  39           HE1      TYR  39   6.482  -4.569   6.958
  300    HE2  TYR  39           HE2      TYR  39   4.118  -8.141   6.645
  301    HH   TYR  39           HH       TYR  39   5.628  -5.966   8.788
  302    H    CYS  40           H        CYS  40   4.248  -8.192   1.593
  303    HA   CYS  40           HA       CYS  40   1.633  -6.890   2.145
  304   1HB   CYS  40          1HB       CYS  40   2.602  -8.772   0.323
  305   2HB   CYS  40          2HB       CYS  40   1.616  -9.716   1.436
  306    H    TYR  41           H        TYR  41   0.518  -7.253   3.999
  307    HA   TYR  41           HA       TYR  41   1.257  -9.590   5.720
  308   1HB   TYR  41          1HB       TYR  41   2.361  -7.546   6.546
  309   2HB   TYR  41          2HB       TYR  41   0.814  -6.699   6.540
  310    HD1  TYR  41           HD1      TYR  41  -1.085  -7.634   7.985
  311    HD2  TYR  41           HD2      TYR  41   3.011  -8.854   8.412
  312    HE1  TYR  41           HE1      TYR  41  -1.581  -8.506  10.252
  313    HE2  TYR  41           HE2      TYR  41   2.514  -9.728  10.680
  314    HH   TYR  41           HH       TYR  41  -0.434 -10.409  11.779
  315    H    GLY  42           H        GLY  42  -0.603 -10.769   6.049
  316   1HA   GLY  42          1HA       GLY  42  -2.879 -11.231   6.451
  317   2HA   GLY  42          2HA       GLY  42  -3.092  -9.521   6.838
  318    H    PHE  43           H        PHE  43  -1.751 -10.703   3.808
  319    HA   PHE  43           HA       PHE  43  -2.517 -10.511   1.589
  320   1HB   PHE  43          1HB       PHE  43  -5.208 -10.488   2.994
  321   2HB   PHE  43          2HB       PHE  43  -4.926 -10.869   1.295
  322    HD1  PHE  43           HD1      PHE  43  -2.411 -12.455   1.499
  323    HD2  PHE  43           HD2      PHE  43  -5.981 -12.541   3.885
  324    HE1  PHE  43           HE1      PHE  43  -1.947 -14.813   2.109
  325    HE2  PHE  43           HE2      PHE  43  -5.519 -14.900   4.492
  326    HZ   PHE  43           HZ       PHE  43  -3.500 -16.036   3.604
  327    H    GLY  44           H        GLY  44  -1.515  -8.246   1.970
  328   1HA   GLY  44          1HA       GLY  44  -3.108  -6.272   0.706
  329   2HA   GLY  44          2HA       GLY  44  -3.159  -5.961   2.443
  330    H    CYS  45           H        CYS  45  -1.701  -4.719  -0.059
  331    HA   CYS  45           HA       CYS  45   1.123  -4.963   0.480
  332   1HB   CYS  45          1HB       CYS  45  -0.669  -3.038  -1.002
  333   2HB   CYS  45          2HB       CYS  45   1.071  -2.771  -0.909
  334    H    TYR  46           H        TYR  46   2.134  -4.180   2.267
  335    HA   TYR  46           HA       TYR  46   1.008  -1.740   3.607
  336   1HB   TYR  46          1HB       TYR  46   0.980  -4.108   4.692
  337   2HB   TYR  46          2HB       TYR  46   2.717  -3.876   4.887
  338    HD1  TYR  46           HD1      TYR  46  -0.575  -2.244   5.601
  339    HD2  TYR  46           HD2      TYR  46   3.556  -2.645   6.708
  340    HE1  TYR  46           HE1      TYR  46  -0.987  -0.881   7.632
  341    HE2  TYR  46           HE2      TYR  46   3.145  -1.283   8.737
  342    HH   TYR  46           HH       TYR  46   0.486  -0.819  10.131
  343    H    CYS  47           H        CYS  47   2.555  -0.155   4.293
  344    HA   CYS  47           HA       CYS  47   5.418  -0.649   3.647
  345   1HB   CYS  47          1HB       CYS  47   3.506   0.961   2.125
  346   2HB   CYS  47          2HB       CYS  47   4.915   1.898   2.630
  347    H    GLU  48           H        GLU  48   6.826   0.886   4.739
  348    HA   GLU  48           HA       GLU  48   5.443   2.414   6.917
  349   1HB   GLU  48          1HB       GLU  48   8.054   0.869   6.906
  350   2HB   GLU  48          2HB       GLU  48   7.423   1.772   8.285
  351   1HG   GLU  48          1HG       GLU  48   5.436   0.352   8.355
  352   2HG   GLU  48          2HG       GLU  48   5.969  -0.506   6.908
  353    H    GLY  49           H        GLY  49   6.429   4.408   7.536
  354   1HA   GLY  49          1HA       GLY  49   8.163   6.099   7.359
  355   2HA   GLY  49          2HA       GLY  49   8.666   5.373   5.832
  356    H    LEU  50           H        LEU  50   5.256   5.791   6.371
  357    HA   LEU  50           HA       LEU  50   5.162   7.717   4.135
  358   1HB   LEU  50          1HB       LEU  50   2.847   6.629   5.742
  359   2HB   LEU  50          2HB       LEU  50   2.859   7.140   4.058
  360    HG   LEU  50           HG       LEU  50   2.927   4.876   3.729
  361   1HD1  LEU  50          1HD1      LEU  50   5.278   6.032   3.190
  362   2HD1  LEU  50          2HD1      LEU  50   5.830   4.838   4.364
  363   3HD1  LEU  50          3HD1      LEU  50   4.989   4.317   2.903
  364   1HD2  LEU  50          1HD2      LEU  50   3.369   4.833   6.482
  365   2HD2  LEU  50          2HD2      LEU  50   3.066   3.437   5.448
  366   3HD2  LEU  50          3HD2      LEU  50   4.722   3.930   5.803
  367    HA   PRO  51           HA       PRO  51   5.172  10.956   7.331
  368   1HB   PRO  51          1HB       PRO  51   4.829  12.866   5.220
  369   2HB   PRO  51          2HB       PRO  51   6.305  12.502   6.119
  370   1HG   PRO  51          1HG       PRO  51   5.641  11.800   3.387
  371   2HG   PRO  51          2HG       PRO  51   7.170  11.571   4.242
  372   1HD   PRO  51          1HD       PRO  51   5.313   9.543   3.486
  373   2HD   PRO  51          2HD       PRO  51   6.752   9.351   4.513
  374    H    ASP  52           H        ASP  52   3.515  12.687   7.851
  375    HA   ASP  52           HA       ASP  52   0.849  11.747   7.719
  376   1HB   ASP  52          1HB       ASP  52   2.014  13.518   9.207
  377   2HB   ASP  52          2HB       ASP  52   1.645  14.656   7.911
  378    H    SER  53           H        SER  53   2.371  14.372   5.814
  379    HA   SER  53           HA       SER  53   0.210  15.086   4.181
  380   1HB   SER  53          1HB       SER  53   3.150  14.822   3.476
  381   2HB   SER  53          2HB       SER  53   1.985  15.839   2.637
  382    HG   SER  53           HG       SER  53   3.077  16.087   5.213
  383    H    THR  54           H        THR  54   2.029  12.104   4.150
  384    HA   THR  54           HA       THR  54   1.481  11.349   1.407
  385    HB   THR  54           HB       THR  54   2.039   9.615   3.841
  386    HG1  THR  54           HG1      THR  54   3.677  11.043   3.746
  387   1HG2  THR  54          1HG2      THR  54   1.723   9.119   0.989
  388   2HG2  THR  54          2HG2      THR  54   3.312   8.614   1.565
  389   3HG2  THR  54          3HG2      THR  54   1.854   7.966   2.317
  390    H    GLN  55           H        GLN  55  -0.268  10.203   0.585
  391    HA   GLN  55           HA       GLN  55  -2.662   9.992   2.328
  392   1HB   GLN  55          1HB       GLN  55  -3.015  11.082   0.241
  393   2HB   GLN  55          2HB       GLN  55  -2.071   9.878  -0.635
  394   1HG   GLN  55          1HG       GLN  55  -3.926   8.663  -1.000
  395   2HG   GLN  55          2HG       GLN  55  -4.204   8.539   0.738
  396   1HE2  GLN  55          2HE2      GLN  55  -6.134   9.468   1.423
  397   2HE2  GLN  55          1HE2      GLN  55  -6.958  10.714   0.616
  398    H    THR  56           H        THR  56  -3.583   7.997   2.869
  399    HA   THR  56           HA       THR  56  -2.580   5.528   1.563
  400    HB   THR  56           HB       THR  56  -0.951   5.915   3.297
  401    HG1  THR  56           HG1      THR  56  -2.895   4.149   4.359
  402   1HG2  THR  56          1HG2      THR  56  -3.385   6.684   4.860
  403   2HG2  THR  56          2HG2      THR  56  -1.995   6.034   5.730
  404   3HG2  THR  56          3HG2      THR  56  -1.821   7.493   4.755
  405    H    TRP  57           H        TRP  57  -3.782   3.581   2.484
  406    HA   TRP  57           HA       TRP  57  -6.619   4.056   2.493
  407   1HB   TRP  57          1HB       TRP  57  -5.074   2.011   1.846
  408   2HB   TRP  57          2HB       TRP  57  -5.295   1.568   3.537
  409    HD1  TRP  57           HD1      TRP  57  -7.288   2.146   0.312
  410    HE1  TRP  57           HE1      TRP  57  -9.568   0.963   0.532
  411    HE3  TRP  57           HE3      TRP  57  -7.032   0.633   5.184
  412    HZ2  TRP  57           HZ2      TRP  57 -11.085  -0.437   2.515
  413    HZ3  TRP  57           HZ3      TRP  57  -8.906  -0.621   6.211
  414    HH2  TRP  57           HH2      TRP  57 -10.929  -1.159   4.884
  415    HA   PRO  58           HA       PRO  58  -8.374   3.393   3.103
  416   1HB   PRO  58          1HB       PRO  58 -10.436   4.652   4.540
  417   2HB   PRO  58          2HB       PRO  58 -10.151   2.910   4.447
  418   1HG   PRO  58          1HG       PRO  58  -9.789   4.682   6.719
  419   2HG   PRO  58          2HG       PRO  58  -9.682   2.920   6.664
  420   1HD   PRO  58          1HD       PRO  58  -7.513   4.842   6.821
  421   2HD   PRO  58          2HD       PRO  58  -7.410   3.062   6.842
  422    H    LEU  59           H        LEU  59  -9.944   5.191   2.131
  423    HA   LEU  59           HA       LEU  59  -8.371   7.703   1.939
  424   1HB   LEU  59          1HB       LEU  59 -10.463   6.240   0.362
  425   2HB   LEU  59          2HB       LEU  59 -10.253   7.966   0.079
  426    HG   LEU  59           HG       LEU  59  -8.124   5.819  -0.143
  427   1HD1  LEU  59          1HD1      LEU  59  -9.487   7.633  -2.152
  428   2HD1  LEU  59          2HD1      LEU  59  -8.057   6.667  -2.515
  429   3HD1  LEU  59          3HD1      LEU  59  -9.569   5.872  -2.079
  430   1HD2  LEU  59          1HD2      LEU  59  -7.977   8.834  -0.183
  431   2HD2  LEU  59          2HD2      LEU  59  -6.965   7.699   0.708
  432   3HD2  LEU  59          3HD2      LEU  59  -6.787   7.858  -1.038
  433    HA   PRO  60           HA       PRO  60 -11.052  10.398   4.160
  434   1HB   PRO  60          1HB       PRO  60 -11.883  11.913   1.809
  435   2HB   PRO  60          2HB       PRO  60 -10.833  12.409   3.140
  436   1HG   PRO  60          1HG       PRO  60 -10.031  11.802   0.498
  437   2HG   PRO  60          2HG       PRO  60  -8.974  12.068   1.887
  438   1HD   PRO  60          1HD       PRO  60  -9.507   9.587   0.491
  439   2HD   PRO  60          2HD       PRO  60  -8.376   9.869   1.836
  440    H    ASN  61           H        ASN  61 -13.411  11.658   3.402
  441    HA   ASN  61           HA       ASN  61 -15.434   9.784   3.814
  442   1HB   ASN  61          1HB       ASN  61 -16.892  11.583   3.197
  443   2HB   ASN  61          2HB       ASN  61 -15.437  12.351   3.833
  444   1HD2  ASN  61          2HD2      ASN  61 -14.139  13.603   2.370
  445   2HD2  ASN  61          1HD2      ASN  61 -14.573  13.864   0.750
  446    H    LYS  62           H        LYS  62 -13.881  10.711   0.794
  447    HA   LYS  62           HA       LYS  62 -15.802   9.188  -0.852
  448   1HB   LYS  62          1HB       LYS  62 -14.654  11.360  -1.481
  449   2HB   LYS  62          2HB       LYS  62 -13.149  10.448  -1.600
  450   1HG   LYS  62          1HG       LYS  62 -13.853   9.261  -3.470
  451   2HG   LYS  62          2HG       LYS  62 -15.561   9.449  -3.074
  452   1HD   LYS  62          1HD       LYS  62 -15.699  11.296  -4.352
  453   2HD   LYS  62          2HD       LYS  62 -14.369  12.044  -3.469
  454   1HE   LYS  62          1HE       LYS  62 -13.859   9.954  -5.600
  455   2HE   LYS  62          2HE       LYS  62 -13.987  11.680  -5.992
  456   1HZ   LYS  62          1HZ       LYS  62 -12.425  11.849  -3.893
  457   2HZ   LYS  62          2HZ       LYS  62 -11.980  10.285  -4.382
  458   3HZ   LYS  62          3HZ       LYS  62 -11.790  11.591  -5.448
  459    H    THR  63           H        THR  63 -15.188   7.163   0.532
  460    HA   THR  63           HA       THR  63 -12.600   5.930   0.171
  461    HB   THR  63           HB       THR  63 -15.143   4.422   0.686
  462    HG1  THR  63           HG1      THR  63 -14.092   6.551   2.161
  463   1HG2  THR  63          1HG2      THR  63 -12.390   3.946   0.991
  464   2HG2  THR  63          2HG2      THR  63 -13.004   4.196   2.624
  465   3HG2  THR  63          3HG2      THR  63 -13.709   2.947   1.601
  466    H    CYS  64           H        CYS  64 -12.947   3.416  -0.754
  467    HA   CYS  64           HA       CYS  64 -13.425   3.816  -3.638
  468   1HB   CYS  64          1HB       CYS  64 -11.530   2.518  -2.330
  469   2HB   CYS  64          2HB       CYS  64 -12.713   1.209  -2.328
  Start of MODEL   38
    1   1H    LYS   1          1H        LYS   1   5.222   7.796   8.108
    2   2H    LYS   1          2H        LYS   1   4.896   9.192   9.020
    3   3H    LYS   1          3H        LYS   1   5.480   7.791   9.784
    4    HA   LYS   1           HA       LYS   1   3.276   7.553  10.287
    5   1HB   LYS   1          1HB       LYS   1   2.991   9.760   8.975
    6   2HB   LYS   1          2HB       LYS   1   2.582   8.741   7.594
    7   1HG   LYS   1          1HG       LYS   1   1.028   7.639   9.568
    8   2HG   LYS   1          2HG       LYS   1   1.008   9.347  10.011
    9   1HD   LYS   1          1HD       LYS   1  -0.836   8.875   8.471
   10   2HD   LYS   1          2HD       LYS   1   0.348   9.919   7.683
   11   1HE   LYS   1          1HE       LYS   1   1.065   7.146   7.262
   12   2HE   LYS   1          2HE       LYS   1  -0.603   7.438   6.728
   13   1HZ   LYS   1          1HZ       LYS   1   0.432   9.624   5.809
   14   2HZ   LYS   1          2HZ       LYS   1   1.882   8.739   5.845
   15   3HZ   LYS   1          3HZ       LYS   1   0.570   8.187   4.917
   16    H    ASP   2           H        ASP   2   2.099   5.645   9.933
   17    HA   ASP   2           HA       ASP   2   2.989   3.976   7.626
   18   1HB   ASP   2          1HB       ASP   2   1.267   3.172   9.987
   19   2HB   ASP   2          2HB       ASP   2   2.311   2.146   9.003
   20    H    GLY   3           H        GLY   3   1.333   2.794   6.392
   21   1HA   GLY   3          1HA       GLY   3  -1.480   3.439   6.684
   22   2HA   GLY   3          2HA       GLY   3  -0.746   4.317   5.345
   23    H    TYR   4           H        TYR   4  -2.408   2.927   4.167
   24    HA   TYR   4           HA       TYR   4  -1.187   0.272   3.473
   25   1HB   TYR   4          1HB       TYR   4  -3.836   1.083   4.384
   26   2HB   TYR   4          2HB       TYR   4  -3.918   0.219   2.849
   27    HD1  TYR   4           HD1      TYR   4  -2.319  -1.927   2.719
   28    HD2  TYR   4           HD2      TYR   4  -3.831  -0.172   6.336
   29    HE1  TYR   4           HE1      TYR   4  -1.965  -4.074   3.910
   30    HE2  TYR   4           HE2      TYR   4  -3.475  -2.317   7.527
   31    HH   TYR   4           HH       TYR   4  -2.217  -5.180   5.812
   32    H    LEU   5           H        LEU   5  -1.674  -0.399   1.200
   33    HA   LEU   5           HA       LEU   5  -1.443   1.881  -0.653
   34   1HB   LEU   5          1HB       LEU   5  -0.765  -0.922  -0.512
   35   2HB   LEU   5          2HB       LEU   5  -1.656  -0.608  -2.002
   36    HG   LEU   5           HG       LEU   5   0.220   1.526  -1.565
   37   1HD1  LEU   5          1HD1      LEU   5   1.331  -0.381  -0.236
   38   2HD1  LEU   5          2HD1      LEU   5   1.546  -1.178  -1.794
   39   3HD1  LEU   5          3HD1      LEU   5   2.301   0.387  -1.493
   40   1HD2  LEU   5          1HD2      LEU   5   0.053  -0.705  -3.618
   41   2HD2  LEU   5          2HD2      LEU   5  -0.728   0.873  -3.735
   42   3HD2  LEU   5          3HD2      LEU   5   1.031   0.753  -3.786
   43    H    VAL   6           H        VAL   6  -2.858   1.812  -2.686
   44    HA   VAL   6           HA       VAL   6  -5.605   0.779  -2.093
   45    HB   VAL   6           HB       VAL   6  -6.484   2.955  -2.803
   46   1HG1  VAL   6          1HG1      VAL   6  -5.150   2.404  -0.449
   47   2HG1  VAL   6          2HG1      VAL   6  -4.416   3.925  -0.957
   48   3HG1  VAL   6          3HG1      VAL   6  -6.161   3.819  -0.731
   49   1HG2  VAL   6          1HG2      VAL   6  -3.686   3.279  -3.684
   50   2HG2  VAL   6          2HG2      VAL   6  -5.152   4.050  -4.293
   51   3HG2  VAL   6          3HG2      VAL   6  -4.348   4.690  -2.859
   52    H    GLU   7           H        GLU   7  -6.948   1.369  -4.297
   53    HA   GLU   7           HA       GLU   7  -5.261   0.399  -6.591
   54   1HB   GLU   7          1HB       GLU   7  -7.216  -0.968  -5.227
   55   2HB   GLU   7          2HB       GLU   7  -8.140  -0.261  -6.553
   56   1HG   GLU   7          1HG       GLU   7  -6.642  -1.236  -8.193
   57   2HG   GLU   7          2HG       GLU   7  -5.566  -1.819  -6.922
   58    H    LYS   8           H        LYS   8  -6.967   0.643  -8.659
   59    HA   LYS   8           HA       LYS   8  -7.056   3.429  -9.251
   60   1HB   LYS   8          1HB       LYS   8  -8.283   2.664 -11.235
   61   2HB   LYS   8          2HB       LYS   8  -6.978   1.535 -10.869
   62   1HG   LYS   8          1HG       LYS   8  -8.615   0.098  -9.650
   63   2HG   LYS   8          2HG       LYS   8  -9.903   1.195 -10.146
   64   1HD   LYS   8          1HD       LYS   8  -8.290   0.440 -12.427
   65   2HD   LYS   8          2HD       LYS   8  -8.905  -0.993 -11.602
   66   1HE   LYS   8          1HE       LYS   8 -10.833   1.254 -12.003
   67   2HE   LYS   8          2HE       LYS   8 -10.385   0.300 -13.431
   68   1HZ   LYS   8          1HZ       LYS   8 -10.727  -1.704 -11.927
   69   2HZ   LYS   8          2HZ       LYS   8 -11.548  -0.652 -10.883
   70   3HZ   LYS   8          3HZ       LYS   8 -12.123  -0.899 -12.463
   71    H    THR   9           H        THR   9  -9.675   1.193  -8.237
   72    HA   THR   9           HA       THR   9 -11.683   3.315  -8.210
   73    HB   THR   9           HB       THR   9 -12.983   1.436  -7.061
   74    HG1  THR   9           HG1      THR   9 -11.882  -0.199  -6.389
   75   1HG2  THR   9          1HG2      THR   9 -11.723   1.352  -9.752
   76   2HG2  THR   9          2HG2      THR   9 -12.519  -0.123  -9.205
   77   3HG2  THR   9          3HG2      THR   9 -13.429   1.385  -9.308
   78    H    GLY  10           H        GLY  10  -9.192   2.302  -6.107
   79   1HA   GLY  10          1HA       GLY  10  -8.721   3.817  -4.190
   80   2HA   GLY  10          2HA       GLY  10 -10.454   3.817  -3.858
   81    H    CYS  11           H        CYS  11 -10.651   0.893  -4.441
   82    HA   CYS  11           HA       CYS  11 -10.448  -0.169  -1.842
   83   1HB   CYS  11          1HB       CYS  11 -10.527  -1.255  -4.638
   84   2HB   CYS  11          2HB       CYS  11 -10.255  -2.378  -3.306
   85    H    LYS  12           H        LYS  12  -8.881  -1.799  -1.015
   86    HA   LYS  12           HA       LYS  12  -6.117  -0.940  -1.456
   87   1HB   LYS  12          1HB       LYS  12  -5.743  -2.684   0.336
   88   2HB   LYS  12          2HB       LYS  12  -6.922  -1.450   0.769
   89   1HG   LYS  12          1HG       LYS  12  -8.569  -2.982   0.949
   90   2HG   LYS  12          2HG       LYS  12  -8.187  -3.653  -0.638
   91   1HD   LYS  12          1HD       LYS  12  -7.039  -5.380   0.261
   92   2HD   LYS  12          2HD       LYS  12  -6.163  -4.318   1.364
   93   1HE   LYS  12          1HE       LYS  12  -7.409  -5.405   2.964
   94   2HE   LYS  12          2HE       LYS  12  -8.672  -4.259   2.469
   95   1HZ   LYS  12          1HZ       LYS  12  -8.205  -6.825   1.065
   96   2HZ   LYS  12          2HZ       LYS  12  -9.300  -6.685   2.356
   97   3HZ   LYS  12          3HZ       LYS  12  -9.543  -5.793   0.931
   98    H    LYS  13           H        LYS  13  -4.577  -3.114  -1.295
   99    HA   LYS  13           HA       LYS  13  -5.378  -4.929  -3.545
  100   1HB   LYS  13          1HB       LYS  13  -3.363  -2.896  -3.450
  101   2HB   LYS  13          2HB       LYS  13  -2.553  -4.461  -3.526
  102   1HG   LYS  13          1HG       LYS  13  -4.835  -4.377  -5.325
  103   2HG   LYS  13          2HG       LYS  13  -3.699  -3.075  -5.677
  104   1HD   LYS  13          1HD       LYS  13  -2.339  -5.599  -5.123
  105   2HD   LYS  13          2HD       LYS  13  -3.444  -5.723  -6.493
  106   1HE   LYS  13          1HE       LYS  13  -2.277  -4.146  -7.752
  107   2HE   LYS  13          2HE       LYS  13  -1.610  -3.344  -6.315
  108   1HZ   LYS  13          1HZ       LYS  13  -0.970  -6.157  -6.974
  109   2HZ   LYS  13          2HZ       LYS  13  -0.050  -4.873  -7.592
  110   3HZ   LYS  13          3HZ       LYS  13  -0.153  -5.111  -5.913
  111    H    THR  14           H        THR  14  -5.461  -6.949  -2.629
  112    HA   THR  14           HA       THR  14  -3.789  -7.607  -0.279
  113    HB   THR  14           HB       THR  14  -6.084  -8.821  -1.810
  114    HG1  THR  14           HG1      THR  14  -6.209  -7.251  -0.008
  115   1HG2  THR  14          1HG2      THR  14  -4.367 -10.203   0.268
  116   2HG2  THR  14          2HG2      THR  14  -5.965 -10.764  -0.224
  117   3HG2  THR  14          3HG2      THR  14  -4.645 -10.724  -1.393
  118    H    CYS  15           H        CYS  15  -2.311  -9.415  -0.283
  119    HA   CYS  15           HA       CYS  15  -1.386 -10.275  -3.009
  120   1HB   CYS  15          1HB       CYS  15   0.864 -10.112  -2.181
  121   2HB   CYS  15          2HB       CYS  15   0.050  -8.625  -1.700
  122    H    TYR  16           H        TYR  16   0.103 -12.363  -2.632
  123    HA   TYR  16           HA       TYR  16  -1.546 -14.255  -1.008
  124   1HB   TYR  16          1HB       TYR  16   0.171 -14.374  -3.465
  125   2HB   TYR  16          2HB       TYR  16  -0.020 -15.846  -2.511
  126    HD1  TYR  16           HD1      TYR  16  -2.284 -16.811  -2.130
  127    HD2  TYR  16           HD2      TYR  16  -1.651 -13.467  -4.750
  128    HE1  TYR  16           HE1      TYR  16  -4.516 -17.184  -3.144
  129    HE2  TYR  16           HE2      TYR  16  -3.882 -13.841  -5.767
  130    HH   TYR  16           HH       TYR  16  -5.496 -15.652  -6.039
  131    H    LYS  17           H        LYS  17   1.908 -13.686  -1.832
  132    HA   LYS  17           HA       LYS  17   2.773 -15.219   0.524
  133   1HB   LYS  17          1HB       LYS  17   3.787 -14.782  -1.950
  134   2HB   LYS  17          2HB       LYS  17   4.650 -13.533  -1.053
  135   1HG   LYS  17          1HG       LYS  17   5.871 -15.724  -1.121
  136   2HG   LYS  17          2HG       LYS  17   5.508 -15.177   0.517
  137   1HD   LYS  17          1HD       LYS  17   3.293 -16.718  -0.492
  138   2HD   LYS  17          2HD       LYS  17   4.784 -17.644  -0.670
  139   1HE   LYS  17          1HE       LYS  17   5.259 -16.862   1.794
  140   2HE   LYS  17          2HE       LYS  17   3.505 -16.594   1.845
  141   1HZ   LYS  17          1HZ       LYS  17   4.725 -19.092   0.810
  142   2HZ   LYS  17          2HZ       LYS  17   4.247 -18.909   2.431
  143   3HZ   LYS  17          3HZ       LYS  17   3.093 -18.810   1.192
  144    H    LEU  18           H        LEU  18   2.476 -14.177   2.459
  145    HA   LEU  18           HA       LEU  18   2.506 -11.298   2.778
  146   1HB   LEU  18          1HB       LEU  18   2.755 -13.574   4.774
  147   2HB   LEU  18          2HB       LEU  18   2.301 -11.913   5.160
  148    HG   LEU  18           HG       LEU  18   0.768 -13.761   3.307
  149   1HD1  LEU  18          1HD1      LEU  18   0.153 -12.765   6.107
  150   2HD1  LEU  18          2HD1      LEU  18  -0.940 -13.717   5.101
  151   3HD1  LEU  18          3HD1      LEU  18   0.574 -14.421   5.670
  152   1HD2  LEU  18          1HD2      LEU  18   0.392 -10.900   4.205
  153   2HD2  LEU  18          2HD2      LEU  18   0.413 -11.535   2.560
  154   3HD2  LEU  18          3HD2      LEU  18  -0.958 -11.871   3.617
  155    H    GLY  19           H        GLY  19   4.044 -10.820   4.992
  156   1HA   GLY  19          1HA       GLY  19   6.266 -10.625   5.801
  157   2HA   GLY  19          2HA       GLY  19   6.766 -11.825   4.610
  158    H    GLU  20           H        GLU  20   8.582 -10.142   4.467
  159    HA   GLU  20           HA       GLU  20   8.194  -7.569   3.296
  160   1HB   GLU  20          1HB       GLU  20  10.313  -9.419   3.980
  161   2HB   GLU  20          2HB       GLU  20  10.655  -8.657   2.426
  162   1HG   GLU  20          1HG       GLU  20  11.571  -7.138   3.970
  163   2HG   GLU  20          2HG       GLU  20   9.988  -6.444   3.619
  164    H    ASN  21           H        ASN  21   6.465  -8.243   1.654
  165    HA   ASN  21           HA       ASN  21   7.199  -9.874  -0.627
  166   1HB   ASN  21          1HB       ASN  21   4.892  -9.016   0.422
  167   2HB   ASN  21          2HB       ASN  21   5.116  -7.724  -0.759
  168   1HD2  ASN  21          2HD2      ASN  21   3.150 -10.104  -0.726
  169   2HD2  ASN  21          1HD2      ASN  21   3.396 -10.857  -2.227
  170    H    ASP  22           H        ASP  22   9.282  -8.918  -1.233
  171    HA   ASP  22           HA       ASP  22  10.059  -6.353  -1.773
  172   1HB   ASP  22          1HB       ASP  22  10.452  -9.005  -3.048
  173   2HB   ASP  22          2HB       ASP  22  10.950  -7.617  -4.016
  174    H    PHE  23           H        PHE  23   8.149  -8.319  -4.095
  175    HA   PHE  23           HA       PHE  23   7.763  -6.507  -6.156
  176   1HB   PHE  23          1HB       PHE  23   6.824  -8.905  -5.632
  177   2HB   PHE  23          2HB       PHE  23   5.440  -8.023  -4.983
  178    HD1  PHE  23           HD1      PHE  23   5.020  -5.782  -6.665
  179    HD2  PHE  23           HD2      PHE  23   6.363  -9.709  -7.772
  180    HE1  PHE  23           HE1      PHE  23   4.165  -5.425  -8.965
  181    HE2  PHE  23           HE2      PHE  23   5.509  -9.351 -10.073
  182    HZ   PHE  23           HZ       PHE  23   4.412  -7.209 -10.669
  183    H    CYS  24           H        CYS  24   5.915  -6.656  -3.101
  184    HA   CYS  24           HA       CYS  24   4.285  -4.334  -3.692
  185   1HB   CYS  24          1HB       CYS  24   3.628  -6.109  -2.125
  186   2HB   CYS  24          2HB       CYS  24   5.030  -5.758  -1.114
  187    H    ASN  25           H        ASN  25   7.122  -4.864  -1.579
  188    HA   ASN  25           HA       ASN  25   7.535  -2.356  -0.481
  189   1HB   ASN  25          1HB       ASN  25   8.897  -4.512  -0.326
  190   2HB   ASN  25          2HB       ASN  25   9.682  -4.019  -1.826
  191   1HD2  ASN  25          2HD2      ASN  25  10.606  -4.182   1.159
  192   2HD2  ASN  25          1HD2      ASN  25  11.365  -2.684   1.404
  193    H    ARG  26           H        ARG  26   8.867  -3.389  -3.639
  194    HA   ARG  26           HA       ARG  26   9.733  -0.762  -4.433
  195   1HB   ARG  26          1HB       ARG  26  10.782  -2.583  -5.475
  196   2HB   ARG  26          2HB       ARG  26   9.264  -3.449  -5.701
  197   1HG   ARG  26          1HG       ARG  26   9.998  -2.637  -7.863
  198   2HG   ARG  26          2HG       ARG  26   8.589  -1.696  -7.375
  199   1HD   ARG  26          1HD       ARG  26  10.001   0.042  -7.985
  200   2HD   ARG  26          2HD       ARG  26  10.514  -0.143  -6.296
  201    HE   ARG  26           HE       ARG  26  12.025  -2.020  -7.696
  202   1HH1  ARG  26          1HH1      ARG  26  11.463   1.385  -7.834
  203   2HH1  ARG  26          2HH1      ARG  26  13.031   1.748  -8.472
  204   1HH2  ARG  26          1HH2      ARG  26  14.071  -1.561  -8.534
  205   2HH2  ARG  26          2HH2      ARG  26  14.507   0.081  -8.871
  206    H    GLU  27           H        GLU  27   6.895  -2.727  -5.402
  207    HA   GLU  27           HA       GLU  27   5.703  -0.790  -7.124
  208   1HB   GLU  27          1HB       GLU  27   5.139  -3.182  -7.047
  209   2HB   GLU  27          2HB       GLU  27   4.501  -2.990  -5.413
  210   1HG   GLU  27          1HG       GLU  27   2.670  -1.695  -6.148
  211   2HG   GLU  27          2HG       GLU  27   3.433  -1.339  -7.699
  212    H    CYS  28           H        CYS  28   5.863  -0.948  -3.658
  213    HA   CYS  28           HA       CYS  28   3.473   0.665  -3.178
  214   1HB   CYS  28          1HB       CYS  28   3.983  -0.772  -1.421
  215   2HB   CYS  28          2HB       CYS  28   5.721  -0.550  -1.607
  216    H    LYS  29           H        LYS  29   6.994   1.310  -2.739
  217    HA   LYS  29           HA       LYS  29   6.312   4.224  -2.829
  218   1HB   LYS  29          1HB       LYS  29   8.323   4.474  -1.457
  219   2HB   LYS  29          2HB       LYS  29   7.261   3.257  -0.751
  220   1HG   LYS  29          1HG       LYS  29   8.891   1.717  -0.899
  221   2HG   LYS  29          2HG       LYS  29   8.985   1.968  -2.643
  222   1HD   LYS  29          1HD       LYS  29  10.587   3.738  -2.389
  223   2HD   LYS  29          2HD       LYS  29  10.339   3.792  -0.643
  224   1HE   LYS  29          1HE       LYS  29  11.026   1.113  -1.221
  225   2HE   LYS  29          2HE       LYS  29  12.160   2.120  -2.143
  226   1HZ   LYS  29          1HZ       LYS  29  11.452   2.691   0.677
  227   2HZ   LYS  29          2HZ       LYS  29  12.767   1.706   0.260
  228   3HZ   LYS  29          3HZ       LYS  29  12.738   3.333  -0.228
  229    H    TRP  30           H        TRP  30   6.716   2.855  -5.362
  230    HA   TRP  30           HA       TRP  30   9.438   3.131  -6.221
  231   1HB   TRP  30          1HB       TRP  30   8.155   3.349  -8.551
  232   2HB   TRP  30          2HB       TRP  30   8.284   1.820  -7.704
  233    HD1  TRP  30           HD1      TRP  30   6.088   0.893  -8.750
  234    HE1  TRP  30           HE1      TRP  30   3.593   1.365  -8.329
  235    HE3  TRP  30           HE3      TRP  30   6.440   5.210  -6.060
  236    HZ2  TRP  30           HZ2      TRP  30   1.961   3.313  -7.030
  237    HZ3  TRP  30           HZ3      TRP  30   4.405   6.360  -5.247
  238    HH2  TRP  30           HH2      TRP  30   2.164   5.414  -5.726
  239    H    LYS  31           H        LYS  31   9.349   4.754  -8.516
  240    HA   LYS  31           HA       LYS  31   9.970   7.003  -8.984
  241   1HB   LYS  31          1HB       LYS  31   7.431   6.648  -9.227
  242   2HB   LYS  31          2HB       LYS  31   7.283   7.515  -7.697
  243   1HG   LYS  31          1HG       LYS  31   8.887   9.246  -8.941
  244   2HG   LYS  31          2HG       LYS  31   8.149   8.526 -10.373
  245   1HD   LYS  31          1HD       LYS  31   6.151   9.523  -9.979
  246   2HD   LYS  31          2HD       LYS  31   6.210   9.151  -8.255
  247   1HE   LYS  31          1HE       LYS  31   7.490  11.093  -7.762
  248   2HE   LYS  31          2HE       LYS  31   7.944  11.323  -9.461
  249   1HZ   LYS  31          1HZ       LYS  31   5.180  11.202  -9.410
  250   2HZ   LYS  31          2HZ       LYS  31   5.609  12.217  -8.117
  251   3HZ   LYS  31          3HZ       LYS  31   6.138  12.577  -9.687
  252    H    HIS  32           H        HIS  32  10.666   6.051  -6.168
  253    HA   HIS  32           HA       HIS  32  11.581   7.044  -4.226
  254   1HB   HIS  32          1HB       HIS  32  12.101   8.642  -6.412
  255   2HB   HIS  32          2HB       HIS  32  11.337   9.776  -5.299
  256    HD1  HIS  32           HD1      HIS  32  14.534   9.306  -6.124
  257    HD2  HIS  32           HD2      HIS  32  12.644   8.579  -2.481
  258    HE1  HIS  32           HE1      HIS  32  16.347   9.343  -4.356
  259    H    ILE  33           H        ILE  33  10.776   7.958  -2.297
  260    HA   ILE  33           HA       ILE  33   8.377   9.680  -2.354
  261    HB   ILE  33           HB       ILE  33   8.429   6.825  -1.340
  262   1HG1  ILE  33          1HG1      ILE  33   6.808   8.365  -3.382
  263   2HG1  ILE  33          2HG1      ILE  33   7.816   6.943  -3.650
  264   1HG2  ILE  33          1HG2      ILE  33   7.375   8.610   0.241
  265   2HG2  ILE  33          2HG2      ILE  33   6.110   8.721  -0.982
  266   3HG2  ILE  33          3HG2      ILE  33   6.416   7.188  -0.167
  267   1HD1  ILE  33          1HD1      ILE  33   6.180   5.845  -1.881
  268   2HD1  ILE  33          2HD1      ILE  33   5.093   7.128  -2.412
  269   3HD1  ILE  33          3HD1      ILE  33   5.713   5.960  -3.578
  270    H    GLY  34           H        GLY  34  10.027   7.495  -0.020
  271   1HA   GLY  34          1HA       GLY  34  11.331   9.580   1.428
  272   2HA   GLY  34          2HA       GLY  34   9.782   9.246   2.198
  273    H    GLY  35           H        GLY  35  12.167   7.093   0.654
  274   1HA   GLY  35          1HA       GLY  35  13.044   5.054   1.439
  275   2HA   GLY  35          2HA       GLY  35  13.338   5.966   2.921
  276    H    SER  36           H        SER  36  10.074   5.585   1.777
  277    HA   SER  36           HA       SER  36   9.192   4.375   4.238
  278   1HB   SER  36          1HB       SER  36   7.046   4.377   3.075
  279   2HB   SER  36          2HB       SER  36   7.903   5.864   2.679
  280    HG   SER  36           HG       SER  36   7.910   5.252   0.677
  281    H    TYR  37           H        TYR  37   9.393   2.231   4.768
  282    HA   TYR  37           HA       TYR  37  10.115   0.237   2.725
  283   1HB   TYR  37          1HB       TYR  37  10.531   0.670   5.466
  284   2HB   TYR  37          2HB       TYR  37   9.476  -0.742   5.394
  285    HD1  TYR  37           HD1      TYR  37  12.014   0.359   2.894
  286    HD2  TYR  37           HD2      TYR  37  10.946  -2.536   5.881
  287    HE1  TYR  37           HE1      TYR  37  13.938  -1.050   2.215
  288    HE2  TYR  37           HE2      TYR  37  12.869  -3.946   5.202
  289    HH   TYR  37           HH       TYR  37  14.897  -3.860   4.059
  290    H    GLY  38           H        GLY  38   8.536  -0.862   1.607
  291   1HA   GLY  38          1HA       GLY  38   5.859  -1.111   2.917
  292   2HA   GLY  38          2HA       GLY  38   6.076  -0.948   1.177
  293    H    TYR  39           H        TYR  39   4.887  -3.106   2.974
  294    HA   TYR  39           HA       TYR  39   5.894  -5.373   1.413
  295   1HB   TYR  39          1HB       TYR  39   6.475  -6.654   3.519
  296   2HB   TYR  39          2HB       TYR  39   7.561  -5.311   3.170
  297    HD1  TYR  39           HD1      TYR  39   6.928  -3.009   4.252
  298    HD2  TYR  39           HD2      TYR  39   5.482  -6.812   5.626
  299    HE1  TYR  39           HE1      TYR  39   6.417  -2.014   6.465
  300    HE2  TYR  39           HE2      TYR  39   4.974  -5.819   7.840
  301    HH   TYR  39           HH       TYR  39   5.059  -2.406   8.386
  302    H    CYS  40           H        CYS  40   4.632  -7.466   2.492
  303    HA   CYS  40           HA       CYS  40   1.817  -6.528   2.636
  304   1HB   CYS  40          1HB       CYS  40   3.191  -8.587   1.324
  305   2HB   CYS  40          2HB       CYS  40   2.228  -9.398   2.560
  306    H    TYR  41           H        TYR  41   0.651  -6.632   4.477
  307    HA   TYR  41           HA       TYR  41   1.518  -8.461   6.672
  308   1HB   TYR  41          1HB       TYR  41   2.468  -6.460   7.423
  309   2HB   TYR  41          2HB       TYR  41   1.246  -5.468   6.629
  310    HD1  TYR  41           HD1      TYR  41   1.991  -7.573   9.578
  311    HD2  TYR  41           HD2      TYR  41  -0.880  -5.001   7.690
  312    HE1  TYR  41           HE1      TYR  41   0.708  -7.448  11.698
  313    HE2  TYR  41           HE2      TYR  41  -2.167  -4.877   9.806
  314    HH   TYR  41           HH       TYR  41  -2.258  -5.472  11.936
  315    H    GLY  42           H        GLY  42  -0.305  -9.802   6.561
  316   1HA   GLY  42          1HA       GLY  42  -2.539 -10.325   7.208
  317   2HA   GLY  42          2HA       GLY  42  -2.876  -8.596   7.336
  318    H    PHE  43           H        PHE  43  -1.514 -10.384   4.585
  319    HA   PHE  43           HA       PHE  43  -2.253 -10.540   2.348
  320   1HB   PHE  43          1HB       PHE  43  -4.837 -10.397   3.924
  321   2HB   PHE  43          2HB       PHE  43  -4.793 -10.724   2.194
  322    HD1  PHE  43           HD1      PHE  43  -3.842 -11.992   5.534
  323    HD2  PHE  43           HD2      PHE  43  -3.981 -12.835   1.322
  324    HE1  PHE  43           HE1      PHE  43  -3.358 -14.380   5.997
  325    HE2  PHE  43           HE2      PHE  43  -3.497 -15.222   1.786
  326    HZ   PHE  43           HZ       PHE  43  -3.186 -15.995   4.122
  327    H    GLY  44           H        GLY  44  -1.343  -8.026   2.894
  328   1HA   GLY  44          1HA       GLY  44  -2.805  -6.378   1.040
  329   2HA   GLY  44          2HA       GLY  44  -3.086  -5.830   2.692
  330    H    CYS  45           H        CYS  45  -1.597  -4.463   0.523
  331    HA   CYS  45           HA       CYS  45   1.243  -4.643   1.220
  332   1HB   CYS  45          1HB       CYS  45  -0.532  -3.257  -0.703
  333   2HB   CYS  45          2HB       CYS  45   0.939  -2.384  -0.277
  334    H    TYR  46           H        TYR  46   1.898  -3.794   3.163
  335    HA   TYR  46           HA       TYR  46   0.629  -1.253   4.111
  336   1HB   TYR  46          1HB       TYR  46   0.765  -3.544   5.412
  337   2HB   TYR  46          2HB       TYR  46   2.423  -3.040   5.735
  338    HD1  TYR  46           HD1      TYR  46  -0.874  -1.247   5.542
  339    HD2  TYR  46           HD2      TYR  46   2.641  -2.109   7.860
  340    HE1  TYR  46           HE1      TYR  46  -1.681   0.268   7.331
  341    HE2  TYR  46           HE2      TYR  46   1.830  -0.594   9.649
  342    HH   TYR  46           HH       TYR  46  -0.142   0.417  10.445
  343    H    CYS  47           H        CYS  47   1.957   0.569   4.334
  344    HA   CYS  47           HA       CYS  47   4.893   0.186   3.878
  345   1HB   CYS  47          1HB       CYS  47   2.964   2.137   2.603
  346   2HB   CYS  47          2HB       CYS  47   4.716   2.221   2.413
  347    H    GLU  48           H        GLU  48   6.235   1.664   4.973
  348    HA   GLU  48           HA       GLU  48   4.865   3.541   6.875
  349   1HB   GLU  48          1HB       GLU  48   7.451   2.057   7.388
  350   2HB   GLU  48          2HB       GLU  48   6.374   2.806   8.567
  351   1HG   GLU  48          1HG       GLU  48   4.712   1.009   7.280
  352   2HG   GLU  48          2HG       GLU  48   6.244   0.139   7.356
  353    H    GLY  49           H        GLY  49   5.280   5.455   5.713
  354   1HA   GLY  49          1HA       GLY  49   7.565   6.935   5.995
  355   2HA   GLY  49          2HA       GLY  49   7.924   5.978   4.562
  356    H    LEU  50           H        LEU  50   5.337   5.843   3.501
  357    HA   LEU  50           HA       LEU  50   5.115   7.976   1.767
  358   1HB   LEU  50          1HB       LEU  50   2.462   7.415   2.228
  359   2HB   LEU  50          2HB       LEU  50   3.516   6.450   1.204
  360    HG   LEU  50           HG       LEU  50   3.568   5.826   4.116
  361   1HD1  LEU  50          1HD1      LEU  50   1.092   5.975   2.683
  362   2HD1  LEU  50          2HD1      LEU  50   1.479   4.276   2.956
  363   3HD1  LEU  50          3HD1      LEU  50   1.375   5.388   4.322
  364   1HD2  LEU  50          1HD2      LEU  50   4.715   4.709   1.971
  365   2HD2  LEU  50          2HD2      LEU  50   4.200   3.741   3.354
  366   3HD2  LEU  50          3HD2      LEU  50   3.180   3.841   1.916
  367    HA   PRO  51           HA       PRO  51   4.535  11.270   4.843
  368   1HB   PRO  51          1HB       PRO  51   4.395  13.067   2.582
  369   2HB   PRO  51          2HB       PRO  51   5.694  12.896   3.767
  370   1HG   PRO  51          1HG       PRO  51   5.705  12.062   1.028
  371   2HG   PRO  51          2HG       PRO  51   6.985  11.857   2.228
  372   1HD   PRO  51          1HD       PRO  51   5.287   9.821   1.099
  373   2HD   PRO  51          2HD       PRO  51   6.555   9.621   2.333
  374    H    ASP  52           H        ASP  52   2.772  12.892   5.131
  375    HA   ASP  52           HA       ASP  52   0.179  11.955   4.842
  376   1HB   ASP  52          1HB       ASP  52   1.265  14.040   6.014
  377   2HB   ASP  52          2HB       ASP  52   0.819  14.880   4.528
  378    H    SER  53           H        SER  53   1.674  14.382   2.663
  379    HA   SER  53           HA       SER  53  -0.268  14.705   0.739
  380   1HB   SER  53          1HB       SER  53   1.477  15.718  -0.294
  381   2HB   SER  53          2HB       SER  53   2.479  15.132   1.031
  382    HG   SER  53           HG       SER  53   3.443  14.042  -0.489
  383    H    THR  54           H        THR  54   1.760  11.837   1.197
  384    HA   THR  54           HA       THR  54   1.109  10.517  -1.270
  385    HB   THR  54           HB       THR  54   1.612   8.981   1.241
  386    HG1  THR  54           HG1      THR  54   3.760  10.359   0.138
  387   1HG2  THR  54          1HG2      THR  54   2.547   9.007  -1.614
  388   2HG2  THR  54          2HG2      THR  54   3.509   8.187  -0.385
  389   3HG2  THR  54          3HG2      THR  54   1.847   7.681  -0.686
  390    H    GLN  55           H        GLN  55  -0.426   8.761  -1.584
  391    HA   GLN  55           HA       GLN  55  -2.929   9.133  -0.035
  392   1HB   GLN  55          1HB       GLN  55  -2.113   8.509  -2.718
  393   2HB   GLN  55          2HB       GLN  55  -3.154   7.213  -2.128
  394   1HG   GLN  55          1HG       GLN  55  -4.253   9.731  -1.296
  395   2HG   GLN  55          2HG       GLN  55  -3.934   9.795  -3.030
  396   1HE2  GLN  55          2HE2      GLN  55  -4.358   7.038  -3.672
  397   2HE2  GLN  55          1HE2      GLN  55  -5.997   6.675  -3.422
  398    H    THR  56           H        THR  56  -4.100   7.235   0.787
  399    HA   THR  56           HA       THR  56  -2.705   4.655   0.971
  400    HB   THR  56           HB       THR  56  -1.509   5.938   2.646
  401    HG1  THR  56           HG1      THR  56  -2.724   4.865   4.593
  402   1HG2  THR  56          1HG2      THR  56  -4.286   6.759   3.511
  403   2HG2  THR  56          2HG2      THR  56  -2.877   6.953   4.554
  404   3HG2  THR  56          3HG2      THR  56  -2.953   7.799   3.010
  405    H    TRP  57           H        TRP  57  -4.042   3.070   2.213
  406    HA   TRP  57           HA       TRP  57  -6.937   3.606   1.863
  407   1HB   TRP  57          1HB       TRP  57  -5.263   1.547   1.269
  408   2HB   TRP  57          2HB       TRP  57  -5.858   1.019   2.838
  409    HD1  TRP  57           HD1      TRP  57  -7.384   2.458  -0.422
  410    HE1  TRP  57           HE1      TRP  57  -9.593   1.217  -0.890
  411    HE3  TRP  57           HE3      TRP  57  -7.544  -0.620   3.648
  412    HZ2  TRP  57           HZ2      TRP  57 -11.213  -0.812   0.300
  413    HZ3  TRP  57           HZ3      TRP  57  -9.430  -2.198   3.954
  414    HH2  TRP  57           HH2      TRP  57 -11.264  -2.298   2.288
  415    HA   PRO  58           HA       PRO  58  -8.802   2.819   2.595
  416   1HB   PRO  58          1HB       PRO  58 -10.645   4.458   3.965
  417   2HB   PRO  58          2HB       PRO  58 -10.583   2.693   4.001
  418   1HG   PRO  58          1HG       PRO  58  -9.915   4.568   6.113
  419   2HG   PRO  58          2HG       PRO  58 -10.024   2.807   6.195
  420   1HD   PRO  58          1HD       PRO  58  -7.638   4.437   6.170
  421   2HD   PRO  58          2HD       PRO  58  -7.750   2.661   6.261
  422    H    LEU  59           H        LEU  59 -10.321   4.687   1.600
  423    HA   LEU  59           HA       LEU  59  -8.507   6.917   0.882
  424   1HB   LEU  59          1HB       LEU  59 -10.689   5.365  -0.269
  425   2HB   LEU  59          2HB       LEU  59 -10.925   7.094  -0.520
  426    HG   LEU  59           HG       LEU  59  -8.375   7.036  -1.189
  427   1HD1  LEU  59          1HD1      LEU  59  -8.965   4.279  -0.745
  428   2HD1  LEU  59          2HD1      LEU  59  -8.694   4.500  -2.473
  429   3HD1  LEU  59          3HD1      LEU  59  -7.457   4.991  -1.319
  430   1HD2  LEU  59          1HD2      LEU  59 -10.531   7.435  -2.602
  431   2HD2  LEU  59          2HD2      LEU  59  -9.048   6.992  -3.447
  432   3HD2  LEU  59          3HD2      LEU  59 -10.290   5.776  -3.149
  433    HA   PRO  60           HA       PRO  60 -10.525  10.229   2.963
  434   1HB   PRO  60          1HB       PRO  60 -11.466  11.578   0.577
  435   2HB   PRO  60          2HB       PRO  60 -10.110  12.008   1.624
  436   1HG   PRO  60          1HG       PRO  60  -9.969  10.939  -1.006
  437   2HG   PRO  60          2HG       PRO  60  -8.626  11.225   0.105
  438   1HD   PRO  60          1HD       PRO  60  -9.744   8.685  -0.732
  439   2HD   PRO  60          2HD       PRO  60  -8.344   8.977   0.330
  440    H    ASN  61           H        ASN  61 -12.766  11.730   2.257
  441    HA   ASN  61           HA       ASN  61 -14.963  10.272   3.164
  442   1HB   ASN  61          1HB       ASN  61 -16.254  12.089   1.861
  443   2HB   ASN  61          2HB       ASN  61 -15.053  12.652   3.025
  444   1HD2  ASN  61          2HD2      ASN  61 -15.238  14.627   1.411
  445   2HD2  ASN  61          1HD2      ASN  61 -14.156  14.615   0.103
  446    H    LYS  62           H        LYS  62 -13.509  10.272   0.000
  447    HA   LYS  62           HA       LYS  62 -15.824   8.837  -1.202
  448   1HB   LYS  62          1HB       LYS  62 -13.168   9.689  -2.398
  449   2HB   LYS  62          2HB       LYS  62 -14.624   9.227  -3.281
  450   1HG   LYS  62          1HG       LYS  62 -15.500  11.238  -1.562
  451   2HG   LYS  62          2HG       LYS  62 -13.919  11.804  -2.106
  452   1HD   LYS  62          1HD       LYS  62 -15.011  10.832  -4.438
  453   2HD   LYS  62          2HD       LYS  62 -16.424  11.502  -3.622
  454   1HE   LYS  62          1HE       LYS  62 -15.137  13.638  -3.270
  455   2HE   LYS  62          2HE       LYS  62 -13.839  12.960  -4.271
  456   1HZ   LYS  62          1HZ       LYS  62 -16.572  12.767  -5.289
  457   2HZ   LYS  62          2HZ       LYS  62 -15.841  14.299  -5.331
  458   3HZ   LYS  62          3HZ       LYS  62 -15.116  12.994  -6.134
  459    H    THR  63           H        THR  63 -14.825   7.241   0.746
  460    HA   THR  63           HA       THR  63 -12.580   5.596   0.140
  461    HB   THR  63           HB       THR  63 -15.104   4.649   1.496
  462    HG1  THR  63           HG1      THR  63 -14.754   5.982   3.130
  463   1HG2  THR  63          1HG2      THR  63 -12.164   4.126   1.674
  464   2HG2  THR  63          2HG2      THR  63 -13.141   3.940   3.130
  465   3HG2  THR  63          3HG2      THR  63 -13.509   2.984   1.694
  466    H    CYS  64           H        CYS  64 -12.680   3.296  -0.612
  467    HA   CYS  64           HA       CYS  64 -14.017   3.019  -3.138
  468   1HB   CYS  64          1HB       CYS  64 -11.876   1.932  -2.243
  469   2HB   CYS  64          2HB       CYS  64 -12.924   0.816  -1.368
  Start of MODEL   39
    1   1H    LYS   1          1H        LYS   1   6.286   6.896   9.532
    2   2H    LYS   1          2H        LYS   1   6.151   7.891   8.162
    3   3H    LYS   1          3H        LYS   1   6.002   8.562   9.712
    4    HA   LYS   1           HA       LYS   1   3.934   7.449  10.094
    5   1HB   LYS   1          1HB       LYS   1   4.444   9.494   8.366
    6   2HB   LYS   1          2HB       LYS   1   3.578   8.384   7.303
    7   1HG   LYS   1          1HG       LYS   1   2.233   8.462   9.835
    8   2HG   LYS   1          2HG       LYS   1   2.481  10.117   9.276
    9   1HD   LYS   1          1HD       LYS   1   1.211   7.872   7.678
   10   2HD   LYS   1          2HD       LYS   1   0.363   9.241   8.396
   11   1HE   LYS   1          1HE       LYS   1   2.658   9.877   6.592
   12   2HE   LYS   1          2HE       LYS   1   1.163   9.293   5.835
   13   1HZ   LYS   1          1HZ       LYS   1   0.207  10.962   7.697
   14   2HZ   LYS   1          2HZ       LYS   1   1.654  11.753   7.289
   15   3HZ   LYS   1          3HZ       LYS   1   0.502  11.414   6.088
   16    H    ASP   2           H        ASP   2   2.694   5.625   9.717
   17    HA   ASP   2           HA       ASP   2   3.519   3.875   7.427
   18   1HB   ASP   2          1HB       ASP   2   1.874   2.710   9.579
   19   2HB   ASP   2          2HB       ASP   2   3.385   2.128   8.890
   20    H    GLY   3           H        GLY   3   1.831   2.895   6.165
   21   1HA   GLY   3          1HA       GLY   3  -0.971   3.423   6.748
   22   2HA   GLY   3          2HA       GLY   3  -0.358   4.421   5.428
   23    H    TYR   4           H        TYR   4  -2.225   2.904   4.488
   24    HA   TYR   4           HA       TYR   4  -0.957   0.384   3.471
   25   1HB   TYR   4          1HB       TYR   4  -3.658   1.224   4.359
   26   2HB   TYR   4          2HB       TYR   4  -3.628   0.183   2.935
   27    HD1  TYR   4           HD1      TYR   4  -2.352  -2.014   3.048
   28    HD2  TYR   4           HD2      TYR   4  -3.234   0.347   6.526
   29    HE1  TYR   4           HE1      TYR   4  -1.923  -3.984   4.493
   30    HE2  TYR   4           HE2      TYR   4  -2.805  -1.624   7.971
   31    HH   TYR   4           HH       TYR   4  -2.781  -4.057   7.800
   32    H    LEU   5           H        LEU   5  -1.160  -0.051   1.190
   33    HA   LEU   5           HA       LEU   5  -1.367   2.388  -0.475
   34   1HB   LEU   5          1HB       LEU   5  -0.632  -0.493  -1.097
   35   2HB   LEU   5          2HB       LEU   5  -0.411   0.878  -2.186
   36    HG   LEU   5           HG       LEU   5   0.741   1.250   0.508
   37   1HD1  LEU   5          1HD1      LEU   5   1.771  -0.868  -1.396
   38   2HD1  LEU   5          2HD1      LEU   5   2.757  -0.149  -0.122
   39   3HD1  LEU   5          3HD1      LEU   5   1.317  -1.078   0.296
   40   1HD2  LEU   5          1HD2      LEU   5   1.150   2.072  -2.262
   41   2HD2  LEU   5          2HD2      LEU   5   1.659   2.871  -0.774
   42   3HD2  LEU   5          3HD2      LEU   5   2.666   1.611  -1.488
   43    H    VAL   6           H        VAL   6  -2.597   2.076  -2.640
   44    HA   VAL   6           HA       VAL   6  -5.088   0.458  -2.194
   45    HB   VAL   6           HB       VAL   6  -6.337   2.363  -3.076
   46   1HG1  VAL   6          1HG1      VAL   6  -4.726   2.434  -0.685
   47   2HG1  VAL   6          2HG1      VAL   6  -4.948   4.069  -1.305
   48   3HG1  VAL   6          3HG1      VAL   6  -6.351   3.066  -0.942
   49   1HG2  VAL   6          1HG2      VAL   6  -4.177   3.017  -4.493
   50   2HG2  VAL   6          2HG2      VAL   6  -5.361   4.238  -4.033
   51   3HG2  VAL   6          3HG2      VAL   6  -3.870   4.063  -3.109
   52    H    GLU   7           H        GLU   7  -6.377   0.538  -4.416
   53    HA   GLU   7           HA       GLU   7  -4.489  -0.409  -6.524
   54   1HB   GLU   7          1HB       GLU   7  -6.474  -1.751  -5.589
   55   2HB   GLU   7          2HB       GLU   7  -7.513  -0.601  -6.429
   56   1HG   GLU   7          1HG       GLU   7  -5.364  -1.629  -8.129
   57   2HG   GLU   7          2HG       GLU   7  -6.428  -2.903  -7.533
   58    H    LYS   8           H        LYS   8  -5.578   0.132  -8.857
   59    HA   LYS   8           HA       LYS   8  -5.234   2.849  -9.412
   60   1HB   LYS   8          1HB       LYS   8  -5.733   0.630 -10.847
   61   2HB   LYS   8          2HB       LYS   8  -7.340   1.358 -10.915
   62   1HG   LYS   8          1HG       LYS   8  -5.131   3.252 -11.389
   63   2HG   LYS   8          2HG       LYS   8  -5.286   1.995 -12.616
   64   1HD   LYS   8          1HD       LYS   8  -7.825   2.577 -12.562
   65   2HD   LYS   8          2HD       LYS   8  -7.302   4.072 -11.785
   66   1HE   LYS   8          1HE       LYS   8  -6.472   3.048 -14.521
   67   2HE   LYS   8          2HE       LYS   8  -7.372   4.532 -14.152
   68   1HZ   LYS   8          1HZ       LYS   8  -5.279   4.852 -12.567
   69   2HZ   LYS   8          2HZ       LYS   8  -4.537   3.949 -13.800
   70   3HZ   LYS   8          3HZ       LYS   8  -5.301   5.418 -14.170
   71    H    THR   9           H        THR   9  -8.375   1.199  -8.879
   72    HA   THR   9           HA       THR   9  -9.873   3.693  -8.832
   73    HB   THR   9           HB       THR   9 -11.566   1.917  -7.803
   74    HG1  THR   9           HG1      THR   9  -9.551   0.517  -7.602
   75   1HG2  THR   9          1HG2      THR   9 -11.565   2.911 -10.114
   76   2HG2  THR   9          2HG2      THR   9 -10.503   1.597 -10.621
   77   3HG2  THR   9          3HG2      THR   9 -12.135   1.243 -10.054
   78    H    GLY  10           H        GLY  10  -7.976   1.995  -6.515
   79   1HA   GLY  10          1HA       GLY  10  -7.449   3.176  -4.403
   80   2HA   GLY  10          2HA       GLY  10  -9.130   3.708  -4.352
   81    H    CYS  11           H        CYS  11  -8.681   0.478  -5.394
   82    HA   CYS  11           HA       CYS  11 -10.008  -0.527  -2.966
   83   1HB   CYS  11          1HB       CYS  11  -8.952  -2.114  -5.314
   84   2HB   CYS  11          2HB       CYS  11 -10.337  -2.483  -4.288
   85    H    LYS  12           H        LYS  12  -8.999  -1.828  -1.395
   86    HA   LYS  12           HA       LYS  12  -6.215  -1.656  -0.934
   87   1HB   LYS  12          1HB       LYS  12  -6.691  -3.615   0.595
   88   2HB   LYS  12          2HB       LYS  12  -7.802  -2.263   0.790
   89   1HG   LYS  12          1HG       LYS  12  -9.398  -3.884   0.576
   90   2HG   LYS  12          2HG       LYS  12  -9.086  -3.678  -1.148
   91   1HD   LYS  12          1HD       LYS  12  -7.087  -5.413  -0.439
   92   2HD   LYS  12          2HD       LYS  12  -8.396  -5.929   0.626
   93   1HE   LYS  12          1HE       LYS  12  -8.455  -5.734  -2.404
   94   2HE   LYS  12          2HE       LYS  12  -8.699  -7.179  -1.401
   95   1HZ   LYS  12          1HZ       LYS  12 -10.497  -5.589  -0.322
   96   2HZ   LYS  12          2HZ       LYS  12 -10.504  -4.935  -1.890
   97   3HZ   LYS  12          3HZ       LYS  12 -10.859  -6.577  -1.656
   98    H    LYS  13           H        LYS  13  -5.145  -4.142  -0.605
   99    HA   LYS  13           HA       LYS  13  -5.491  -5.745  -3.052
  100   1HB   LYS  13          1HB       LYS  13  -3.079  -5.293  -3.706
  101   2HB   LYS  13          2HB       LYS  13  -4.166  -3.917  -3.900
  102   1HG   LYS  13          1HG       LYS  13  -3.417  -2.960  -1.797
  103   2HG   LYS  13          2HG       LYS  13  -2.437  -4.386  -1.455
  104   1HD   LYS  13          1HD       LYS  13  -0.824  -2.974  -2.344
  105   2HD   LYS  13          2HD       LYS  13  -1.358  -3.808  -3.804
  106   1HE   LYS  13          1HE       LYS  13  -3.163  -1.776  -3.747
  107   2HE   LYS  13          2HE       LYS  13  -1.762  -0.979  -3.003
  108   1HZ   LYS  13          1HZ       LYS  13  -0.503  -2.252  -4.893
  109   2HZ   LYS  13          2HZ       LYS  13  -2.015  -2.188  -5.665
  110   3HZ   LYS  13          3HZ       LYS  13  -1.232  -0.753  -5.204
  111    H    THR  14           H        THR  14  -5.908  -7.143  -1.009
  112    HA   THR  14           HA       THR  14  -3.964  -7.893   0.870
  113    HB   THR  14           HB       THR  14  -6.278  -9.173  -0.528
  114    HG1  THR  14           HG1      THR  14  -5.786  -9.257   2.212
  115   1HG2  THR  14          1HG2      THR  14  -4.122 -10.682   0.919
  116   2HG2  THR  14          2HG2      THR  14  -5.800 -11.200   1.084
  117   3HG2  THR  14          3HG2      THR  14  -5.045 -11.151  -0.509
  118    H    CYS  15           H        CYS  15  -2.378  -9.640   0.838
  119    HA   CYS  15           HA       CYS  15  -1.456 -10.392  -1.919
  120   1HB   CYS  15          1HB       CYS  15   0.844 -10.164  -0.941
  121   2HB   CYS  15          2HB       CYS  15  -0.062  -8.649  -0.929
  122    H    TYR  16           H        TYR  16  -0.864 -12.550  -2.170
  123    HA   TYR  16           HA       TYR  16  -1.677 -14.458  -0.123
  124   1HB   TYR  16          1HB       TYR  16  -0.540 -14.455  -2.892
  125   2HB   TYR  16          2HB       TYR  16  -0.415 -15.943  -1.955
  126    HD1  TYR  16           HD1      TYR  16  -3.137 -13.476  -1.554
  127    HD2  TYR  16           HD2      TYR  16  -1.983 -17.249  -3.250
  128    HE1  TYR  16           HE1      TYR  16  -5.514 -13.984  -2.041
  129    HE2  TYR  16           HE2      TYR  16  -4.361 -17.757  -3.739
  130    HH   TYR  16           HH       TYR  16  -6.818 -16.512  -2.387
  131    H    LYS  17           H        LYS  17   1.370 -13.129  -1.310
  132    HA   LYS  17           HA       LYS  17   2.993 -14.924   0.389
  133   1HB   LYS  17          1HB       LYS  17   3.407 -13.965  -2.027
  134   2HB   LYS  17          2HB       LYS  17   3.964 -12.534  -1.160
  135   1HG   LYS  17          1HG       LYS  17   5.731 -13.693  -0.124
  136   2HG   LYS  17          2HG       LYS  17   4.998 -15.268  -0.431
  137   1HD   LYS  17          1HD       LYS  17   6.985 -14.606  -1.929
  138   2HD   LYS  17          2HD       LYS  17   5.535 -15.191  -2.745
  139   1HE   LYS  17          1HE       LYS  17   5.015 -13.107  -3.610
  140   2HE   LYS  17          2HE       LYS  17   5.742 -12.244  -2.241
  141   1HZ   LYS  17          1HZ       LYS  17   7.406 -13.897  -4.029
  142   2HZ   LYS  17          2HZ       LYS  17   7.020 -12.299  -4.458
  143   3HZ   LYS  17          3HZ       LYS  17   7.876 -12.615  -3.024
  144    H    LEU  18           H        LEU  18   2.568 -14.279   2.555
  145    HA   LEU  18           HA       LEU  18   2.459 -11.490   3.371
  146   1HB   LEU  18          1HB       LEU  18   2.847 -14.082   4.905
  147   2HB   LEU  18          2HB       LEU  18   2.416 -12.532   5.626
  148    HG   LEU  18           HG       LEU  18   0.780 -14.018   3.550
  149   1HD1  LEU  18          1HD1      LEU  18   0.577 -13.719   6.545
  150   2HD1  LEU  18          2HD1      LEU  18  -0.846 -14.068   5.564
  151   3HD1  LEU  18          3HD1      LEU  18   0.510 -15.195   5.582
  152   1HD2  LEU  18          1HD2      LEU  18   0.728 -11.278   4.632
  153   2HD2  LEU  18          2HD2      LEU  18  -0.021 -11.923   3.171
  154   3HD2  LEU  18          3HD2      LEU  18  -0.823 -12.113   4.731
  155    H    GLY  19           H        GLY  19   4.045 -10.527   4.903
  156   1HA   GLY  19          1HA       GLY  19   6.255 -10.425   5.886
  157   2HA   GLY  19          2HA       GLY  19   6.772 -11.694   4.781
  158    H    GLU  20           H        GLU  20   8.577 -10.059   4.493
  159    HA   GLU  20           HA       GLU  20   8.330  -7.533   3.299
  160   1HB   GLU  20          1HB       GLU  20  10.373  -8.879   4.114
  161   2HB   GLU  20          2HB       GLU  20  10.381  -9.610   2.508
  162   1HG   GLU  20          1HG       GLU  20  11.369  -7.792   1.630
  163   2HG   GLU  20          2HG       GLU  20  10.101  -6.748   2.275
  164    H    ASN  21           H        ASN  21   6.492  -7.653   1.820
  165    HA   ASN  21           HA       ASN  21   6.601  -9.424  -0.515
  166   1HB   ASN  21          1HB       ASN  21   4.557  -8.552   0.768
  167   2HB   ASN  21          2HB       ASN  21   4.845  -7.006  -0.029
  168   1HD2  ASN  21          2HD2      ASN  21   3.136  -9.887  -0.362
  169   2HD2  ASN  21          1HD2      ASN  21   2.883  -9.846  -2.040
  170    H    ASP  22           H        ASP  22   8.807  -8.566  -1.216
  171    HA   ASP  22           HA       ASP  22   9.508  -6.004  -1.987
  172   1HB   ASP  22          1HB       ASP  22  10.631  -8.354  -2.283
  173   2HB   ASP  22          2HB       ASP  22   9.865  -8.330  -3.871
  174    H    PHE  23           H        PHE  23   7.173  -8.142  -3.555
  175    HA   PHE  23           HA       PHE  23   6.790  -6.825  -6.021
  176   1HB   PHE  23          1HB       PHE  23   5.574  -8.821  -4.422
  177   2HB   PHE  23          2HB       PHE  23   4.294  -7.678  -4.833
  178    HD1  PHE  23           HD1      PHE  23   7.259  -9.279  -6.498
  179    HD2  PHE  23           HD2      PHE  23   3.150  -8.069  -6.817
  180    HE1  PHE  23           HE1      PHE  23   7.165 -10.202  -8.797
  181    HE2  PHE  23           HE2      PHE  23   3.056  -8.992  -9.117
  182    HZ   PHE  23           HZ       PHE  23   5.064 -10.058 -10.107
  183    H    CYS  24           H        CYS  24   4.735  -6.361  -3.111
  184    HA   CYS  24           HA       CYS  24   3.496  -3.963  -4.069
  185   1HB   CYS  24          1HB       CYS  24   3.806  -5.455  -1.502
  186   2HB   CYS  24          2HB       CYS  24   3.238  -3.788  -1.397
  187    H    ASN  25           H        ASN  25   6.422  -4.552  -2.142
  188    HA   ASN  25           HA       ASN  25   6.989  -1.914  -1.287
  189   1HB   ASN  25          1HB       ASN  25   8.514  -4.399  -1.960
  190   2HB   ASN  25          2HB       ASN  25   9.441  -2.914  -1.741
  191   1HD2  ASN  25          2HD2      ASN  25  10.273  -4.149   0.259
  192   2HD2  ASN  25          1HD2      ASN  25   9.356  -4.042   1.683
  193    H    ARG  26           H        ARG  26   7.878  -3.558  -4.333
  194    HA   ARG  26           HA       ARG  26   9.274  -1.418  -5.570
  195   1HB   ARG  26          1HB       ARG  26   8.189  -3.999  -6.185
  196   2HB   ARG  26          2HB       ARG  26   7.744  -2.892  -7.484
  197   1HG   ARG  26          1HG       ARG  26  10.315  -2.156  -7.151
  198   2HG   ARG  26          2HG       ARG  26  10.434  -3.842  -6.645
  199   1HD   ARG  26          1HD       ARG  26   8.852  -3.972  -8.926
  200   2HD   ARG  26          2HD       ARG  26  10.058  -2.739  -9.333
  201    HE   ARG  26           HE       ARG  26  10.556  -5.551  -9.115
  202   1HH1  ARG  26          1HH1      ARG  26  11.891  -2.531  -8.057
  203   2HH1  ARG  26          2HH1      ARG  26  13.441  -3.211  -7.706
  204   1HH2  ARG  26          1HH2      ARG  26  12.575  -6.414  -8.684
  205   2HH2  ARG  26          2HH2      ARG  26  13.831  -5.394  -8.066
  206    H    GLU  27           H        GLU  27   5.836  -2.363  -6.061
  207    HA   GLU  27           HA       GLU  27   5.106  -0.034  -7.559
  208   1HB   GLU  27          1HB       GLU  27   3.939  -2.343  -7.126
  209   2HB   GLU  27          2HB       GLU  27   3.242  -1.532  -5.724
  210   1HG   GLU  27          1HG       GLU  27   2.127   0.073  -7.062
  211   2HG   GLU  27          2HG       GLU  27   3.113  -0.301  -8.476
  212    H    CYS  28           H        CYS  28   5.019  -0.750  -4.077
  213    HA   CYS  28           HA       CYS  28   3.616   1.488  -3.114
  214   1HB   CYS  28          1HB       CYS  28   4.243  -0.291  -1.655
  215   2HB   CYS  28          2HB       CYS  28   5.947  -0.142  -2.086
  216    H    LYS  29           H        LYS  29   7.076   1.213  -3.968
  217    HA   LYS  29           HA       LYS  29   7.289   4.192  -3.682
  218   1HB   LYS  29          1HB       LYS  29   9.770   3.597  -3.449
  219   2HB   LYS  29          2HB       LYS  29   8.725   3.066  -2.131
  220   1HG   LYS  29          1HG       LYS  29   9.037   0.867  -2.609
  221   2HG   LYS  29          2HG       LYS  29   8.949   1.137  -4.351
  222   1HD   LYS  29          1HD       LYS  29  11.315   2.401  -3.609
  223   2HD   LYS  29          2HD       LYS  29  11.298   0.937  -2.625
  224   1HE   LYS  29          1HE       LYS  29  10.476  -0.031  -5.071
  225   2HE   LYS  29          2HE       LYS  29  11.645   1.219  -5.538
  226   1HZ   LYS  29          1HZ       LYS  29  12.806   0.078  -3.376
  227   2HZ   LYS  29          2HZ       LYS  29  12.086  -1.260  -4.135
  228   3HZ   LYS  29          3HZ       LYS  29  13.185  -0.294  -4.990
  229    H    TRP  30           H        TRP  30   6.262   2.957  -6.097
  230    HA   TRP  30           HA       TRP  30   8.431   2.761  -8.039
  231   1HB   TRP  30          1HB       TRP  30   6.449   2.717  -9.627
  232   2HB   TRP  30          2HB       TRP  30   6.478   1.463  -8.398
  233    HD1  TRP  30           HD1      TRP  30   3.803   1.475  -9.130
  234    HE1  TRP  30           HE1      TRP  30   1.843   2.698  -8.008
  235    HE3  TRP  30           HE3      TRP  30   6.333   5.137  -6.538
  236    HZ2  TRP  30           HZ2      TRP  30   1.387   4.899  -6.271
  237    HZ3  TRP  30           HZ3      TRP  30   5.087   6.766  -5.177
  238    HH2  TRP  30           HH2      TRP  30   2.619   6.654  -5.033
  239    H    LYS  31           H        LYS  31   8.751   5.208  -6.789
  240    HA   LYS  31           HA       LYS  31   8.975   7.065  -8.901
  241   1HB   LYS  31          1HB       LYS  31   6.304   6.648  -8.019
  242   2HB   LYS  31          2HB       LYS  31   6.783   8.246  -7.446
  243   1HG   LYS  31          1HG       LYS  31   7.788   8.038 -10.076
  244   2HG   LYS  31          2HG       LYS  31   6.143   7.405 -10.136
  245   1HD   LYS  31          1HD       LYS  31   6.247   9.775  -8.478
  246   2HD   LYS  31          2HD       LYS  31   6.910  10.114 -10.077
  247   1HE   LYS  31          1HE       LYS  31   4.672  10.433 -10.573
  248   2HE   LYS  31          2HE       LYS  31   4.726   8.673 -10.796
  249   1HZ   LYS  31          1HZ       LYS  31   4.458   9.516  -8.048
  250   2HZ   LYS  31          2HZ       LYS  31   3.134   9.938  -9.021
  251   3HZ   LYS  31          3HZ       LYS  31   3.614   8.314  -8.901
  252    H    HIS  32           H        HIS  32   8.734   9.503  -7.693
  253    HA   HIS  32           HA       HIS  32  10.620   9.260  -5.411
  254   1HB   HIS  32          1HB       HIS  32   9.638  11.576  -7.109
  255   2HB   HIS  32          2HB       HIS  32  10.864  11.719  -5.848
  256    HD1  HIS  32           HD1      HIS  32  12.025   8.748  -6.692
  257    HD2  HIS  32           HD2      HIS  32  11.670  12.144  -9.084
  258    HE1  HIS  32           HE1      HIS  32  13.689   8.471  -8.582
  259    H    ILE  33           H        ILE  33   9.101   8.629  -3.736
  260    HA   ILE  33           HA       ILE  33   7.282  10.856  -2.874
  261    HB   ILE  33           HB       ILE  33   6.904   7.861  -3.012
  262   1HG1  ILE  33          1HG1      ILE  33   6.230   9.408  -4.908
  263   2HG1  ILE  33          2HG1      ILE  33   4.911   8.445  -4.237
  264   1HG2  ILE  33          1HG2      ILE  33   6.295   8.631  -0.726
  265   2HG2  ILE  33          2HG2      ILE  33   5.217   9.831  -1.437
  266   3HG2  ILE  33          3HG2      ILE  33   4.883   8.113  -1.647
  267   1HD1  ILE  33          1HD1      ILE  33   5.547  11.308  -3.463
  268   2HD1  ILE  33          2HD1      ILE  33   4.245  10.813  -4.546
  269   3HD1  ILE  33          3HD1      ILE  33   4.206  10.342  -2.847
  270    H    GLY  34           H        GLY  34   9.102   7.969  -1.821
  271   1HA   GLY  34          1HA       GLY  34  10.462   9.212   0.315
  272   2HA   GLY  34          2HA       GLY  34   8.977   8.539   0.986
  273    H    GLY  35           H        GLY  35   8.594   6.212   0.600
  274   1HA   GLY  35          1HA       GLY  35   9.283   3.968   0.502
  275   2HA   GLY  35          2HA       GLY  35  10.704   4.510  -0.387
  276    H    SER  36           H        SER  36   9.366   4.217   2.882
  277    HA   SER  36           HA       SER  36  12.144   4.367   3.984
  278   1HB   SER  36          1HB       SER  36  11.132   5.606   5.584
  279   2HB   SER  36          2HB       SER  36   9.615   5.452   4.704
  280    HG   SER  36           HG       SER  36  10.673   3.674   6.653
  281    H    TYR  37           H        TYR  37   9.126   2.475   4.136
  282    HA   TYR  37           HA       TYR  37  10.630  -0.030   4.425
  283   1HB   TYR  37          1HB       TYR  37  10.147   1.415   6.704
  284   2HB   TYR  37          2HB       TYR  37   8.713   0.389   6.640
  285    HD1  TYR  37           HD1      TYR  37   9.019  -2.126   6.376
  286    HD2  TYR  37           HD2      TYR  37  12.250   0.532   7.347
  287    HE1  TYR  37           HE1      TYR  37  10.355  -4.049   7.191
  288    HE2  TYR  37           HE2      TYR  37  13.587  -1.391   8.161
  289    HH   TYR  37           HH       TYR  37  13.316  -4.249   7.441
  290    H    GLY  38           H        GLY  38   9.389  -1.660   3.514
  291   1HA   GLY  38          1HA       GLY  38   6.436  -1.286   3.440
  292   2HA   GLY  38          2HA       GLY  38   7.296  -1.581   1.929
  293    H    TYR  39           H        TYR  39   5.330  -3.162   3.753
  294    HA   TYR  39           HA       TYR  39   6.405  -5.791   3.114
  295   1HB   TYR  39          1HB       TYR  39   6.891  -6.518   5.334
  296   2HB   TYR  39          2HB       TYR  39   7.630  -4.922   5.216
  297    HD1  TYR  39           HD1      TYR  39   6.534  -2.948   6.244
  298    HD2  TYR  39           HD2      TYR  39   4.991  -6.922   6.766
  299    HE1  TYR  39           HE1      TYR  39   5.145  -2.156   8.141
  300    HE2  TYR  39           HE2      TYR  39   3.599  -6.132   8.663
  301    HH   TYR  39           HH       TYR  39   3.982  -3.825  10.390
  302    H    CYS  40           H        CYS  40   4.723  -7.376   3.289
  303    HA   CYS  40           HA       CYS  40   2.014  -6.272   3.465
  304   1HB   CYS  40          1HB       CYS  40   3.378  -8.411   2.221
  305   2HB   CYS  40          2HB       CYS  40   2.178  -9.148   3.283
  306    H    TYR  41           H        TYR  41   0.442  -6.845   5.016
  307    HA   TYR  41           HA       TYR  41   1.265  -8.553   7.312
  308   1HB   TYR  41          1HB       TYR  41   1.931  -6.196   7.768
  309   2HB   TYR  41          2HB       TYR  41   0.259  -5.694   7.517
  310    HD1  TYR  41           HD1      TYR  41   1.513  -8.778   9.202
  311    HD2  TYR  41           HD2      TYR  41  -0.426  -4.973   9.665
  312    HE1  TYR  41           HE1      TYR  41   0.988  -9.333  11.562
  313    HE2  TYR  41           HE2      TYR  41  -0.952  -5.528  12.025
  314    HH   TYR  41           HH       TYR  41   0.300  -8.457  13.545
  315    H    GLY  42           H        GLY  42  -0.492  -9.731   8.060
  316   1HA   GLY  42          1HA       GLY  42  -2.679 -10.602   8.037
  317   2HA   GLY  42          2HA       GLY  42  -3.165  -8.917   8.234
  318    H    PHE  43           H        PHE  43  -1.552 -10.536   5.499
  319    HA   PHE  43           HA       PHE  43  -2.155 -10.616   3.220
  320   1HB   PHE  43          1HB       PHE  43  -4.875 -10.582   4.570
  321   2HB   PHE  43          2HB       PHE  43  -4.594 -11.042   2.890
  322    HD1  PHE  43           HD1      PHE  43  -2.556 -12.801   2.612
  323    HD2  PHE  43           HD2      PHE  43  -4.991 -12.318   6.118
  324    HE1  PHE  43           HE1      PHE  43  -1.973 -15.100   3.334
  325    HE2  PHE  43           HE2      PHE  43  -4.409 -14.618   6.839
  326    HZ   PHE  43           HZ       PHE  43  -2.899 -16.009   5.448
  327    H    GLY  44           H        GLY  44  -1.334  -8.156   3.723
  328   1HA   GLY  44          1HA       GLY  44  -2.916  -6.472   1.992
  329   2HA   GLY  44          2HA       GLY  44  -3.057  -5.955   3.673
  330    H    CYS  45           H        CYS  45  -1.426  -5.187   0.995
  331    HA   CYS  45           HA       CYS  45   1.329  -5.143   1.860
  332   1HB   CYS  45          1HB       CYS  45  -0.267  -3.626  -0.222
  333   2HB   CYS  45          2HB       CYS  45   1.491  -3.556  -0.097
  334    H    TYR  46           H        TYR  46   2.215  -3.806   3.352
  335    HA   TYR  46           HA       TYR  46   0.826  -1.224   3.991
  336   1HB   TYR  46          1HB       TYR  46   1.093  -3.269   5.633
  337   2HB   TYR  46          2HB       TYR  46   2.746  -2.679   5.792
  338    HD1  TYR  46           HD1      TYR  46  -0.550  -0.923   5.413
  339    HD2  TYR  46           HD2      TYR  46   2.969  -1.522   7.805
  340    HE1  TYR  46           HE1      TYR  46  -1.324   0.827   6.992
  341    HE2  TYR  46           HE2      TYR  46   2.194   0.225   9.383
  342    HH   TYR  46           HH       TYR  46  -1.003   1.629   9.150
  343    H    CYS  47           H        CYS  47   2.239   0.628   4.343
  344    HA   CYS  47           HA       CYS  47   5.123   0.257   3.710
  345   1HB   CYS  47          1HB       CYS  47   3.039   1.313   1.948
  346   2HB   CYS  47          2HB       CYS  47   4.375   2.445   2.165
  347    H    GLU  48           H        GLU  48   6.421   2.022   4.446
  348    HA   GLU  48           HA       GLU  48   4.987   3.971   6.224
  349   1HB   GLU  48          1HB       GLU  48   7.371   2.220   6.484
  350   2HB   GLU  48          2HB       GLU  48   7.524   3.829   7.189
  351   1HG   GLU  48          1HG       GLU  48   5.377   3.453   8.410
  352   2HG   GLU  48          2HG       GLU  48   5.348   1.804   7.784
  353    H    GLY  49           H        GLY  49   6.025   6.111   6.384
  354   1HA   GLY  49          1HA       GLY  49   7.389   7.896   5.586
  355   2HA   GLY  49          2HA       GLY  49   8.093   6.792   4.404
  356    H    LEU  50           H        LEU  50   4.645   7.338   4.922
  357    HA   LEU  50           HA       LEU  50   4.378   8.077   2.056
  358   1HB   LEU  50          1HB       LEU  50   2.206   7.607   4.107
  359   2HB   LEU  50          2HB       LEU  50   2.109   7.406   2.357
  360    HG   LEU  50           HG       LEU  50   3.825   5.738   4.220
  361   1HD1  LEU  50          1HD1      LEU  50   1.101   5.576   3.853
  362   2HD1  LEU  50          2HD1      LEU  50   1.705   4.457   2.632
  363   3HD1  LEU  50          3HD1      LEU  50   2.135   4.228   4.327
  364   1HD2  LEU  50          1HD2      LEU  50   4.583   6.197   1.785
  365   2HD2  LEU  50          2HD2      LEU  50   4.492   4.515   2.307
  366   3HD2  LEU  50          3HD2      LEU  50   3.205   5.201   1.315
  367    HA   PRO  51           HA       PRO  51   4.392  12.369   3.580
  368   1HB   PRO  51          1HB       PRO  51   3.601  12.986   0.837
  369   2HB   PRO  51          2HB       PRO  51   5.090  13.414   1.687
  370   1HG   PRO  51          1HG       PRO  51   4.797  11.460  -0.349
  371   2HG   PRO  51          2HG       PRO  51   6.233  11.759   0.635
  372   1HD   PRO  51          1HD       PRO  51   4.465   9.474   0.721
  373   2HD   PRO  51          2HD       PRO  51   5.920   9.770   1.705
  374    H    ASP  52           H        ASP  52   2.650  13.912   3.893
  375    HA   ASP  52           HA       ASP  52   0.038  12.810   4.224
  376   1HB   ASP  52          1HB       ASP  52   1.433  15.400   4.439
  377   2HB   ASP  52          2HB       ASP  52  -0.296  15.541   4.118
  378    H    SER  53           H        SER  53   1.526  14.544   1.531
  379    HA   SER  53           HA       SER  53  -1.024  14.923   0.120
  380   1HB   SER  53          1HB       SER  53   1.036  15.402  -1.651
  381   2HB   SER  53          2HB       SER  53   0.366  16.595  -0.543
  382    HG   SER  53           HG       SER  53   2.142  16.505   0.571
  383    H    THR  54           H        THR  54   0.315  12.127   0.769
  384    HA   THR  54           HA       THR  54   0.479  11.061  -2.011
  385    HB   THR  54           HB       THR  54   0.940   9.546   0.556
  386    HG1  THR  54           HG1      THR  54   2.396  11.649  -0.531
  387   1HG2  THR  54          1HG2      THR  54   2.187   9.459  -2.205
  388   2HG2  THR  54          2HG2      THR  54   2.629   8.410  -0.857
  389   3HG2  THR  54          3HG2      THR  54   1.015   8.310  -1.560
  390    H    GLN  55           H        GLN  55  -0.810   9.168  -2.583
  391    HA   GLN  55           HA       GLN  55  -3.507   9.187  -1.386
  392   1HB   GLN  55          1HB       GLN  55  -2.184   8.460  -3.867
  393   2HB   GLN  55          2HB       GLN  55  -3.234   7.152  -3.324
  394   1HG   GLN  55          1HG       GLN  55  -4.537   9.713  -2.963
  395   2HG   GLN  55          2HG       GLN  55  -4.024   9.510  -4.638
  396   1HE2  GLN  55          2HE2      GLN  55  -4.891   6.794  -2.501
  397   2HE2  GLN  55          1HE2      GLN  55  -6.286   6.347  -3.359
  398    H    THR  56           H        THR  56  -4.334   7.498  -0.086
  399    HA   THR  56           HA       THR  56  -2.757   5.002   0.187
  400    HB   THR  56           HB       THR  56  -3.171   5.718   2.808
  401    HG1  THR  56           HG1      THR  56  -3.123   7.803   2.995
  402   1HG2  THR  56          1HG2      THR  56  -1.098   4.840   1.607
  403   2HG2  THR  56          2HG2      THR  56  -0.724   6.522   1.233
  404   3HG2  THR  56          3HG2      THR  56  -0.802   5.988   2.912
  405    H    TRP  57           H        TRP  57  -3.908   3.528   1.830
  406    HA   TRP  57           HA       TRP  57  -6.835   3.585   1.300
  407   1HB   TRP  57          1HB       TRP  57  -5.073   1.651   0.970
  408   2HB   TRP  57          2HB       TRP  57  -5.270   1.426   2.705
  409    HD1  TRP  57           HD1      TRP  57  -7.575   1.782  -0.391
  410    HE1  TRP  57           HE1      TRP  57  -9.570   0.182  -0.083
  411    HE3  TRP  57           HE3      TRP  57  -6.467  -0.135   4.209
  412    HZ2  TRP  57           HZ2      TRP  57 -10.567  -1.667   1.857
  413    HZ3  TRP  57           HZ3      TRP  57  -7.953  -1.813   5.263
  414    HH2  TRP  57           HH2      TRP  57 -10.001  -2.582   4.094
  415    HA   PRO  58           HA       PRO  58  -8.554   2.652   2.061
  416   1HB   PRO  58          1HB       PRO  58 -10.756   3.943   3.279
  417   2HB   PRO  58          2HB       PRO  58 -10.326   2.235   3.410
  418   1HG   PRO  58          1HG       PRO  58 -10.185   4.260   5.454
  419   2HG   PRO  58          2HG       PRO  58  -9.808   2.541   5.593
  420   1HD   PRO  58          1HD       PRO  58  -7.962   4.790   5.483
  421   2HD   PRO  58          2HD       PRO  58  -7.597   3.068   5.763
  422    H    LEU  59           H        LEU  59 -10.203   3.919   0.677
  423    HA   LEU  59           HA       LEU  59  -8.998   6.383  -0.271
  424   1HB   LEU  59          1HB       LEU  59 -11.387   4.660  -0.875
  425   2HB   LEU  59          2HB       LEU  59 -11.264   6.247  -1.630
  426    HG   LEU  59           HG       LEU  59 -10.257   4.214  -2.893
  427   1HD1  LEU  59          1HD1      LEU  59  -9.836   6.796  -3.164
  428   2HD1  LEU  59          2HD1      LEU  59  -8.254   6.413  -2.487
  429   3HD1  LEU  59          3HD1      LEU  59  -8.781   5.649  -3.986
  430   1HD2  LEU  59          1HD2      LEU  59  -9.053   3.413  -0.789
  431   2HD2  LEU  59          2HD2      LEU  59  -8.055   3.516  -2.240
  432   3HD2  LEU  59          3HD2      LEU  59  -7.951   4.773  -1.009
  433    HA   PRO  60           HA       PRO  60 -11.163   9.562   1.863
  434   1HB   PRO  60          1HB       PRO  60 -12.437  10.668  -0.491
  435   2HB   PRO  60          2HB       PRO  60 -11.054  11.295   0.410
  436   1HG   PRO  60          1HG       PRO  60 -11.030  10.068  -2.167
  437   2HG   PRO  60          2HG       PRO  60  -9.641  10.616  -1.223
  438   1HD   PRO  60          1HD       PRO  60 -10.431   7.902  -1.792
  439   2HD   PRO  60          2HD       PRO  60  -9.038   8.453  -0.831
  440    H    ASN  61           H        ASN  61 -13.625  10.751   1.280
  441    HA   ASN  61           HA       ASN  61 -15.543   9.106   2.449
  442   1HB   ASN  61          1HB       ASN  61 -15.680  11.361   0.440
  443   2HB   ASN  61          2HB       ASN  61 -17.148  10.640   1.103
  444   1HD2  ASN  61          2HD2      ASN  61 -17.242  10.595   3.597
  445   2HD2  ASN  61          1HD2      ASN  61 -16.545  11.901   4.428
  446    H    LYS  62           H        LYS  62 -14.380   9.101  -0.841
  447    HA   LYS  62           HA       LYS  62 -16.543   7.258  -1.728
  448   1HB   LYS  62          1HB       LYS  62 -15.787   9.207  -3.103
  449   2HB   LYS  62          2HB       LYS  62 -14.185   8.476  -3.204
  450   1HG   LYS  62          1HG       LYS  62 -14.949   7.437  -5.063
  451   2HG   LYS  62          2HG       LYS  62 -15.852   6.400  -3.960
  452   1HD   LYS  62          1HD       LYS  62 -17.848   7.466  -4.367
  453   2HD   LYS  62          2HD       LYS  62 -17.078   9.028  -4.649
  454   1HE   LYS  62          1HE       LYS  62 -16.099   7.875  -6.795
  455   2HE   LYS  62          2HE       LYS  62 -17.434   6.729  -6.562
  456   1HZ   LYS  62          1HZ       LYS  62 -18.951   8.629  -6.377
  457   2HZ   LYS  62          2HZ       LYS  62 -17.669   9.689  -6.708
  458   3HZ   LYS  62          3HZ       LYS  62 -18.184   8.585  -7.892
  459    H    THR  63           H        THR  63 -16.162   5.139  -1.177
  460    HA   THR  63           HA       THR  63 -13.484   4.074  -0.729
  461    HB   THR  63           HB       THR  63 -15.470   3.323   0.508
  462    HG1  THR  63           HG1      THR  63 -13.845   1.803   0.211
  463   1HG2  THR  63          1HG2      THR  63 -16.802   3.555  -1.853
  464   2HG2  THR  63          2HG2      THR  63 -16.566   1.810  -1.785
  465   3HG2  THR  63          3HG2      THR  63 -17.410   2.637  -0.476
  466    H    CYS  64           H        CYS  64 -13.475   1.611  -1.876
  467    HA   CYS  64           HA       CYS  64 -12.646   2.098  -4.587
  468   1HB   CYS  64          1HB       CYS  64 -11.627   0.327  -3.393
  469   2HB   CYS  64          2HB       CYS  64 -13.174  -0.309  -2.840
  Start of MODEL   40
    1   1H    LYS   1          1H        LYS   1   4.580   5.981  11.170
    2   2H    LYS   1          2H        LYS   1   4.051   7.398  11.944
    3   3H    LYS   1          3H        LYS   1   3.792   5.883  12.669
    4    HA   LYS   1           HA       LYS   1   1.721   6.189  11.783
    5   1HB   LYS   1          1HB       LYS   1   1.410   7.622   9.811
    6   2HB   LYS   1          2HB       LYS   1   2.463   8.428  10.975
    7   1HG   LYS   1          1HG       LYS   1   4.104   6.806   9.294
    8   2HG   LYS   1          2HG       LYS   1   3.034   7.749   8.257
    9   1HD   LYS   1          1HD       LYS   1   3.687   9.794   9.592
   10   2HD   LYS   1          2HD       LYS   1   4.906   8.800  10.393
   11   1HE   LYS   1          1HE       LYS   1   5.326   8.250   7.699
   12   2HE   LYS   1          2HE       LYS   1   4.970   9.989   7.717
   13   1HZ   LYS   1          1HZ       LYS   1   6.856   8.645   9.578
   14   2HZ   LYS   1          2HZ       LYS   1   7.333   9.480   8.177
   15   3HZ   LYS   1          3HZ       LYS   1   6.572  10.312   9.449
   16    H    ASP   2           H        ASP   2   0.589   4.778  10.368
   17    HA   ASP   2           HA       ASP   2   2.174   3.320   8.304
   18   1HB   ASP   2          1HB       ASP   2   0.570   2.053  10.551
   19   2HB   ASP   2          2HB       ASP   2   1.453   1.185   9.295
   20    H    GLY   3           H        GLY   3   0.775   2.227   6.737
   21   1HA   GLY   3          1HA       GLY   3  -2.120   2.460   6.956
   22   2HA   GLY   3          2HA       GLY   3  -1.435   3.622   5.821
   23    H    TYR   4           H        TYR   4  -3.031   2.046   4.550
   24    HA   TYR   4           HA       TYR   4  -1.448  -0.259   3.470
   25   1HB   TYR   4          1HB       TYR   4  -4.265   0.273   4.126
   26   2HB   TYR   4          2HB       TYR   4  -4.047  -0.443   2.529
   27    HD1  TYR   4           HD1      TYR   4  -2.216  -2.411   2.483
   28    HD2  TYR   4           HD2      TYR   4  -4.490  -1.201   5.919
   29    HE1  TYR   4           HE1      TYR   4  -1.854  -4.641   3.505
   30    HE2  TYR   4           HE2      TYR   4  -4.125  -3.431   6.944
   31    HH   TYR   4           HH       TYR   4  -2.135  -5.899   5.318
   32    H    LEU   5           H        LEU   5  -1.942  -0.599   1.027
   33    HA   LEU   5           HA       LEU   5  -1.700   2.049  -0.331
   34   1HB   LEU   5          1HB       LEU   5  -0.443  -0.518  -0.499
   35   2HB   LEU   5          2HB       LEU   5  -1.215  -0.179  -2.048
   36    HG   LEU   5           HG       LEU   5   0.703   1.658  -0.581
   37   1HD1  LEU   5          1HD1      LEU   5   1.077  -0.522  -2.442
   38   2HD1  LEU   5          2HD1      LEU   5   1.613   0.993  -3.168
   39   3HD1  LEU   5          3HD1      LEU   5   2.296   0.461  -1.631
   40   1HD2  LEU   5          1HD2      LEU   5  -1.077   2.836  -1.890
   41   2HD2  LEU   5          2HD2      LEU   5   0.534   3.080  -2.563
   42   3HD2  LEU   5          3HD2      LEU   5  -0.574   1.938  -3.321
   43    H    VAL   6           H        VAL   6  -3.043   2.529  -2.143
   44    HA   VAL   6           HA       VAL   6  -5.494   0.815  -2.365
   45    HB   VAL   6           HB       VAL   6  -6.650   2.872  -2.900
   46   1HG1  VAL   6          1HG1      VAL   6  -4.711   3.072  -0.596
   47   2HG1  VAL   6          2HG1      VAL   6  -5.919   4.321  -0.897
   48   3HG1  VAL   6          3HG1      VAL   6  -6.426   2.669  -0.553
   49   1HG2  VAL   6          1HG2      VAL   6  -3.855   4.031  -3.043
   50   2HG2  VAL   6          2HG2      VAL   6  -5.055   3.957  -4.333
   51   3HG2  VAL   6          3HG2      VAL   6  -5.304   5.031  -2.956
   52    H    GLU   7           H        GLU   7  -6.530   1.778  -4.694
   53    HA   GLU   7           HA       GLU   7  -4.444   1.579  -6.807
   54   1HB   GLU   7          1HB       GLU   7  -6.175  -0.535  -5.874
   55   2HB   GLU   7          2HB       GLU   7  -6.578  -0.143  -7.544
   56   1HG   GLU   7          1HG       GLU   7  -3.729  -0.574  -6.630
   57   2HG   GLU   7          2HG       GLU   7  -4.744  -1.897  -7.208
   58    H    LYS   8           H        LYS   8  -5.467   2.067  -8.996
   59    HA   LYS   8           HA       LYS   8  -6.937   4.426  -9.077
   60   1HB   LYS   8          1HB       LYS   8  -5.805   2.868 -10.896
   61   2HB   LYS   8          2HB       LYS   8  -7.452   2.271 -11.105
   62   1HG   LYS   8          1HG       LYS   8  -8.138   4.179 -12.117
   63   2HG   LYS   8          2HG       LYS   8  -7.281   5.201 -10.962
   64   1HD   LYS   8          1HD       LYS   8  -5.132   4.404 -12.189
   65   2HD   LYS   8          2HD       LYS   8  -6.233   3.923 -13.481
   66   1HE   LYS   8          1HE       LYS   8  -5.773   6.707 -12.373
   67   2HE   LYS   8          2HE       LYS   8  -5.619   6.152 -14.052
   68   1HZ   LYS   8          1HZ       LYS   8  -8.078   5.422 -13.666
   69   2HZ   LYS   8          2HZ       LYS   8  -8.049   6.628 -12.471
   70   3HZ   LYS   8          3HZ       LYS   8  -7.724   7.030 -14.087
   71    H    THR   9           H        THR   9  -8.130   1.137  -8.622
   72    HA   THR   9           HA       THR   9 -10.959   1.925  -8.871
   73    HB   THR   9           HB       THR   9 -11.140  -0.533  -8.005
   74    HG1  THR   9           HG1      THR   9  -8.883  -1.413  -8.752
   75   1HG2  THR   9          1HG2      THR   9 -11.091   0.472 -10.460
   76   2HG2  THR   9          2HG2      THR   9  -9.548  -0.379 -10.534
   77   3HG2  THR   9          3HG2      THR   9 -11.032  -1.271 -10.196
   78    H    GLY  10           H        GLY  10  -8.538   1.607  -6.389
   79   1HA   GLY  10          1HA       GLY  10  -8.828   2.725  -4.239
   80   2HA   GLY  10          2HA       GLY  10 -10.557   2.404  -4.345
   81    H    CYS  11           H        CYS  11  -9.568  -0.393  -5.414
   82    HA   CYS  11           HA       CYS  11  -9.800  -1.725  -2.822
   83   1HB   CYS  11          1HB       CYS  11  -9.043  -2.946  -5.487
   84   2HB   CYS  11          2HB       CYS  11  -9.924  -3.701  -4.160
   85    H    LYS  12           H        LYS  12  -8.096  -2.547  -1.604
   86    HA   LYS  12           HA       LYS  12  -5.467  -1.635  -1.836
   87   1HB   LYS  12          1HB       LYS  12  -4.945  -3.516  -0.327
   88   2HB   LYS  12          2HB       LYS  12  -6.474  -2.770   0.117
   89   1HG   LYS  12          1HG       LYS  12  -7.461  -4.578  -1.557
   90   2HG   LYS  12          2HG       LYS  12  -5.964  -5.424  -1.165
   91   1HD   LYS  12          1HD       LYS  12  -6.726  -4.690   1.322
   92   2HD   LYS  12          2HD       LYS  12  -8.310  -4.835   0.559
   93   1HE   LYS  12          1HE       LYS  12  -7.367  -7.119  -0.352
   94   2HE   LYS  12          2HE       LYS  12  -6.229  -6.964   1.002
   95   1HZ   LYS  12          1HZ       LYS  12  -9.116  -6.474   1.380
   96   2HZ   LYS  12          2HZ       LYS  12  -8.493  -8.053   1.459
   97   3HZ   LYS  12          3HZ       LYS  12  -7.945  -6.866   2.544
   98    H    LYS  13           H        LYS  13  -3.621  -3.494  -1.992
   99    HA   LYS  13           HA       LYS  13  -3.923  -4.680  -4.731
  100   1HB   LYS  13          1HB       LYS  13  -2.178  -2.795  -3.926
  101   2HB   LYS  13          2HB       LYS  13  -1.260  -4.227  -3.458
  102   1HG   LYS  13          1HG       LYS  13  -0.746  -4.690  -5.602
  103   2HG   LYS  13          2HG       LYS  13  -2.437  -4.563  -6.091
  104   1HD   LYS  13          1HD       LYS  13  -1.570  -2.784  -7.280
  105   2HD   LYS  13          2HD       LYS  13  -1.953  -1.960  -5.769
  106   1HE   LYS  13          1HE       LYS  13   0.239  -1.532  -5.366
  107   2HE   LYS  13          2HE       LYS  13   0.681  -3.224  -5.664
  108   1HZ   LYS  13          1HZ       LYS  13  -0.162  -1.615  -7.952
  109   2HZ   LYS  13          2HZ       LYS  13   1.385  -1.311  -7.319
  110   3HZ   LYS  13          3HZ       LYS  13   0.982  -2.865  -7.875
  111    H    THR  14           H        THR  14  -5.008  -6.359  -3.072
  112    HA   THR  14           HA       THR  14  -3.771  -8.005  -1.274
  113    HB   THR  14           HB       THR  14  -5.469  -8.714  -3.686
  114    HG1  THR  14           HG1      THR  14  -6.928  -7.844  -2.485
  115   1HG2  THR  14          1HG2      THR  14  -4.202 -10.676  -2.701
  116   2HG2  THR  14          2HG2      THR  14  -5.063 -10.375  -1.192
  117   3HG2  THR  14          3HG2      THR  14  -5.958 -10.819  -2.644
  118    H    CYS  15           H        CYS  15  -2.038  -9.404  -1.265
  119    HA   CYS  15           HA       CYS  15  -0.765 -10.073  -3.900
  120   1HB   CYS  15          1HB       CYS  15   1.360  -9.654  -2.868
  121   2HB   CYS  15          2HB       CYS  15   0.326  -8.297  -2.425
  122    H    TYR  16           H        TYR  16   1.028 -11.901  -3.260
  123    HA   TYR  16           HA       TYR  16  -0.506 -14.030  -1.810
  124   1HB   TYR  16          1HB       TYR  16   1.091 -13.861  -4.310
  125   2HB   TYR  16          2HB       TYR  16   1.298 -15.340  -3.369
  126    HD1  TYR  16           HD1      TYR  16  -1.346 -15.686  -2.139
  127    HD2  TYR  16           HD2      TYR  16  -0.304 -14.452  -6.119
  128    HE1  TYR  16           HE1      TYR  16  -3.529 -16.520  -2.968
  129    HE2  TYR  16           HE2      TYR  16  -2.487 -15.286  -6.948
  130    HH   TYR  16           HH       TYR  16  -4.743 -16.983  -4.794
  131    H    LYS  17           H        LYS  17   2.760 -12.724  -2.428
  132    HA   LYS  17           HA       LYS  17   3.980 -14.386  -0.341
  133   1HB   LYS  17          1HB       LYS  17   4.900 -12.037  -2.032
  134   2HB   LYS  17          2HB       LYS  17   5.958 -12.913  -0.924
  135   1HG   LYS  17          1HG       LYS  17   5.508 -15.010  -2.140
  136   2HG   LYS  17          2HG       LYS  17   4.446 -14.140  -3.248
  137   1HD   LYS  17          1HD       LYS  17   7.302 -13.268  -2.840
  138   2HD   LYS  17          2HD       LYS  17   6.900 -14.543  -3.990
  139   1HE   LYS  17          1HE       LYS  17   5.075 -12.335  -4.351
  140   2HE   LYS  17          2HE       LYS  17   6.750 -11.752  -4.438
  141   1HZ   LYS  17          1HZ       LYS  17   7.195 -13.771  -5.852
  142   2HZ   LYS  17          2HZ       LYS  17   5.515 -13.971  -5.969
  143   3HZ   LYS  17          3HZ       LYS  17   6.245 -12.564  -6.580
  144    H    LEU  18           H        LEU  18   2.641 -13.732   1.493
  145    HA   LEU  18           HA       LEU  18   2.101 -11.137   2.399
  146   1HB   LEU  18          1HB       LEU  18   2.696 -13.753   3.786
  147   2HB   LEU  18          2HB       LEU  18   2.185 -12.326   4.685
  148    HG   LEU  18           HG       LEU  18   0.664 -13.703   2.455
  149   1HD1  LEU  18          1HD1      LEU  18   0.737 -14.566   4.936
  150   2HD1  LEU  18          2HD1      LEU  18  -0.321 -13.191   5.248
  151   3HD1  LEU  18          3HD1      LEU  18  -0.814 -14.442   4.107
  152   1HD2  LEU  18          1HD2      LEU  18   0.182 -11.111   3.941
  153   2HD2  LEU  18          2HD2      LEU  18   0.264 -11.358   2.196
  154   3HD2  LEU  18          3HD2      LEU  18  -1.110 -11.979   3.111
  155    H    GLY  19           H        GLY  19   3.310  -9.533   3.314
  156   1HA   GLY  19          1HA       GLY  19   5.195  -8.367   4.073
  157   2HA   GLY  19          2HA       GLY  19   5.623  -9.859   4.906
  158    H    GLU  20           H        GLU  20   7.669  -8.370   3.948
  159    HA   GLU  20           HA       GLU  20   9.469  -8.312   2.402
  160   1HB   GLU  20          1HB       GLU  20   8.978 -10.808   3.613
  161   2HB   GLU  20          2HB       GLU  20   9.388 -11.171   1.936
  162   1HG   GLU  20          1HG       GLU  20  11.489 -10.106   2.093
  163   2HG   GLU  20          2HG       GLU  20  11.032  -9.226   3.551
  164    H    ASN  21           H        ASN  21   7.134  -7.672   0.990
  165    HA   ASN  21           HA       ASN  21   7.279  -9.354  -1.482
  166   1HB   ASN  21          1HB       ASN  21   5.108  -8.857  -0.157
  167   2HB   ASN  21          2HB       ASN  21   5.240  -7.226  -0.819
  168   1HD2  ASN  21          2HD2      ASN  21   3.620 -10.003  -1.422
  169   2HD2  ASN  21          1HD2      ASN  21   3.550  -9.959  -3.117
  170    H    ASP  22           H        ASP  22   9.379  -8.199  -1.970
  171    HA   ASP  22           HA       ASP  22   9.910  -5.525  -2.280
  172   1HB   ASP  22          1HB       ASP  22  10.771  -8.005  -3.385
  173   2HB   ASP  22          2HB       ASP  22  10.636  -6.859  -4.720
  174    H    PHE  23           H        PHE  23   8.178  -7.470  -4.759
  175    HA   PHE  23           HA       PHE  23   7.599  -5.562  -6.672
  176   1HB   PHE  23          1HB       PHE  23   6.730  -8.087  -5.978
  177   2HB   PHE  23          2HB       PHE  23   5.254  -7.133  -5.824
  178    HD1  PHE  23           HD1      PHE  23   8.096  -7.837  -8.152
  179    HD2  PHE  23           HD2      PHE  23   4.040  -6.480  -7.738
  180    HE1  PHE  23           HE1      PHE  23   7.851  -7.810 -10.620
  181    HE2  PHE  23           HE2      PHE  23   3.798  -6.452 -10.207
  182    HZ   PHE  23           HZ       PHE  23   5.703  -7.117 -11.647
  183    H    CYS  24           H        CYS  24   5.896  -5.997  -3.564
  184    HA   CYS  24           HA       CYS  24   3.969  -3.894  -3.977
  185   1HB   CYS  24          1HB       CYS  24   3.759  -5.760  -2.364
  186   2HB   CYS  24          2HB       CYS  24   5.129  -5.123  -1.453
  187    H    ASN  25           H        ASN  25   6.882  -3.967  -1.869
  188    HA   ASN  25           HA       ASN  25   6.955  -1.266  -1.120
  189   1HB   ASN  25          1HB       ASN  25   9.228  -3.144  -1.859
  190   2HB   ASN  25          2HB       ASN  25   9.402  -1.685  -0.884
  191   1HD2  ASN  25          2HD2      ASN  25  10.150  -3.199   0.881
  192   2HD2  ASN  25          1HD2      ASN  25   8.985  -4.017   1.805
  193    H    ARG  26           H        ARG  26   8.441  -2.764  -4.010
  194    HA   ARG  26           HA       ARG  26   9.601  -0.505  -5.197
  195   1HB   ARG  26          1HB       ARG  26   9.852  -2.769  -6.044
  196   2HB   ARG  26          2HB       ARG  26   8.124  -2.877  -6.383
  197   1HG   ARG  26          1HG       ARG  26   8.607  -2.140  -8.458
  198   2HG   ARG  26          2HG       ARG  26   8.921  -0.570  -7.720
  199   1HD   ARG  26          1HD       ARG  26  11.219  -2.264  -7.338
  200   2HD   ARG  26          2HD       ARG  26  10.791  -2.239  -9.057
  201    HE   ARG  26           HE       ARG  26  11.971  -0.069  -7.627
  202   1HH1  ARG  26          1HH1      ARG  26   9.334  -0.681  -9.793
  203   2HH1  ARG  26          2HH1      ARG  26   9.137   0.987 -10.206
  204   1HH2  ARG  26          1HH2      ARG  26  11.729   2.083  -8.188
  205   2HH2  ARG  26          2HH2      ARG  26  10.491   2.546  -9.307
  206    H    GLU  27           H        GLU  27   6.207  -1.613  -5.382
  207    HA   GLU  27           HA       GLU  27   5.374   0.625  -7.074
  208   1HB   GLU  27          1HB       GLU  27   3.729  -1.275  -5.373
  209   2HB   GLU  27          2HB       GLU  27   3.196  -0.391  -6.801
  210   1HG   GLU  27          1HG       GLU  27   5.576  -2.064  -7.257
  211   2HG   GLU  27          2HG       GLU  27   4.128  -2.976  -6.829
  212    H    CYS  28           H        CYS  28   4.935  -0.290  -3.629
  213    HA   CYS  28           HA       CYS  28   3.370   1.707  -2.589
  214   1HB   CYS  28          1HB       CYS  28   4.589  -0.091  -1.351
  215   2HB   CYS  28          2HB       CYS  28   6.077   0.843  -1.516
  216    H    LYS  29           H        LYS  29   6.921   2.147  -2.686
  217    HA   LYS  29           HA       LYS  29   6.622   5.072  -2.662
  218   1HB   LYS  29          1HB       LYS  29   9.128   4.926  -2.733
  219   2HB   LYS  29          2HB       LYS  29   8.438   3.933  -1.449
  220   1HG   LYS  29          1HG       LYS  29   8.774   1.928  -2.658
  221   2HG   LYS  29          2HG       LYS  29   8.994   2.784  -4.184
  222   1HD   LYS  29          1HD       LYS  29  10.901   3.556  -2.072
  223   2HD   LYS  29          2HD       LYS  29  11.047   1.882  -2.609
  224   1HE   LYS  29          1HE       LYS  29  10.680   3.490  -4.943
  225   2HE   LYS  29          2HE       LYS  29  11.951   4.243  -3.961
  226   1HZ   LYS  29          1HZ       LYS  29  12.546   1.664  -3.662
  227   2HZ   LYS  29          2HZ       LYS  29  11.906   1.631  -5.235
  228   3HZ   LYS  29          3HZ       LYS  29  13.222   2.638  -4.878
  229    H    TRP  30           H        TRP  30   5.244   4.400  -4.812
  230    HA   TRP  30           HA       TRP  30   6.027   3.644  -7.240
  231   1HB   TRP  30          1HB       TRP  30   4.308   5.695  -6.221
  232   2HB   TRP  30          2HB       TRP  30   5.038   6.252  -7.719
  233    HD1  TRP  30           HD1      TRP  30   4.494   4.968  -9.893
  234    HE1  TRP  30           HE1      TRP  30   2.703   3.212 -10.519
  235    HE3  TRP  30           HE3      TRP  30   2.914   3.692  -5.260
  236    HZ2  TRP  30           HZ2      TRP  30   0.818   1.508  -9.197
  237    HZ3  TRP  30           HZ3      TRP  30   1.110   2.012  -4.939
  238    HH2  TRP  30           HH2      TRP  30   0.065   0.915  -6.905
  239    H    LYS  31           H        LYS  31   7.089   6.793  -5.903
  240    HA   LYS  31           HA       LYS  31   9.484   6.659  -7.672
  241   1HB   LYS  31          1HB       LYS  31   7.152   8.315  -8.011
  242   2HB   LYS  31          2HB       LYS  31   8.542   9.340  -7.653
  243   1HG   LYS  31          1HG       LYS  31   9.454   8.959  -9.680
  244   2HG   LYS  31          2HG       LYS  31   9.225   7.216  -9.527
  245   1HD   LYS  31          1HD       LYS  31   7.628   7.418 -11.112
  246   2HD   LYS  31          2HD       LYS  31   6.640   8.189  -9.872
  247   1HE   LYS  31          1HE       LYS  31   8.473   9.578 -11.861
  248   2HE   LYS  31          2HE       LYS  31   6.705   9.708 -11.757
  249   1HZ   LYS  31          1HZ       LYS  31   7.145  10.386  -9.344
  250   2HZ   LYS  31          2HZ       LYS  31   8.740  10.683  -9.847
  251   3HZ   LYS  31          3HZ       LYS  31   7.451  11.537 -10.552
  252    H    HIS  32           H        HIS  32   7.921   8.995  -5.439
  253    HA   HIS  32           HA       HIS  32  10.280   8.789  -3.631
  254   1HB   HIS  32          1HB       HIS  32   9.586  10.963  -5.478
  255   2HB   HIS  32          2HB       HIS  32   9.812  11.516  -3.819
  256    HD1  HIS  32           HD1      HIS  32  11.695   8.612  -5.345
  257    HD2  HIS  32           HD2      HIS  32  12.407  12.545  -4.156
  258    HE1  HIS  32           HE1      HIS  32  14.202   8.955  -5.467
  259    H    ILE  33           H        ILE  33   9.073   8.111  -1.842
  260    HA   ILE  33           HA       ILE  33   6.870   9.949  -0.962
  261    HB   ILE  33           HB       ILE  33   7.117   6.928  -0.880
  262   1HG1  ILE  33          1HG1      ILE  33   6.324   8.009  -2.996
  263   2HG1  ILE  33          2HG1      ILE  33   5.089   7.003  -2.237
  264   1HG2  ILE  33          1HG2      ILE  33   6.200   7.811   1.257
  265   2HG2  ILE  33          2HG2      ILE  33   4.966   8.682   0.347
  266   3HG2  ILE  33          3HG2      ILE  33   4.991   6.919   0.335
  267   1HD1  ILE  33          1HD1      ILE  33   4.383   9.229  -1.046
  268   2HD1  ILE  33          2HD1      ILE  33   5.268  10.001  -2.362
  269   3HD1  ILE  33          3HD1      ILE  33   3.894   8.955  -2.718
  270    H    GLY  34           H        GLY  34   9.517   7.782  -0.028
  271   1HA   GLY  34          1HA       GLY  34  11.020   8.255   1.796
  272   2HA   GLY  34          2HA       GLY  34   9.800   9.321   2.488
  273    H    GLY  35           H        GLY  35   9.606   5.925   1.426
  274   1HA   GLY  35          1HA       GLY  35   8.186   5.258   3.920
  275   2HA   GLY  35          2HA       GLY  35   8.449   4.169   2.557
  276    H    SER  36           H        SER  36   8.987   3.784   5.489
  277    HA   SER  36           HA       SER  36  11.952   3.458   5.451
  278   1HB   SER  36          1HB       SER  36  11.812   3.947   7.669
  279   2HB   SER  36          2HB       SER  36  10.202   4.533   7.279
  280    HG   SER  36           HG       SER  36   9.341   2.756   8.105
  281    H    TYR  37           H        TYR  37   8.911   1.661   6.011
  282    HA   TYR  37           HA       TYR  37  10.401  -0.859   5.438
  283   1HB   TYR  37          1HB       TYR  37   9.966  -0.078   7.987
  284   2HB   TYR  37          2HB       TYR  37   8.430  -0.885   7.673
  285    HD1  TYR  37           HD1      TYR  37   8.933  -3.128   6.050
  286    HD2  TYR  37           HD2      TYR  37  11.472  -1.473   9.095
  287    HE1  TYR  37           HE1      TYR  37  10.028  -5.334   6.336
  288    HE2  TYR  37           HE2      TYR  37  12.567  -3.680   9.380
  289    HH   TYR  37           HH       TYR  37  11.418  -6.541   7.628
  290    H    GLY  38           H        GLY  38   9.201  -0.882   3.422
  291   1HA   GLY  38          1HA       GLY  38   6.249  -0.949   3.583
  292   2HA   GLY  38          2HA       GLY  38   7.204  -0.990   2.099
  293    H    TYR  39           H        TYR  39   5.027  -2.826   2.996
  294    HA   TYR  39           HA       TYR  39   6.189  -5.317   2.151
  295   1HB   TYR  39          1HB       TYR  39   6.151  -6.460   4.357
  296   2HB   TYR  39          2HB       TYR  39   7.283  -5.107   4.356
  297    HD1  TYR  39           HD1      TYR  39   3.802  -6.082   5.283
  298    HD2  TYR  39           HD2      TYR  39   7.021  -3.297   5.861
  299    HE1  TYR  39           HE1      TYR  39   2.570  -5.049   7.172
  300    HE2  TYR  39           HE2      TYR  39   5.789  -2.264   7.750
  301    HH   TYR  39           HH       TYR  39   3.816  -3.321   9.452
  302    H    CYS  40           H        CYS  40   4.564  -7.001   2.029
  303    HA   CYS  40           HA       CYS  40   1.816  -6.002   1.932
  304   1HB   CYS  40          1HB       CYS  40   3.222  -7.810   0.536
  305   2HB   CYS  40          2HB       CYS  40   2.523  -8.899   1.733
  306    H    TYR  41           H        TYR  41   0.044  -6.952   3.184
  307    HA   TYR  41           HA       TYR  41   0.683  -8.647   5.506
  308   1HB   TYR  41          1HB       TYR  41   1.347  -6.264   6.060
  309   2HB   TYR  41          2HB       TYR  41  -0.352  -5.823   5.889
  310    HD1  TYR  41           HD1      TYR  41  -2.017  -7.502   7.200
  311    HD2  TYR  41           HD2      TYR  41   2.095  -6.765   8.203
  312    HE1  TYR  41           HE1      TYR  41  -2.448  -8.256   9.524
  313    HE2  TYR  41           HE2      TYR  41   1.664  -7.518  10.527
  314    HH   TYR  41           HH       TYR  41  -0.432  -7.632  12.060
  315    H    GLY  42           H        GLY  42  -1.186  -9.723   6.205
  316   1HA   GLY  42          1HA       GLY  42  -3.384 -10.543   5.968
  317   2HA   GLY  42          2HA       GLY  42  -3.836  -8.842   6.119
  318    H    PHE  43           H        PHE  43  -1.933 -10.347   3.535
  319    HA   PHE  43           HA       PHE  43  -2.305 -10.429   1.208
  320   1HB   PHE  43          1HB       PHE  43  -5.115 -10.541   2.340
  321   2HB   PHE  43          2HB       PHE  43  -4.762 -10.767   0.629
  322    HD1  PHE  43           HD1      PHE  43  -2.785 -12.493   0.131
  323    HD2  PHE  43           HD2      PHE  43  -5.160 -12.423   3.709
  324    HE1  PHE  43           HE1      PHE  43  -2.210 -14.866   0.561
  325    HE2  PHE  43           HE2      PHE  43  -4.586 -14.794   4.139
  326    HZ   PHE  43           HZ       PHE  43  -3.111 -16.016   2.565
  327    H    GLY  44           H        GLY  44  -1.510  -8.025   1.631
  328   1HA   GLY  44          1HA       GLY  44  -2.928  -6.321  -0.161
  329   2HA   GLY  44          2HA       GLY  44  -3.315  -5.841   1.491
  330    H    CYS  45           H        CYS  45  -1.783  -4.305  -0.471
  331    HA   CYS  45           HA       CYS  45   1.039  -4.458   0.280
  332   1HB   CYS  45          1HB       CYS  45  -0.728  -3.065  -1.594
  333   2HB   CYS  45          2HB       CYS  45   0.545  -2.021  -0.962
  334    H    TYR  46           H        TYR  46   1.593  -3.824   2.336
  335    HA   TYR  46           HA       TYR  46   0.260  -1.392   3.482
  336   1HB   TYR  46          1HB       TYR  46   0.106  -3.727   4.570
  337   2HB   TYR  46          2HB       TYR  46   1.815  -3.527   4.959
  338    HD1  TYR  46           HD1      TYR  46  -1.599  -2.296   5.593
  339    HD2  TYR  46           HD2      TYR  46   2.558  -1.846   6.569
  340    HE1  TYR  46           HE1      TYR  46  -2.213  -0.911   7.557
  341    HE2  TYR  46           HE2      TYR  46   1.946  -0.459   8.532
  342    HH   TYR  46           HH       TYR  46  -1.004  -0.379   9.877
  343    H    CYS  47           H        CYS  47   1.653   0.214   4.451
  344    HA   CYS  47           HA       CYS  47   4.597  -0.166   4.113
  345   1HB   CYS  47          1HB       CYS  47   2.774   1.773   2.723
  346   2HB   CYS  47          2HB       CYS  47   4.423   2.274   3.095
  347    H    GLU  48           H        GLU  48   5.742   0.822   5.746
  348    HA   GLU  48           HA       GLU  48   4.202   2.504   7.688
  349   1HB   GLU  48          1HB       GLU  48   6.636   0.708   7.902
  350   2HB   GLU  48          2HB       GLU  48   6.096   1.750   9.219
  351   1HG   GLU  48          1HG       GLU  48   3.781   0.611   8.858
  352   2HG   GLU  48          2HG       GLU  48   4.705  -0.629   8.009
  353    H    GLY  49           H        GLY  49   4.871   4.616   7.969
  354   1HA   GLY  49          1HA       GLY  49   6.691   6.263   8.184
  355   2HA   GLY  49          2HA       GLY  49   7.570   5.375   6.938
  356    H    LEU  50           H        LEU  50   4.134   6.043   6.719
  357    HA   LEU  50           HA       LEU  50   4.561   7.443   4.165
  358   1HB   LEU  50          1HB       LEU  50   2.054   6.771   5.739
  359   2HB   LEU  50          2HB       LEU  50   2.117   7.239   4.038
  360    HG   LEU  50           HG       LEU  50   3.538   4.812   5.166
  361   1HD1  LEU  50          1HD1      LEU  50   0.800   5.107   4.903
  362   2HD1  LEU  50          2HD1      LEU  50   1.264   4.380   3.364
  363   3HD1  LEU  50          3HD1      LEU  50   1.666   3.570   4.877
  364   1HD2  LEU  50          1HD2      LEU  50   3.273   6.110   2.496
  365   2HD2  LEU  50          2HD2      LEU  50   4.622   5.197   3.172
  366   3HD2  LEU  50          3HD2      LEU  50   3.215   4.349   2.531
  367    HA   PRO  51           HA       PRO  51   4.736  11.380   6.390
  368   1HB   PRO  51          1HB       PRO  51   4.288  12.602   3.788
  369   2HB   PRO  51          2HB       PRO  51   5.743  12.636   4.789
  370   1HG   PRO  51          1HG       PRO  51   5.346  11.169   2.382
  371   2HG   PRO  51          2HG       PRO  51   6.745  11.101   3.458
  372   1HD   PRO  51          1HD       PRO  51   4.741   9.068   3.034
  373   2HD   PRO  51          2HD       PRO  51   6.147   9.005   4.124
  374    H    ASP  52           H        ASP  52   3.104  12.907   6.986
  375    HA   ASP  52           HA       ASP  52   0.411  12.170   6.959
  376   1HB   ASP  52          1HB       ASP  52   1.769  14.061   8.167
  377   2HB   ASP  52          2HB       ASP  52   1.265  15.055   6.800
  378    H    SER  53           H        SER  53   2.127  14.217   4.597
  379    HA   SER  53           HA       SER  53  -0.006  15.092   3.003
  380   1HB   SER  53          1HB       SER  53   2.548  15.492   2.893
  381   2HB   SER  53          2HB       SER  53   2.606  14.032   1.909
  382    HG   SER  53           HG       SER  53   1.402  15.014   0.374
  383    H    THR  54           H        THR  54   1.808  12.016   2.696
  384    HA   THR  54           HA       THR  54   0.229  10.971   0.527
  385    HB   THR  54           HB       THR  54   1.652   9.315   2.603
  386    HG1  THR  54           HG1      THR  54   3.104  10.505   0.552
  387   1HG2  THR  54          1HG2      THR  54   1.227   9.227  -0.381
  388   2HG2  THR  54          2HG2      THR  54   2.496   8.277   0.393
  389   3HG2  THR  54          3HG2      THR  54   0.807   8.010   0.824
  390    H    GLN  55           H        GLN  55  -1.655   9.733   0.584
  391    HA   GLN  55           HA       GLN  55  -3.055   9.540   3.204
  392   1HB   GLN  55          1HB       GLN  55  -5.018   9.147   1.749
  393   2HB   GLN  55          2HB       GLN  55  -4.149  10.598   1.250
  394   1HG   GLN  55          1HG       GLN  55  -3.761   9.727  -0.788
  395   2HG   GLN  55          2HG       GLN  55  -3.042   8.282  -0.076
  396   1HE2  GLN  55          2HE2      GLN  55  -4.103   6.660  -1.311
  397   2HE2  GLN  55          1HE2      GLN  55  -5.787   6.458  -1.340
  398    H    THR  56           H        THR  56  -4.621   7.371   3.023
  399    HA   THR  56           HA       THR  56  -3.019   5.054   2.085
  400    HB   THR  56           HB       THR  56  -2.110   5.458   4.274
  401    HG1  THR  56           HG1      THR  56  -3.965   3.591   5.073
  402   1HG2  THR  56          1HG2      THR  56  -4.324   6.824   4.853
  403   2HG2  THR  56          2HG2      THR  56  -4.779   5.296   5.607
  404   3HG2  THR  56          3HG2      THR  56  -3.317   6.133   6.125
  405    H    TRP  57           H        TRP  57  -4.225   3.006   2.357
  406    HA   TRP  57           HA       TRP  57  -7.018   3.229   1.569
  407   1HB   TRP  57          1HB       TRP  57  -5.305   1.561   0.792
  408   2HB   TRP  57          2HB       TRP  57  -5.284   0.883   2.411
  409    HD1  TRP  57           HD1      TRP  57  -7.567   1.232  -0.652
  410    HE1  TRP  57           HE1      TRP  57  -9.409  -0.561  -0.497
  411    HE3  TRP  57           HE3      TRP  57  -6.567  -0.651   3.984
  412    HZ2  TRP  57           HZ2      TRP  57 -10.329  -2.549   1.350
  413    HZ3  TRP  57           HZ3      TRP  57  -7.932  -2.498   4.915
  414    HH2  TRP  57           HH2      TRP  57  -9.810  -3.450   3.605
  415    HA   PRO  58           HA       PRO  58  -8.775   2.032   1.607
  416   1HB   PRO  58          1HB       PRO  58 -11.274   2.830   2.655
  417   2HB   PRO  58          2HB       PRO  58 -10.737   1.177   2.340
  418   1HG   PRO  58          1HG       PRO  58 -11.175   2.448   4.890
  419   2HG   PRO  58          2HG       PRO  58 -10.701   0.777   4.567
  420   1HD   PRO  58          1HD       PRO  58  -9.052   2.958   5.565
  421   2HD   PRO  58          2HD       PRO  58  -8.614   1.244   5.358
  422    H    LEU  59           H        LEU  59 -10.303   3.640   0.413
  423    HA   LEU  59           HA       LEU  59  -9.197   6.364   0.746
  424   1HB   LEU  59          1HB       LEU  59 -10.457   4.657  -1.315
  425   2HB   LEU  59          2HB       LEU  59 -10.875   6.364  -1.432
  426    HG   LEU  59           HG       LEU  59  -8.043   6.030  -0.886
  427   1HD1  LEU  59          1HD1      LEU  59  -9.247   4.541  -3.220
  428   2HD1  LEU  59          2HD1      LEU  59  -7.584   5.127  -3.251
  429   3HD1  LEU  59          3HD1      LEU  59  -8.083   3.953  -2.032
  430   1HD2  LEU  59          1HD2      LEU  59  -9.857   7.488  -2.715
  431   2HD2  LEU  59          2HD2      LEU  59  -8.422   8.058  -1.861
  432   3HD2  LEU  59          3HD2      LEU  59  -8.252   7.155  -3.366
  433    HA   PRO  60           HA       PRO  60 -12.678   8.515   2.388
  434   1HB   PRO  60          1HB       PRO  60 -13.472   9.760  -0.136
  435   2HB   PRO  60          2HB       PRO  60 -12.792  10.510   1.313
  436   1HG   PRO  60          1HG       PRO  60 -11.456  10.077  -1.135
  437   2HG   PRO  60          2HG       PRO  60 -10.721  10.582   0.389
  438   1HD   PRO  60          1HD       PRO  60 -10.444   8.042  -0.968
  439   2HD   PRO  60          2HD       PRO  60  -9.657   8.571   0.535
  440    H    ASN  61           H        ASN  61 -15.134   9.204   1.347
  441    HA   ASN  61           HA       ASN  61 -16.761   6.977   1.581
  442   1HB   ASN  61          1HB       ASN  61 -17.358   9.442   1.428
  443   2HB   ASN  61          2HB       ASN  61 -17.233   9.288  -0.325
  444   1HD2  ASN  61          2HD2      ASN  61 -19.191   8.821  -1.324
  445   2HD2  ASN  61          1HD2      ASN  61 -20.490   8.004  -0.598
  446    H    LYS  62           H        LYS  62 -14.933   8.018  -1.220
  447    HA   LYS  62           HA       LYS  62 -16.266   6.107  -3.034
  448   1HB   LYS  62          1HB       LYS  62 -14.532   8.416  -3.159
  449   2HB   LYS  62          2HB       LYS  62 -13.848   7.104  -4.121
  450   1HG   LYS  62          1HG       LYS  62 -16.679   8.173  -4.337
  451   2HG   LYS  62          2HG       LYS  62 -15.377   8.449  -5.495
  452   1HD   LYS  62          1HD       LYS  62 -16.020   6.563  -6.546
  453   2HD   LYS  62          2HD       LYS  62 -15.449   5.666  -5.137
  454   1HE   LYS  62          1HE       LYS  62 -17.616   4.985  -4.916
  455   2HE   LYS  62          2HE       LYS  62 -17.935   6.626  -4.320
  456   1HZ   LYS  62          1HZ       LYS  62 -17.800   6.035  -7.214
  457   2HZ   LYS  62          2HZ       LYS  62 -19.250   5.847  -6.348
  458   3HZ   LYS  62          3HZ       LYS  62 -18.503   7.371  -6.440
  459    H    THR  63           H        THR  63 -15.489   4.465  -1.118
  460    HA   THR  63           HA       THR  63 -12.716   3.582  -1.317
  461    HB   THR  63           HB       THR  63 -14.899   1.902  -0.181
  462    HG1  THR  63           HG1      THR  63 -15.050   3.370   1.585
  463   1HG2  THR  63          1HG2      THR  63 -12.345   1.595   0.067
  464   2HG2  THR  63          2HG2      THR  63 -12.423   2.972   1.165
  465   3HG2  THR  63          3HG2      THR  63 -13.319   1.499   1.533
  466    H    CYS  64           H        CYS  64 -12.498   1.040  -1.688
  467    HA   CYS  64           HA       CYS  64 -12.781   0.397  -4.374
  468   1HB   CYS  64          1HB       CYS  64 -11.466  -0.884  -2.772
  469   2HB   CYS  64          2HB       CYS  64 -12.925  -1.365  -1.907