*HEADER    COLLAGEN FACIT XIV                      15-FEB-99   1B9Q              
*TITLE     NMR STRUCTURE OF HEPARIN BINDING SITE OF NON COLLAGENOUS              
*TITLE    2 DOMAIN I (NC1) OF COLLAGEN FACIT XIV                                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: COLLAGEN ALPHA 1;                                          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: FRAGMENT 84-116 OF NC1 (HEPARIN BINDING SITE);             
*COMPND   5 SYNONYM: ALPHA 1 TYPE XIV COLLAGEN;                                  
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE PROTEIN WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE   4 SEQUENCE OF THIS PROTEIN IS NATURALLY FOUND                          
*SOURCE   5 EXTRACELLULARLY IN THE EMBRYO OF GALLUS GALLUS (CHICKEN).            
*KEYWDS    COLLAGEN FACIT XIV, HEPARIN-BINDING SITE, NC1                         
*EXPDTA    NMR                                                                   
*AUTHOR    R.MONTSERRET, G.DELEAGE, F.PENIN                                      
*REVDAT   2   18-JUN-99 1B9Q    1       JRNL                                     
*REVDAT   1   25-FEB-99 1B9Q    0                                                

###RCSB000487
REMARK =======================================================
REMARK ==        Analyse des structures Xplor               ==
REMARK ==           IBCP-CNRS UPR 412, Lyon                 ==
REMARK ==        by C. Geourjon (geourjon@ibcp.fr)          ==
REMARK ==           G. Deleage (deleage@ibcp.fr)            ==
REMARK == Please in your publication site :                 ==
REMARK == ANTHEPROT :                                       == 
REMARK == A 3D module coupled to protein sequence analysis ==
REMARK == methods., Geourjon C. & Deleage G.               ==
REMARK == J. Mol. Graph., 1993, 13, 209-212                ==
REMARK =======================================================
! PEPNC1TFE_20 roland(20/1/98)                                                  
!contraintes intra de noesy a 20C et mix 50ms.                                  
! PEPNC1TFE_21 ajoute qq contraintes entre                                      
!chaines laterales tj a partir de noesy 50ms.                                   
!                                                                                                         
! Cys 1                                                                                              
assign (resid    1 and  name HA   )(resid    1 and  name HB#  ) 2.8 1.0 1.3
!                                                                                                          
!1      HN      2       HN      1                                                                    
assign (resid    1 and  name HA   )(resid    2 and  name HN   ) 3.9 2.1 0.4
assign (resid    1 and  name HB#  )(resid    4 and  name HN   ) 5.0 3.2 1.5
!                                                                                                          
! Ala 2                                                                                              
assign (resid    2 and  name HN   )(resid    2 and  name HA   ) 2.8 1.0 0.3
assign (resid    2 and  name HN   )(resid    2 and  name HB#  ) 2.8 1.0 1.3
assign (resid    2 and  name HA   )(resid    2 and  name HB#  ) 2.8 1.0 1.3
!                                                                                                          
assign (resid    2 and  name HN   )(resid    3 and  name HN   ) 5.0 3.2 0.5
assign (resid    2 and  name HA   )(resid    3 and  name HN   ) 2.8 1.0 0.3
assign (resid    2 and  name HB#  )(resid    3 and  name HN   ) 3.9 2.1 1.4
assign (resid    2 and  name HB#  )(resid    4 and  name HN   ) 5.0 3.2 1.5
assign (resid    2 and  name HA   )(resid    5 and  name HD1# ) 5.0 3.2 1.5
!                                                                                                          
assign (resid    2 and  name HA   )(resid    5 and  name HD2# ) 3.9 2.1 1.4
!                                                                                                          
! VAL 3                                                                                              
assign (resid    3 and  name HN   )(resid    3 and  name HA   ) 2.8 1.0 0.3
assign (resid    3 and  name HN   )(resid    3 and  name HB   ) 3.9 2.1 0.4
assign (resid    3 and  name HN   )(resid    3 and  name HG1# ) 3.9 2.1 1.4
assign (resid    3 and  name HN   )(resid    3 and  name HG2# ) 3.9 2.1 1.4
assign (resid    3 and  name HA   )(resid    3 and  name HB   ) 3.9 2.1 0.4
assign (resid    3 and  name HA   )(resid    3 and  name HG1# ) 3.9 2.1 1.4
assign (resid    3 and  name HA   )(resid    3 and  name HG2# ) 3.9 2.1 1.4
assign (resid    3 and  name HB   )(resid    3 and  name HG1# ) 2.8 1.0 1.3
assign (resid    3 and  name HB   )(resid    3 and  name HG2# ) 2.8 1.0 1.3
!                                                                                                          
assign (resid    3 and  name HN   )(resid    4 and  name HN   ) 2.8 1.0 0.3
assign (resid    3 and  name HA   )(resid    4 and  name HN   ) 3.9 2.1 0.4
assign (resid    3 and  name HB   )(resid    4 and  name HN   ) 3.9 2.1 0.4
assign (resid    3 and  name HG1# )(resid    4 and  name HN   ) 3.9 2.1 1.4
assign (resid    3 and  name HG2# )(resid    4 and  name HN   ) 2.8 1.0 1.3
assign (resid    3 and  name HA   )(resid    6 and  name HN   ) 5.0 3.2 0.5
assign (resid    3 and  name HA   )(resid    7 and  name HN   ) 5.0 3.2 0.5
assign (resid    3 and  name HG2# )(resid    4 and  name HA   ) 3.9 2.1 1.4
!                                                                                                          
!GLU 4                                                                                                
assign (resid    4 and  name HN   )(resid    4 and  name HG#  ) 3.9 2.1 1.4
assign (resid    4 and  name HA   )(resid    4 and  name HB#  ) 3.9 2.1 1.4
assign (resid    4 and  name HA   )(resid    4 and  name HG#  ) 3.9 2.1 1.4
assign (resid    4 and  name HB#  )(resid    4 and  name HG#  ) 2.8 1.0 2.3
!                                                                                                          
assign (resid    4 and  name HN   )(resid    5 and  name HN   ) 5.0 3.2 0.5
assign (resid    4 and  name HA   )(resid    5 and  name HN   ) 2.8 1.0 0.3
assign (resid    4 and  name HG#  )(resid    5 and  name HN   ) 3.9 2.1 1.4
assign (resid    4 and  name HB2  )(resid    5 and  name HN   ) 3.9 2.1 0.4
assign (resid    4 and  name HA   )(resid    7 and  name HN   ) 5.0 3.2 0.5
assign (resid    4 and  name HG#  )(resid    6 and  name HN   ) 5.0 3.2 1.5
!                                                                                                          
! LEU 5                                                                                              
assign (resid    5 and  name HN   )(resid    5 and  name HA   ) 2.8 1.0 0.3
assign (resid    5 and  name HN   )(resid    5 and  name HB1  ) 3.9 2.1 0.4
assign (resid    5 and  name HN   )(resid    5 and  name HB2  ) 3.9 2.1 0.4
assign (resid    5 and  name HN   )(resid    5 and  name HG   ) 5.0 3.2 0.5
assign (resid    5 and  name HA   )(resid    5 and  name HB1  ) 5.0 3.2 0.5
assign (resid    5 and  name HA   )(resid    5 and  name HB2  ) 2.8 1.0 0.3
assign (resid    5 and  name HA   )(resid    5 and  name HG   ) 5.0 3.2 0.5
assign (resid    5 and  name HA   )(resid    5 and  name HD2# ) 3.9 2.1 1.4
!                                                                                                          
assign (resid    5 and  name HA   )(resid    6 and  name HN   ) 3.9 2.1 0.4
assign (resid    5 and  name HN   )(resid    6 and  name HN   ) 5.0 3.2 0.5
assign (resid    5 and  name HD2# )(resid    6 and  name HN   ) 5.0 3.2 1.5
!                                                                                                          
!5      HA      5       HD1#    1                                                                  
!                                                                                                          
! ARG 6                                                                                              
assign (resid    6 and  name HN   )(resid    6 and  name HA   ) 2.8 1.0 0.3
assign (resid    6 and  name HN   )(resid    6 and  name HB1  ) 2.8 1.0 0.3
assign (resid    6 and  name HN   )(resid    6 and  name HB2  ) 3.9 2.1 0.4
assign (resid    6 and  name HN   )(resid    6 and  name HG1  ) 5.0 3.2 0.5
assign (resid    6 and  name HN   )(resid    6 and  name HG2  ) 5.0 3.2 0.5
assign (resid    6 and  name HA   )(resid    6 and  name HB1  ) 3.9 2.1 0.4
assign (resid    6 and  name HA   )(resid    6 and  name HB2  ) 3.9 2.1 0.4
assign (resid    6 and  name HA   )(resid    6 and  name HG1  ) 5.0 3.2 0.5
assign (resid    6 and  name HA   )(resid    6 and  name HG2  ) 3.9 2.1 0.4
assign (resid    6 and  name HA   )(resid    6 and  name HD#  ) 5.0 3.2 1.5
assign (resid    6 and  name HB1  )(resid    6 and  name HD#  ) 5.0 3.2 1.5
assign (resid    6 and  name HB2  )(resid    6 and  name HD#  ) 5.0 3.2 1.5
assign (resid    6 and  name HG1  )(resid    6 and  name HD#  ) 3.9 2.1 1.4
assign (resid    6 and  name HG2  )(resid    6 and  name HD#  ) 3.9 2.1 1.4
!                                                                                                          
assign (resid    6 and  name HA   )(resid    7 and  name HN   ) 3.9 2.1 0.4
assign (resid    6 and  name HB1  )(resid    7 and  name HN   ) 5.0 3.2 0.5
assign (resid    6 and  name HB2  )(resid    7 and  name HN   ) 5.0 3.2 0.5
!                                                                                                          
! SER 7                                                                                              
assign (resid    7 and  name HN   )(resid    7 and  name HA   ) 3.9 2.1 0.4
assign (resid    7 and  name HN   )(resid    7 and  name HB#  ) 2.8 1.0 1.3
assign (resid    7 and  name HA   )(resid    7 and  name HB#  ) 2.8 1.0 1.3
!                                                                                                          
assign (resid    7 and  name HA   )(resid    8 and  name HD1  ) 2.8 1.0 0.3
assign (resid    7 and  name HA   )(resid    8 and  name HD2  ) 2.8 1.0 0.3
assign (resid    7 and  name HB#  )(resid    8 and  name HD1  ) 5.0 3.2 1.5
assign (resid    7 and  name HB#  )(resid    8 and  name HD2  ) 5.0 3.2 1.5
assign (resid    7 and  name HA   )(resid    8 and  name HB2  ) 5.0 3.2 0.5
!                                                                                                          
! PRO 8                                                                                              
assign (resid    8 and  name HA   )(resid    8 and  name HB1  ) 2.8 1.0 0.3
assign (resid    8 and  name HA   )(resid    8 and  name HB2  ) 2.8 1.0 0.3
assign (resid    8 and  name HA   )(resid    8 and  name HG#  ) 2.8 1.0 1.3
assign (resid    8 and  name HA   )(resid    8 and  name HD1  ) 5.0 3.2 0.5
assign (resid    8 and  name HA   )(resid    8 and  name HD2  ) 5.0 3.2 0.5
assign (resid    8 and  name HB1  )(resid    8 and  name HB2  ) 2.8 1.0 0.3
assign (resid    8 and  name HB1  )(resid    8 and  name HD1  ) 5.0 3.2 0.5
assign (resid    8 and  name HB1  )(resid    8 and  name HD2  ) 5.0 3.2 0.5
assign (resid    8 and  name HB2  )(resid    8 and  name HD2  ) 5.0 3.2 0.5
assign (resid    8 and  name HG#  )(resid    8 and  name HD1  ) 3.9 2.1 1.4
assign (resid    8 and  name HG#  )(resid    8 and  name HD2  ) 3.9 2.1 1.4
!                                                                                                          
assign (resid    8 and  name HA   )(resid    9 and  name HN   ) 3.9 2.1 0.4
assign (resid    8 and  name HB2  )(resid    9 and  name HN   ) 5.0 3.2 0.5
assign (resid    8 and  name HA   )(resid   11 and  name HB1  ) 5.0 3.2 0.5
assign (resid    8 and  name HA   )(resid   11 and  name HB2  ) 5.0 3.2 0.5
!                                                                                                          
! GLY 9                                                                                              
assign (resid    9 and  name HN   )(resid    9 and  name HA1  ) 5.0 3.2 0.5
assign (resid    9 and  name HN   )(resid    9 and  name HA2  ) 5.0 3.2 0.5
!                                                                                                          
assign (resid    9 and  name HN   )(resid   10 and  name HN   ) 5.0 3.2 0.5
assign (resid    9 and  name HA1  )(resid   10 and  name HN   ) 5.0 3.2 0.5
assign (resid    9 and  name HA2  )(resid   10 and  name HN   ) 3.9 2.1 0.4
!                                                                                                          
! ILE 10                                                                                             
assign (resid   10 and  name HN   )(resid   10 and  name HA   ) 2.8 1.0 0.3
assign (resid   10 and  name HN   )(resid   10 and  name HG11 ) 3.9 2.1 0.4
assign (resid   10 and  name HN   )(resid   10 and  name HG12 ) 3.9 2.1 0.4
assign (resid   10 and  name HN   )(resid   10 and  name HG2# ) 3.9 2.1 1.4
assign (resid   10 and  name HA   )(resid   10 and  name HG12 ) 3.9 2.1 0.4
assign (resid   10 and  name HA   )(resid   10 and  name HG2# ) 2.8 1.0 1.3
assign (resid   10 and  name HB   )(resid   10 and  name HG2# ) 2.8 1.0 1.3
assign (resid   10 and  name HB   )(resid   10 and  name HD#  ) 2.8 1.0 1.3
assign (resid   10 and  name HG11 )(resid   10 and  name HG12 ) 2.8 1.0 0.3
assign (resid   10 and  name HG11 )(resid   10 and  name HG2# ) 5.0 3.2 1.5
assign (resid   10 and  name HG11 )(resid   10 and  name HD#  ) 2.8 1.0 1.3
assign (resid   10 and  name HG12 )(resid   10 and  name HD#  ) 3.9 2.1 1.4
!                                                                                                          
assign (resid   10 and  name HN   )(resid   11 and  name HN   ) 2.8 1.0 0.3
assign (resid   10 and  name HG2# )(resid   11 and  name HN   ) 2.8 1.0 1.3
assign (resid   10 and  name HG2# )(resid   11 and  name HA   ) 3.9 2.1 1.4
assign (resid   10 and  name HD#  )(resid   11 and  name HA   ) 5.0 3.2 1.5
assign (resid   10 and  name HA   )(resid   13 and  name HN   ) 3.9 2.1 0.4
assign (resid   10 and  name HA   )(resid   13 and  name HD*  ) 5.0 3.2 2.5
assign (resid   10 and  name HG2# )(resid   13 and  name HD*  ) 5.0 3.2 3.5
assign (resid   10 and  name HA   )(resid   13 and  name HB#  ) 2.8 1.0 1.3
assign (resid   10 and  name HG12 )(resid   13 and  name HD*  ) 5.0 3.2 2.5
assign (resid   10 and  name HA   )(resid   14 and  name HN   ) 5.0 3.2 0.5
assign (resid   10 and  name HG2# )(resid   14 and  name HN   ) 5.0 3.2 1.5
!                                                                                                          
assign (resid   10 and  name HG2# )(resid   11 and  name HB2  ) 5.0 3.2 1.5
assign (resid   10 and  name HD#  )(resid   11 and  name HB2  ) 5.0 3.2 1.5
assign (resid   10 and  name HG2# )(resid   13 and  name HB#  ) 5.0 3.2 2.5
assign (resid   10 and  name HG2# )(resid   14 and  name HD#  ) 3.9 2.1 2.4
!                                                                                                          
assign (resid   10 and  name HD#  )(resid   13 and  name HD*  ) 5.0 3.2 3.5
assign (resid   10 and  name HG2# )(resid   13 and  name HE*  ) 5.0 3.2 3.5
assign (resid   10 and  name HG12 )(resid   13 and  name HZ   ) 5.0 3.2 0.5
!                                                                                                          
! SER 11                                                                                             
assign (resid   11 and  name HN   )(resid   11 and  name HA   ) 2.8 1.0 0.3
assign (resid   11 and  name HN   )(resid   11 and  name HB1  ) 3.9 2.1 0.4
assign (resid   11 and  name HN   )(resid   11 and  name HB2  ) 3.9 2.1 0.4
assign (resid   11 and  name HA   )(resid   11 and  name HB1  ) 3.9 2.1 0.4
assign (resid   11 and  name HA   )(resid   11 and  name HB2  ) 3.9 2.1 0.4
!                                                                                                          
assign (resid   11 and  name HN   )(resid   12 and  name HN   ) 2.8 1.0 0.3
assign (resid   11 and  name HA   )(resid   12 and  name HN   ) 5.0 3.2 0.5
assign (resid   11 and  name HB2  )(resid   12 and  name HN   ) 5.0 3.2 0.5
assign (resid   11 and  name HA   )(resid   14 and  name HN   ) 2.8 1.0 0.3
assign (resid   11 and  name HA   )(resid   14 and  name HB#  ) 3.9 2.1 1.4
assign (resid   11 and  name HA   )(resid   14 and  name HD#  ) 5.0 3.2 1.5
assign (resid   11 and  name HA   )(resid   15 and  name HN   ) 5.0 3.2 0.5
!                                                                                                          
assign (resid   11 and  name HB1  )(resid   14 and  name HD#  ) 3.9 2.1 1.4
assign (resid   11 and  name HB2  )(resid   14 and  name HD#  ) 5.0 3.2 1.5
!                                                                                                          
! ARG 12                                                                                             
assign (resid   12 and  name HN   )(resid   12 and  name HA   ) 2.8 1.0 0.3
!                                                                                                          
assign (resid   12 and  name HA   )(resid   15 and  name HN   ) 3.9 2.1 0.4
!                                                                                                          
! PHE 13                                                                                             
assign (resid   13 and  name HN   )(resid   13 and  name HA   ) 2.8 1.0 0.3
assign (resid   13 and  name HA   )(resid   13 and  name HD*  ) 3.9 2.1 2.4
assign (resid   13 and  name HB#  )(resid   13 and  name HD*  ) 2.8 1.0 3.3
assign (resid   13 and  name HN   )(resid   13 and  name HD*  ) 5.0 3.2 2.5
assign (resid   13 and  name HD*  )(resid   13 and  name HE*  ) 2.8 1.0 4.3
!                                                                                                          
assign (resid   13 and  name HN   )(resid   14 and  name HN   ) 2.8 1.0 0.3
assign (resid   13 and  name HA   )(resid   14 and  name HN   ) 5.0 3.2 0.5
assign (resid   13 and  name HB#  )(resid   14 and  name HN   ) 2.8 1.0 1.3
assign (resid   13 and  name HD*  )(resid   14 and  name HA   ) 5.0 3.2 2.5
assign (resid   13 and  name HD*  )(resid   14 and  name HB#  ) 5.0 3.2 3.5
assign (resid   13 and  name HN   )(resid   15 and  name HN   ) 5.0 3.2 0.5
assign (resid   13 and  name HA   )(resid   15 and  name HN   ) 5.0 3.2 0.5
assign (resid   13 and  name HA   )(resid   16 and  name HB1  ) 3.9 2.1 0.4
assign (resid   13 and  name HA   )(resid   16 and  name HB2  ) 3.9 2.1 0.4
!13     HE*     17      HD#     1                                                                
assign (resid   13 and  name HD*  )(resid   17 and  name HD#  ) 5.0 3.2 3.5
!13     HZ      17      HD#     1                                                                 
!                                                                               
assign (resid   13 and  name HE*  )(resid   17 and  name HD#  ) 3.9 2.1 3.4
assign (resid   13 and  name HZ   )(resid   17 and  name HD#  ) 3.9 2.1 1.4
assign (resid   13 and  name HE*  )(resid   17 and  name HG2# ) 5.0 3.2 3.5
assign (resid   13 and  name HZ   )(resid   17 and  name HG2# ) 5.0 3.2 1.5
!                                                                                                                 
!                                                                                                          
! ARG 14                                                                                             
assign (resid   14 and  name HN   )(resid   14 and  name HA   ) 2.8 1.0 0.3
assign (resid   14 and  name HN   )(resid   14 and  name HB#  ) 2.8 1.0 1.3
assign (resid   14 and  name HN   )(resid   14 and  name HG#  ) 5.0 3.2 1.5
assign (resid   14 and  name HA   )(resid   14 and  name HB#  ) 2.8 1.0 1.3
assign (resid   14 and  name HA   )(resid   14 and  name HG#  ) 3.9 2.1 1.4
assign (resid   14 and  name HA   )(resid   14 and  name HD#  ) 5.0 3.2 1.5
!                                                                                                          
assign (resid   14 and  name HN   )(resid   15 and  name HN   ) 2.8 1.0 0.3
assign (resid   14 and  name HA   )(resid   15 and  name HN   ) 5.0 3.2 0.5
assign (resid   14 and  name HN   )(resid   16 and  name HN   ) 5.0 3.2 0.5
assign (resid   14 and  name HA   )(resid   16 and  name HN   ) 5.0 3.2 0.5
assign (resid   14 and  name HA   )(resid   17 and  name HN   ) 3.9 2.1 0.4
assign (resid   14 and  name HA   )(resid   17 and  name HB   ) 2.8 1.0 0.3
assign (resid   14 and  name HA   )(resid   17 and  name HG11 ) 5.0 3.2 0.5
assign (resid   14 and  name HA   )(resid   17 and  name HG12 ) 5.0 3.2 0.5
assign (resid   14 and  name HA   )(resid   17 and  name HG2# ) 3.9 2.1 1.4
assign (resid   14 and  name HA   )(resid   17 and  name HD#  ) 3.9 2.1 1.4
assign (resid   14 and  name HA   )(resid   18 and  name HN   ) 5.0 3.2 0.5
!                                                                                                          
assign (resid   14 and  name HB#  )(resid   17 and  name HD#  ) 5.0 3.2 2.5
!                                                                                                          
! ARG 15                                                                                             
assign (resid   15 and  name HN   )(resid   15 and  name HA   ) 2.8 1.0 0.3
assign (resid   15 and  name HN   )(resid   15 and  name HB2  ) 3.9 2.1 0.4
assign (resid   15 and  name HN   )(resid   15 and  name HG#  ) 5.0 3.2 1.5
assign (resid   15 and  name HN   )(resid   15 and  name HD#  ) 5.0 3.2 1.5
!                                                                                                          
assign (resid   15 and  name HN   )(resid   16 and  name HN   ) 2.8 1.0 0.3
assign (resid   15 and  name HN   )(resid   17 and  name HN   ) 5.0 3.2 0.5
assign (resid   15 and  name HA   )(resid   17 and  name HN   ) 5.0 3.2 0.5
assign (resid   15 and  name HA   )(resid   18 and  name HN   ) 3.9 2.1 0.4
assign (resid   15 and  name HA   )(resid   18 and  name HB#  ) 2.8 1.0 1.3
!                                                                                                          
! LYS 16                                                                                             
assign (resid   16 and  name HN   )(resid   17 and  name HN   ) 2.8 1.0 0.3
assign (resid   16 and  name HA   )(resid   17 and  name HN   ) 5.0 3.2 0.5
assign (resid   16 and  name HN   )(resid   18 and  name HN   ) 5.0 3.2 0.5
assign (resid   16 and  name HA   )(resid   19 and  name HN   ) 2.8 1.0 0.3
assign (resid   16 and  name HA   )(resid   20 and  name HN   ) 5.0 3.2 0.5
!                                                                                                          
! ILE 17                                                                                             
assign (resid   17 and  name HN   )(resid   17 and  name HA   ) 2.8 1.0 0.3
assign (resid   17 and  name HN   )(resid   17 and  name HG11 ) 3.9 2.1 0.4
assign (resid   17 and  name HN   )(resid   17 and  name HG12 ) 3.9 2.1 0.4
assign (resid   17 and  name HN   )(resid   17 and  name HG2# ) 5.0 3.2 1.5
assign (resid   17 and  name HN   )(resid   17 and  name HD#  ) 5.0 3.2 1.5
assign (resid   17 and  name HA   )(resid   17 and  name HB   ) 3.9 2.1 0.4
assign (resid   17 and  name HA   )(resid   17 and  name HG11 ) 3.9 2.1 0.4
assign (resid   17 and  name HA   )(resid   17 and  name HG12 ) 3.9 2.1 0.4
assign (resid   17 and  name HA   )(resid   17 and  name HG2# ) 2.8 1.0 1.3
assign (resid   17 and  name HA   )(resid   17 and  name HD#  ) 3.9 2.1 1.4
assign (resid   17 and  name HB   )(resid   17 and  name HG11 ) 3.9 2.1 0.4
assign (resid   17 and  name HB   )(resid   17 and  name HG12 ) 5.0 3.2 0.5
assign (resid   17 and  name HB   )(resid   17 and  name HG2# ) 2.8 1.0 1.3
assign (resid   17 and  name HB   )(resid   17 and  name HD#  ) 5.0 3.2 1.5
assign (resid   17 and  name HG11 )(resid   17 and  name HG12 ) 2.8 1.0 0.3
assign (resid   17 and  name HG11 )(resid   17 and  name HG2# ) 5.0 3.2 1.5
assign (resid   17 and  name HG11 )(resid   17 and  name HD#  ) 2.8 1.0 1.3
assign (resid   17 and  name HG12 )(resid   17 and  name HG2# ) 3.9 2.1 1.4
assign (resid   17 and  name HG12 )(resid   17 and  name HD#  ) 3.9 2.1 1.4
assign (resid   17 and  name HG2# )(resid   17 and  name HD#  ) 2.8 1.0 2.3
!                                                                                                          
assign (resid   17 and  name HN   )(resid   18 and  name HN   ) 2.8 1.0 0.3
assign (resid   17 and  name HA   )(resid   18 and  name HN   ) 5.0 3.2 0.5
assign (resid   17 and  name HB   )(resid   18 and  name HN   ) 3.9 2.1 0.4
assign (resid   17 and  name HG2# )(resid   18 and  name HN   ) 5.0 3.2 1.5
assign (resid   17 and  name HG2# )(resid   18 and  name HA   ) 5.0 3.2 1.5
assign (resid   17 and  name HN   )(resid   19 and  name HN   ) 5.0 3.2 0.5
assign (resid   17 and  name HA   )(resid   20 and  name HN   ) 3.9 2.1 0.4
assign (resid   17 and  name HA   )(resid   20 and  name HB#  ) 2.8 1.0 1.3
assign (resid   17 and  name HA   )(resid   21 and  name HN   ) 5.0 3.2 0.5
!                                                                                                          
! ALA 18                                                                                             
assign (resid   18 and  name HN   )(resid   18 and  name HA   ) 2.8 1.0 0.3
assign (resid   18 and  name HN   )(resid   18 and  name HB#  ) 2.8 1.0 1.3
assign (resid   18 and  name HA   )(resid   18 and  name HB#  ) 2.8 1.0 1.3
!                                                                                                          
assign (resid   18 and  name HN   )(resid   19 and  name HN   ) 2.8 1.0 0.3
assign (resid   18 and  name HB#  )(resid   19 and  name HN   ) 2.8 1.0 1.3
assign (resid   18 and  name HA   )(resid   20 and  name HN   ) 5.0 3.2 0.5
assign (resid   18 and  name HA   )(resid   21 and  name HN   ) 2.8 1.0 0.3
!                                                                                                          
assign (resid   18 and  name HB#  )(resid   22 and  name HD#  ) 5.0 3.2 2.5
!                                                                                                          
! LYS 19                                                                                             
assign (resid   19 and  name HN   )(resid   19 and  name HA   ) 2.8 1.0 0.3
assign (resid   19 and  name HN   )(resid   19 and  name HB#  ) 2.8 1.0 1.3
assign (resid   19 and  name HN   )(resid   19 and  name HG#  ) 5.0 3.2 1.5
assign (resid   19 and  name HN   )(resid   19 and  name HD1  ) 5.0 3.2 0.5
assign (resid   19 and  name HN   )(resid   19 and  name HD2  ) 5.0 3.2 0.5
assign (resid   19 and  name HA   )(resid   19 and  name HD1  ) 5.0 3.2 0.5
assign (resid   19 and  name HA   )(resid   19 and  name HD2  ) 5.0 3.2 0.5
assign (resid   19 and  name HA   )(resid   19 and  name HG#  ) 3.9 2.1 1.4
!                                                                                                          
assign (resid   19 and  name HN   )(resid   20 and  name HN   ) 2.8 1.0 0.3
assign (resid   19 and  name HA   )(resid   20 and  name HN   ) 5.0 3.2 0.5
assign (resid   19 and  name HN   )(resid   21 and  name HN   ) 5.0 3.2 0.5
assign (resid   19 and  name HA   )(resid   22 and  name HN   ) 3.9 2.1 0.4
assign (resid   19 and  name HA   )(resid   22 and  name HB   ) 2.8 1.0 0.3
assign (resid   19 and  name HA   )(resid   22 and  name HG2# ) 5.0 3.2 1.5
assign (resid   19 and  name HA   )(resid   22 and  name HD#  ) 3.9 2.1 1.4
!                                                                                                          
! ARG 20                                                                                             
assign (resid   20 and  name HN   )(resid   20 and  name HA   ) 2.8 1.0 0.3
assign (resid   20 and  name HN   )(resid   20 and  name HB#  ) 2.8 1.0 1.3
assign (resid   20 and  name HN   )(resid   20 and  name HG1  ) 5.0 3.2 0.5
assign (resid   20 and  name HN   )(resid   20 and  name HG2  ) 5.0 3.2 0.5
!                                                                                                          
assign (resid   20 and  name HN   )(resid   21 and  name HN   ) 2.8 1.0 0.3
assign (resid   20 and  name HA   )(resid   21 and  name HN   ) 5.0 3.2 0.5
assign (resid   20 and  name HB#  )(resid   21 and  name HN   ) 2.8 1.0 1.3
assign (resid   20 and  name HN   )(resid   22 and  name HN   ) 5.0 3.2 0.5
assign (resid   20 and  name HA   )(resid   23 and  name HG#  ) 5.0 3.2 1.5
assign (resid   20 and  name HA   )(resid   24 and  name HN   ) 5.0 3.2 0.5
!                                                                                                          
! SER 21                                                                                             
assign (resid   21 and  name HN   )(resid   21 and  name HB1  ) 3.9 2.1 0.4
assign (resid   21 and  name HN   )(resid   21 and  name HB2  ) 5.0 3.2 0.5
assign (resid   21 and  name HA   )(resid   21 and  name HB2  ) 2.8 1.0 0.3
assign (resid   21 and  name HB1  )(resid   21 and  name HB2  ) 2.8 1.0 0.3
!                                                                                                          
assign (resid   21 and  name HN   )(resid   22 and  name HN   ) 2.8 1.0 0.3
assign (resid   21 and  name HA   )(resid   22 and  name HN   ) 3.9 2.1 0.4
assign (resid   21 and  name HB1  )(resid   22 and  name HN   ) 5.0 3.2 0.5
assign (resid   21 and  name HB2  )(resid   22 and  name HN   ) 5.0 3.2 0.5
assign (resid   21 and  name HN   )(resid   23 and  name HN   ) 5.0 3.2 0.5
assign (resid   21 and  name HA   )(resid   24 and  name HN   ) 5.0 3.2 0.5
assign (resid   21 and  name HA   )(resid   24 and  name HB   ) 5.0 3.2 0.5
assign (resid   21 and  name HA   )(resid   24 and  name HG2# ) 5.0 3.2 1.5
assign (resid   21 and  name HA   )(resid   25 and  name HN   ) 5.0 3.2 0.5
!                                                                                                          
! ILE 22                                                                                             
assign (resid   22 and  name HN   )(resid   22 and  name HA   ) 3.9 2.1 0.4
assign (resid   22 and  name HN   )(resid   22 and  name HG11 ) 3.9 2.1 0.4
assign (resid   22 and  name HN   )(resid   22 and  name HG12 ) 5.0 3.2 0.5
assign (resid   22 and  name HN   )(resid   22 and  name HG2# ) 5.0 3.2 1.5
assign (resid   22 and  name HN   )(resid   22 and  name HD#  ) 5.0 3.2 1.5
assign (resid   22 and  name HA   )(resid   22 and  name HG11 ) 3.9 2.1 0.4
assign (resid   22 and  name HA   )(resid   22 and  name HG12 ) 3.9 2.1 0.4
assign (resid   22 and  name HA   )(resid   22 and  name HG2# ) 2.8 1.0 1.3
assign (resid   22 and  name HA   )(resid   22 and  name HD#  ) 5.0 3.2 1.5
assign (resid   22 and  name HB   )(resid   22 and  name HG12 ) 5.0 3.2 0.5
assign (resid   22 and  name HB   )(resid   22 and  name HG2# ) 2.8 1.0 1.3
assign (resid   22 and  name HB   )(resid   22 and  name HD#  ) 3.9 2.1 1.4
assign (resid   22 and  name HG11 )(resid   22 and  name HG12 ) 2.8 1.0 0.3
assign (resid   22 and  name HG11 )(resid   22 and  name HD#  ) 3.9 2.1 1.4
assign (resid   22 and  name HG12 )(resid   22 and  name HD#  ) 3.9 2.1 1.4
!                                                                                                          
assign (resid   22 and  name HN   )(resid   23 and  name HN   ) 2.8 1.0 0.3
assign (resid   22 and  name HA   )(resid   23 and  name HN   ) 3.9 2.1 0.4
assign (resid   22 and  name HN   )(resid   24 and  name HN   ) 5.0 3.2 0.5
assign (resid   22 and  name HA   )(resid   25 and  name HN   ) 5.0 3.2 0.5
assign (resid   22 and  name HA   )(resid   25 and  name HB1  ) 2.8 1.0 0.3
assign (resid   22 and  name HA   )(resid   25 and  name HB2  ) 2.8 1.0 0.3
assign (resid   22 and  name HA   )(resid   25 and  name HG   ) 5.0 3.2 0.5
assign (resid   22 and  name HA   )(resid   25 and  name HD1# ) 5.0 3.2 1.5
assign (resid   22 and  name HA   )(resid   26 and  name HN   ) 5.0 3.2 0.5
!                                                                                                          
!22     HA      25      HD2#    1                                                                
assign (resid   22 and  name HG2# )(resid   26 and  name HG1  ) 5.0 3.2 1.5
assign (resid   22 and  name HG2# )(resid   26 and  name HG2  ) 5.0 3.2 1.5
!                                                                                                          
! LYS 23                                                                                             
assign (resid   23 and  name HN   )(resid   23 and  name HG#  ) 3.9 2.1 1.4
assign (resid   23 and  name HA   )(resid   23 and  name HB1  ) 3.9 2.1 0.4
assign (resid   23 and  name HA   )(resid   23 and  name HB2  ) 2.8 1.0 0.3
assign (resid   23 and  name HA   )(resid   23 and  name HG#  ) 3.9 2.1 1.4
assign (resid   23 and  name HA   )(resid   23 and  name HD#  ) 3.9 2.1 1.4
!                                                                                                          
assign (resid   23 and  name HN   )(resid   24 and  name HN   ) 2.8 1.0 0.3
assign (resid   23 and  name HB1  )(resid   24 and  name HN   ) 3.9 2.1 0.4
assign (resid   23 and  name HB2  )(resid   24 and  name HN   ) 3.9 2.1 0.4
assign (resid   23 and  name HA   )(resid   26 and  name HN   ) 5.0 3.2 0.5
assign (resid   23 and  name HA   )(resid   26 and  name HB1  ) 3.9 2.1 0.4
assign (resid   23 and  name HA   )(resid   26 and  name HB2  ) 3.9 2.1 0.4
assign (resid   23 and  name HA   )(resid   26 and  name HG1  ) 5.0 3.2 0.5
assign (resid   23 and  name HA   )(resid   26 and  name HG2  ) 5.0 3.2 0.5
assign (resid   23 and  name HA   )(resid   27 and  name HN   ) 5.0 3.2 0.5
!                                                                                                          
! THR 24                                                                                             
assign (resid   24 and  name HN   )(resid   24 and  name HA   ) 3.9 2.1 0.4
assign (resid   24 and  name HN   )(resid   24 and  name HB   ) 3.9 2.1 0.4
assign (resid   24 and  name HN   )(resid   24 and  name HG2# ) 5.0 3.2 1.5
assign (resid   24 and  name HA   )(resid   24 and  name HB   ) 3.9 2.1 0.4
assign (resid   24 and  name HA   )(resid   24 and  name HG2# ) 2.8 1.0 1.3
assign (resid   24 and  name HB   )(resid   24 and  name HG2# ) 2.8 1.0 1.3
!                                                                                                          
assign (resid   24 and  name HA   )(resid   25 and  name HN   ) 3.9 2.1 0.4
assign (resid   24 and  name HB   )(resid   25 and  name HN   ) 3.9 2.1 0.4
assign (resid   24 and  name HG2# )(resid   25 and  name HN   ) 3.9 2.1 1.4
assign (resid   24 and  name HN   )(resid   26 and  name HN   ) 5.0 3.2 0.5
assign (resid   24 and  name HA   )(resid   27 and  name HN   ) 5.0 3.2 0.5
assign (resid   24 and  name HA   )(resid   27 and  name HB1  ) 5.0 3.2 0.5
assign (resid   24 and  name HA   )(resid   27 and  name HB2  ) 5.0 3.2 0.5
!                                                                                                          
assign (resid   24 and  name HG2# )(resid   28 and  name HE#  ) 5.0 3.2 2.5
!                                                                                                          
! LEU 25                                                                                             
assign (resid   25 and  name HN   )(resid   25 and  name HA   ) 2.8 1.0 0.3
assign (resid   25 and  name HN   )(resid   25 and  name HB1  ) 3.9 2.1 0.4
assign (resid   25 and  name HN   )(resid   25 and  name HB2  ) 3.9 2.1 0.4
assign (resid   25 and  name HN   )(resid   25 and  name HG   ) 3.9 2.1 0.4
assign (resid   25 and  name HA   )(resid   25 and  name HB1  ) 2.8 1.0 0.3
assign (resid   25 and  name HA   )(resid   25 and  name HB2  ) 3.9 2.1 0.4
assign (resid   25 and  name HA   )(resid   25 and  name HG   ) 3.9 2.1 0.4
assign (resid   25 and  name HA   )(resid   25 and  name HD2# ) 5.0 3.2 1.5
assign (resid   25 and  name HB1  )(resid   25 and  name HD1# ) 3.9 2.1 1.4
assign (resid   25 and  name HB1  )(resid   25 and  name HD2# ) 3.9 2.1 1.4
assign (resid   25 and  name HB2  )(resid   25 and  name HD1# ) 2.8 1.0 1.3
assign (resid   25 and  name HB2  )(resid   25 and  name HD2# ) 2.8 1.0 1.3
assign (resid   25 and  name HG   )(resid   25 and  name HD1# ) 2.8 1.0 1.3
assign (resid   25 and  name HG   )(resid   25 and  name HD2# ) 2.8 1.0 1.3
!                                                                                                          
assign (resid   25 and  name HN   )(resid   26 and  name HN   ) 2.8 1.0 0.3
assign (resid   25 and  name HA   )(resid   26 and  name HN   ) 5.0 3.2 0.5
assign (resid   25 and  name HB1  )(resid   26 and  name HN   ) 3.9 2.1 0.4
assign (resid   25 and  name HB2  )(resid   26 and  name HN   ) 5.0 3.2 0.5
assign (resid   25 and  name HN   )(resid   27 and  name HN   ) 5.0 3.2 0.5
!                                                                                                          
! GLU 26                                                                                             
assign (resid   26 and  name HN   )(resid   26 and  name HA   ) 2.8 1.0 0.3
assign (resid   26 and  name HN   )(resid   26 and  name HB1  ) 3.9 2.1 0.4
assign (resid   26 and  name HN   )(resid   26 and  name HB2  ) 3.9 2.1 0.4
assign (resid   26 and  name HN   )(resid   26 and  name HG1  ) 5.0 3.2 0.5
assign (resid   26 and  name HN   )(resid   26 and  name HG2  ) 5.0 3.2 0.5
assign (resid   26 and  name HA   )(resid   26 and  name HB1  ) 3.9 2.1 0.4
assign (resid   26 and  name HA   )(resid   26 and  name HB2  ) 3.9 2.1 0.4
assign (resid   26 and  name HA   )(resid   26 and  name HG1  ) 5.0 3.2 0.5
assign (resid   26 and  name HA   )(resid   26 and  name HG2  ) 5.0 3.2 0.5
assign (resid   26 and  name HB1  )(resid   26 and  name HB2  ) 2.8 1.0 0.3
assign (resid   26 and  name HB2  )(resid   26 and  name HG1  ) 5.0 3.2 0.5
assign (resid   26 and  name HG1  )(resid   26 and  name HG2  ) 2.8 1.0 0.3
!                                                                                                          
assign (resid   26 and  name HN   )(resid   27 and  name HN   ) 3.9 2.1 0.4
assign (resid   26 and  name HA   )(resid   27 and  name HN   ) 3.9 2.1 0.4
assign (resid   26 and  name HB1  )(resid   27 and  name HN   ) 3.9 2.1 0.4
assign (resid   26 and  name HB2  )(resid   27 and  name HN   ) 5.0 3.2 0.5
assign (resid   26 and  name HN   )(resid   28 and  name HN   ) 5.0 3.2 0.5
assign (resid   26 and  name HA   )(resid   28 and  name HN   ) 5.0 3.2 0.5
assign (resid   26 and  name HA   )(resid   29 and  name HN   ) 5.0 3.2 0.5
assign (resid   26 and  name HA   )(resid   29 and  name HG2  ) 5.0 3.2 0.5
assign (resid   26 and  name HA   )(resid   30 and  name HN   ) 5.0 3.2 0.5
!                                                                                                          
! HIS 27                                                                                             
assign (resid   27 and  name HN   )(resid   27 and  name HA   ) 3.9 2.1 0.4
assign (resid   27 and  name HN   )(resid   27 and  name HB1  ) 3.9 2.1 0.4
assign (resid   27 and  name HN   )(resid   27 and  name HB2  ) 3.9 2.1 0.4
assign (resid   27 and  name HA   )(resid   27 and  name HB1  ) 5.0 3.2 0.5
assign (resid   27 and  name HA   )(resid   27 and  name HB2  ) 3.9 2.1 0.4
!                                                                                                          
assign (resid   27 and  name HN   )(resid   28 and  name HN   ) 3.9 2.1 0.4
assign (resid   27 and  name HA   )(resid   28 and  name HN   ) 5.0 3.2 0.5
assign (resid   27 and  name HB1  )(resid   28 and  name HN   ) 5.0 3.2 0.5
assign (resid   27 and  name HB2  )(resid   28 and  name HN   ) 5.0 3.2 0.5
assign (resid   27 and  name HA   )(resid   30 and  name HN   ) 5.0 3.2 0.5
assign (resid   27 and  name HA   )(resid   30 and  name HB#  ) 3.9 2.1 1.4
assign (resid   27 and  name HA   )(resid   30 and  name HG#  ) 5.0 3.2 1.5
!                                                                                                          
! LYS 28                                                                                             
assign (resid   28 and  name HN   )(resid   28 and  name HA   ) 2.8 1.0 0.3
assign (resid   28 and  name HN   )(resid   28 and  name HB#  ) 2.8 1.0 1.3
assign (resid   28 and  name HN   )(resid   28 and  name HG#  ) 5.0 3.2 1.5
assign (resid   28 and  name HN   )(resid   28 and  name HD1  ) 5.0 3.2 0.5
assign (resid   28 and  name HN   )(resid   28 and  name HD2  ) 5.0 3.2 0.5
!                                                                                                          
assign (resid   28 and  name HA   )(resid   31 and  name HN   ) 5.0 3.2 0.5
assign (resid   28 and  name HA   )(resid   31 and  name HB1  ) 5.0 3.2 0.5
assign (resid   28 and  name HA   )(resid   31 and  name HB2  ) 5.0 3.2 0.5
!                                                                                                          
! ARG 29                                                                                             
assign (resid   29 and  name HN   )(resid   29 and  name HA   ) 2.8 1.0 0.3
assign (resid   29 and  name HN   )(resid   29 and  name HB1  ) 3.9 2.1 0.4
assign (resid   29 and  name HN   )(resid   29 and  name HB2  ) 3.9 2.1 0.4
assign (resid   29 and  name HN   )(resid   29 and  name HG1  ) 5.0 3.2 0.5
assign (resid   29 and  name HN   )(resid   29 and  name HG2  ) 5.0 3.2 0.5
!                                                                                                          
assign (resid   29 and  name HN   )(resid   30 and  name HN   ) 2.8 1.0 0.3
assign (resid   29 and  name HA   )(resid   30 and  name HN   ) 5.0 3.2 0.5
assign (resid   29 and  name HN   )(resid   31 and  name HN   ) 5.0 3.2 0.5
assign (resid   29 and  name HA   )(resid   32 and  name HN   ) 5.0 3.2 0.5
assign (resid   29 and  name HA   )(resid   32 and  name HB#  ) 2.8 1.0 1.3
!                                                                                                          
! GLU 30                                                                                             
assign (resid   30 and  name HN   )(resid   30 and  name HA   ) 2.8 1.0 0.3
assign (resid   30 and  name HN   )(resid   30 and  name HB#  ) 2.8 1.0 1.3
assign (resid   30 and  name HN   )(resid   30 and  name HG#  ) 3.9 2.1 1.4
assign (resid   30 and  name HA   )(resid   30 and  name HB#  ) 2.8 1.0 1.3
assign (resid   30 and  name HA   )(resid   30 and  name HG#  ) 3.9 2.1 1.4
!                                                                                                          
assign (resid   30 and  name HN   )(resid   31 and  name HN   ) 2.8 1.0 0.3
assign (resid   30 and  name HA   )(resid   31 and  name HN   ) 3.9 2.1 0.4
assign (resid   30 and  name HB#  )(resid   31 and  name HN   ) 3.9 2.1 1.4
assign (resid   30 and  name HN   )(resid   32 and  name HN   ) 5.0 3.2 0.5
!                                                                                                          
! ASN 31                                                                                             
assign (resid   31 and  name HN   )(resid   31 and  name HB1  ) 5.0 3.2 0.5
assign (resid   31 and  name HN   )(resid   31 and  name HB2  ) 3.9 2.1 0.4
!                                                                                                          
assign (resid   31 and  name HB1  )(resid   32 and  name HN   ) 5.0 3.2 0.5
assign (resid   31 and  name HB2  )(resid   32 and  name HN   ) 5.0 3.2 0.5
assign (resid   31 and  name HN   )(resid   32 and  name HN   ) 2.8 1.0 0.3
!                                                                               
assign (resid   31 and  name HB1  )(resid   31 and  name HD1  ) 5.0 3.2 0.5
assign (resid   31 and  name HB2  )(resid   31 and  name HD1  ) 3.9 2.1 0.4
assign (resid   31 and  name HB2  )(resid   31 and  name HD2  ) 5.0 3.2 0.5
assign (resid   31 and  name HD1  )(resid   31 and  name HD2  ) 2.8 1.0 0.3
!                                                                                                                                      
! ALA 32                                                                                             
assign (resid   32 and  name HN   )(resid   32 and  name HA   ) 3.9 2.1 0.4
assign (resid   32 and  name HN   )(resid   32 and  name HB#  ) 2.8 1.0 1.3
assign (resid   32 and  name HA   )(resid   32 and  name HB#  ) 2.8 1.0 1.3
!                                                                                                          
assign (resid   32 and  name HA   )(resid   33 and  name HN   ) 3.9 2.1 0.4
assign (resid   32 and  name HB#  )(resid   33 and  name HN   ) 2.8 1.0 1.3
!                                                                                                          
! LYS 33                                                                                             
assign (resid   33 and  name HN   )(resid   33 and  name HA   ) 2.8 1.0 0.3
assign (resid   33 and  name HN   )(resid   33 and  name HB#  ) 2.8 1.0 1.3
assign (resid   33 and  name HN   )(resid   33 and  name HG1  ) 5.0 3.2 0.5
!                                                                                                          
assign (resid   33 and  name HN   )(resid   34 and  name HN   ) 5.0 3.2 0.5
assign (resid   33 and  name HB#  )(resid   34 and  name HN   ) 3.9 2.1 1.4
assign (resid   33 and  name HG#  )(resid   34 and  name HN   ) 5.0 3.2 1.5
!                                                                                                         
! GLU 34                                                                                             
assign (resid   34 and  name HN   )(resid   34 and  name HA   ) 2.8 1.0 0.3
assign (resid   34 and  name HN   )(resid   34 and  name HG#  ) 5.0 3.2 1.5
assign (resid   34 and  name HN   )(resid   34 and  name HB1  ) 5.0 3.2 0.5
assign (resid   34 and  name HA   )(resid   34 and  name HB1  ) 2.8 1.0 0.3
assign (resid   34 and  name HA   )(resid   34 and  name HB2  ) 2.8 1.0 0.3
assign (resid   34 and  name HA   )(resid   34 and  name HG#  ) 5.0 3.2 1.5


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    CYS   1          1H        CYS   1 -21.177   6.548   5.178
    2   2H    CYS   1          2H        CYS   1 -22.775   7.101   5.003
    3   3H    CYS   1          3H        CYS   1 -22.371   6.073   6.285
    4    HA   CYS   1           HA       CYS   1 -23.534   4.829   4.556
    5   1HB   CYS   1          1HB       CYS   1 -21.347   6.126   2.935
    6   2HB   CYS   1          2HB       CYS   1 -22.103   4.636   2.381
    7    HG   CYS   1           HG       CYS   1 -23.592   6.485   1.402
    8    H    ALA   2           H        ALA   2 -22.975   2.594   4.311
    9    HA   ALA   2           HA       ALA   2 -20.634   1.712   5.872
   10   1HB   ALA   2          1HB       ALA   2 -22.971   0.305   4.541
   11   2HB   ALA   2          2HB       ALA   2 -21.736  -0.537   5.474
   12   3HB   ALA   2          3HB       ALA   2 -22.776   0.652   6.259
   13    H    VAL   3           H        VAL   3 -19.175   2.689   4.167
   14    HA   VAL   3           HA       VAL   3 -18.956   1.342   1.584
   15    HB   VAL   3           HB       VAL   3 -17.053   2.818   1.225
   16   1HG1  VAL   3          1HG1      VAL   3 -19.448   3.648   1.071
   17   2HG1  VAL   3          2HG1      VAL   3 -19.183   4.422   2.634
   18   3HG1  VAL   3          3HG1      VAL   3 -18.204   4.886   1.242
   19   1HG2  VAL   3          1HG2      VAL   3 -17.362   3.438   4.178
   20   2HG2  VAL   3          2HG2      VAL   3 -15.926   2.865   3.332
   21   3HG2  VAL   3          3HG2      VAL   3 -16.509   4.507   3.068
   22    H    GLU   4           H        GLU   4 -17.403   0.917   4.725
   23    HA   GLU   4           HA       GLU   4 -15.821  -1.320   3.531
   24   1HB   GLU   4          1HB       GLU   4 -14.009  -0.721   5.068
   25   2HB   GLU   4          2HB       GLU   4 -14.377   0.602   3.969
   26   1HG   GLU   4          1HG       GLU   4 -15.289   1.919   5.661
   27   2HG   GLU   4          2HG       GLU   4 -15.722   0.528   6.656
   28    H    LEU   5           H        LEU   5 -18.394  -1.535   4.722
   29    HA   LEU   5           HA       LEU   5 -17.923  -2.782   7.391
   30   1HB   LEU   5          1HB       LEU   5 -19.750  -1.006   6.813
   31   2HB   LEU   5          2HB       LEU   5 -20.583  -2.342   6.024
   32    HG   LEU   5           HG       LEU   5 -20.109  -3.577   8.322
   33   1HD1  LEU   5          1HD1      LEU   5 -20.022  -0.633   9.039
   34   2HD1  LEU   5          2HD1      LEU   5 -20.334  -1.919  10.204
   35   3HD1  LEU   5          3HD1      LEU   5 -18.784  -1.846   9.365
   36   1HD2  LEU   5          1HD2      LEU   5 -22.349  -3.060   7.371
   37   2HD2  LEU   5          2HD2      LEU   5 -22.311  -2.819   9.116
   38   3HD2  LEU   5          3HD2      LEU   5 -22.240  -1.429   8.034
   39    H    ARG   6           H        ARG   6 -19.703  -3.452   4.349
   40    HA   ARG   6           HA       ARG   6 -19.309  -6.384   4.812
   41   1HB   ARG   6          1HB       ARG   6 -21.630  -5.150   4.608
   42   2HB   ARG   6          2HB       ARG   6 -21.286  -5.200   2.879
   43   1HG   ARG   6          1HG       ARG   6 -20.676  -7.779   3.897
   44   2HG   ARG   6          2HG       ARG   6 -22.221  -7.315   4.599
   45   1HD   ARG   6          1HD       ARG   6 -22.786  -8.370   2.542
   46   2HD   ARG   6          2HD       ARG   6 -22.902  -6.638   2.184
   47    HE   ARG   6           HE       ARG   6 -20.824  -6.761   0.973
   48   1HH1  ARG   6          1HH2      ARG   6 -22.306  -9.484   0.385
   49   2HH1  ARG   6          2HH2      ARG   6 -20.947 -10.552   0.384
   50   1HH2  ARG   6          1HH1      ARG   6 -18.812  -8.213   1.871
   51   2HH2  ARG   6          2HH1      ARG   6 -18.933  -9.821   1.241
   52    H    SER   7           H        SER   7 -19.290  -3.885   2.223
   53    HA   SER   7           HA       SER   7 -17.325  -5.574   0.710
   54   1HB   SER   7          1HB       SER   7 -19.673  -3.933  -0.304
   55   2HB   SER   7          2HB       SER   7 -18.466  -4.684  -1.336
   56    HG   SER   7           HG       SER   7 -19.632  -6.431  -1.151
   57    HA   PRO   8           HA       PRO   8 -15.394  -1.506   1.373
   58   1HB   PRO   8          1HB       PRO   8 -12.816  -2.388   1.392
   59   2HB   PRO   8          2HB       PRO   8 -13.879  -2.446   2.813
   60   1HG   PRO   8          1HG       PRO   8 -13.009  -4.614   1.028
   61   2HG   PRO   8          2HG       PRO   8 -13.458  -4.659   2.738
   62   1HD   PRO   8          1HD       PRO   8 -15.048  -5.468   0.598
   63   2HD   PRO   8          2HD       PRO   8 -15.593  -5.179   2.264
   64    H    GLY   9           H        GLY   9 -16.200  -1.009  -0.815
   65   1HA   GLY   9          1HA       GLY   9 -14.820  -1.815  -3.207
   66   2HA   GLY   9          2HA       GLY   9 -15.938  -0.458  -3.076
   67    H    ILE  10           H        ILE  10 -13.093  -0.884  -4.222
   68    HA   ILE  10           HA       ILE  10 -11.336   0.511  -4.774
   69    HB   ILE  10           HB       ILE  10 -12.500   2.462  -2.772
   70   1HG1  ILE  10          1HG1      ILE  10 -12.844   3.043  -5.632
   71   2HG1  ILE  10          2HG1      ILE  10 -13.738   1.610  -5.106
   72   1HG2  ILE  10          1HG2      ILE  10 -10.089   2.758  -3.546
   73   2HG2  ILE  10          2HG2      ILE  10 -10.754   3.068  -5.151
   74   3HG2  ILE  10          3HG2      ILE  10 -11.174   4.123  -3.802
   75   1HD1  ILE  10          1HD1      ILE  10 -13.826   4.302  -3.719
   76   2HD1  ILE  10          2HD1      ILE  10 -15.077   3.679  -4.797
   77   3HD1  ILE  10          3HD1      ILE  10 -14.744   2.868  -3.265
   78    H    SER  11           H        SER  11 -12.039   0.520  -1.268
   79    HA   SER  11           HA       SER  11  -9.468   0.982  -0.301
   80   1HB   SER  11          1HB       SER  11 -11.820   0.585   0.861
   81   2HB   SER  11          2HB       SER  11 -11.182  -1.037   1.080
   82    HG   SER  11           HG       SER  11  -9.360  -0.073   2.101
   83    H    ARG  12           H        ARG  12 -10.776  -2.155  -1.411
   84    HA   ARG  12           HA       ARG  12  -8.500  -3.717  -0.537
   85   1HB   ARG  12          1HB       ARG  12 -10.942  -4.375  -1.263
   86   2HB   ARG  12          2HB       ARG  12 -10.241  -4.455  -2.877
   87   1HG   ARG  12          1HG       ARG  12  -8.484  -5.795  -1.033
   88   2HG   ARG  12          2HG       ARG  12 -10.116  -6.417  -0.819
   89   1HD   ARG  12          1HD       ARG  12  -9.452  -6.111  -3.651
   90   2HD   ARG  12          2HD       ARG  12  -8.330  -7.201  -2.817
   91    HE   ARG  12           HE       ARG  12 -11.305  -7.531  -2.700
   92   1HH1  ARG  12          1HH1      ARG  12  -9.717  -9.032  -0.669
   93   2HH1  ARG  12          2HH1      ARG  12  -9.460 -10.557  -1.441
   94   1HH2  ARG  12          1HH2      ARG  12 -10.274  -9.355  -4.620
   95   2HH2  ARG  12          2HH2      ARG  12  -9.780 -10.743  -3.715
   96    H    PHE  13           H        PHE  13  -9.087  -1.714  -3.375
   97    HA   PHE  13           HA       PHE  13  -6.671  -2.781  -4.722
   98   1HB   PHE  13          1HB       PHE  13  -7.990  -2.585  -6.514
   99   2HB   PHE  13          2HB       PHE  13  -9.268  -1.957  -5.504
  100    HD1  PHE  13           HD1      PHE  13  -9.493   0.539  -5.215
  101    HD2  PHE  13           HD2      PHE  13  -6.764  -1.203  -8.033
  102    HE1  PHE  13           HE1      PHE  13  -9.339   2.707  -6.400
  103    HE2  PHE  13           HE2      PHE  13  -6.612   0.970  -9.221
  104    HZ   PHE  13           HZ       PHE  13  -7.907   2.926  -8.395
  105    H    ARG  14           H        ARG  14  -7.857   0.160  -3.108
  106    HA   ARG  14           HA       ARG  14  -5.855   1.963  -4.052
  107   1HB   ARG  14          1HB       ARG  14  -6.590   3.392  -2.315
  108   2HB   ARG  14          2HB       ARG  14  -8.008   2.437  -2.726
  109   1HG   ARG  14          1HG       ARG  14  -7.707   1.038  -0.784
  110   2HG   ARG  14          2HG       ARG  14  -6.132   1.741  -0.449
  111   1HD   ARG  14          1HD       ARG  14  -7.780   3.970  -0.460
  112   2HD   ARG  14          2HD       ARG  14  -8.795   2.722   0.292
  113    HE   ARG  14           HE       ARG  14  -7.073   2.371   1.979
  114   1HH1  ARG  14          1HH2      ARG  14  -7.518   5.445   1.732
  115   2HH1  ARG  14          2HH2      ARG  14  -5.888   6.003   1.864
  116   1HH2  ARG  14          1HH1      ARG  14  -4.505   2.841   1.298
  117   2HH2  ARG  14          2HH1      ARG  14  -4.150   4.503   1.614
  118    H    ARG  15           H        ARG  15  -5.830  -0.359  -1.366
  119    HA   ARG  15           HA       ARG  15  -3.296   0.420  -0.240
  120   1HB   ARG  15          1HB       ARG  15  -5.096  -1.992  -0.120
  121   2HB   ARG  15          2HB       ARG  15  -3.498  -2.052   0.622
  122   1HG   ARG  15          1HG       ARG  15  -4.040   0.018   1.896
  123   2HG   ARG  15          2HG       ARG  15  -5.674  -0.031   1.231
  124   1HD   ARG  15          1HD       ARG  15  -6.209  -2.037   2.376
  125   2HD   ARG  15          2HD       ARG  15  -4.508  -2.389   2.726
  126    HE   ARG  15           HE       ARG  15  -4.830   0.028   3.976
  127   1HH1  ARG  15          1HH2      ARG  15  -4.562  -2.342   5.670
  128   2HH1  ARG  15          2HH2      ARG  15  -6.063  -2.399   6.526
  129   1HH2  ARG  15          1HH1      ARG  15  -7.686  -0.249   4.283
  130   2HH2  ARG  15          2HH1      ARG  15  -7.871  -1.186   5.722
  131    H    LYS  16           H        LYS  16  -4.212  -1.849  -2.838
  132    HA   LYS  16           HA       LYS  16  -1.629  -3.081  -3.133
  133   1HB   LYS  16          1HB       LYS  16  -4.164  -3.372  -4.234
  134   2HB   LYS  16          2HB       LYS  16  -3.233  -2.739  -5.588
  135   1HG   LYS  16          1HG       LYS  16  -2.040  -4.956  -3.967
  136   2HG   LYS  16          2HG       LYS  16  -3.339  -5.348  -5.088
  137   1HD   LYS  16          1HD       LYS  16  -1.104  -3.634  -6.095
  138   2HD   LYS  16          2HD       LYS  16  -0.787  -5.352  -5.855
  139   1HE   LYS  16          1HE       LYS  16  -3.039  -5.685  -7.178
  140   2HE   LYS  16          2HE       LYS  16  -2.715  -4.043  -7.761
  141   1HZ   LYS  16          1HZ       LYS  16  -0.441  -4.788  -8.341
  142   2HZ   LYS  16          2HZ       LYS  16  -0.885  -6.382  -7.940
  143   3HZ   LYS  16          3HZ       LYS  16  -1.647  -5.579  -9.226
  144    H    ILE  17           H        ILE  17  -3.056  -0.102  -4.448
  145    HA   ILE  17           HA       ILE  17  -0.938   0.533  -6.311
  146    HB   ILE  17           HB       ILE  17  -2.859   2.329  -4.767
  147   1HG1  ILE  17          1HG1      ILE  17  -3.260   1.465  -7.625
  148   2HG1  ILE  17          2HG1      ILE  17  -3.801   0.418  -6.313
  149   1HG2  ILE  17          1HG2      ILE  17  -0.922   3.490  -5.878
  150   2HG2  ILE  17          2HG2      ILE  17  -1.505   2.866  -7.421
  151   3HG2  ILE  17          3HG2      ILE  17  -2.504   3.976  -6.485
  152   1HD1  ILE  17          1HD1      ILE  17  -4.774   2.815  -5.463
  153   2HD1  ILE  17          2HD1      ILE  17  -4.878   3.021  -7.212
  154   3HD1  ILE  17          3HD1      ILE  17  -5.698   1.669  -6.431
  155    H    ALA  18           H        ALA  18  -1.651   1.421  -2.931
  156    HA   ALA  18           HA       ALA  18   0.687   3.022  -2.444
  157   1HB   ALA  18          1HB       ALA  18  -1.267   1.506  -0.693
  158   2HB   ALA  18          2HB       ALA  18   0.015   2.514  -0.024
  159   3HB   ALA  18          3HB       ALA  18  -1.240   3.235  -1.031
  160    H    LYS  19           H        LYS  19   0.022  -0.478  -1.938
  161    HA   LYS  19           HA       LYS  19   2.463  -1.132  -0.603
  162   1HB   LYS  19          1HB       LYS  19   0.397  -2.584  -2.224
  163   2HB   LYS  19          2HB       LYS  19   1.899  -3.422  -1.830
  164   1HG   LYS  19          1HG       LYS  19   1.545  -2.829   0.576
  165   2HG   LYS  19          2HG       LYS  19  -0.025  -2.157   0.138
  166   1HD   LYS  19          1HD       LYS  19  -0.818  -4.309  -0.610
  167   2HD   LYS  19          2HD       LYS  19   0.786  -5.020  -0.435
  168   1HE   LYS  19          1HE       LYS  19   0.565  -5.289   1.822
  169   2HE   LYS  19          2HE       LYS  19  -0.262  -3.735   2.027
  170   1HZ   LYS  19          1HZ       LYS  19  -2.247  -4.723   0.994
  171   2HZ   LYS  19          2HZ       LYS  19  -1.460  -6.224   0.923
  172   3HZ   LYS  19          3HZ       LYS  19  -1.804  -5.515   2.428
  173    H    ARG  20           H        ARG  20   1.803  -0.455  -3.996
  174    HA   ARG  20           HA       ARG  20   4.281  -1.640  -5.009
  175   1HB   ARG  20          1HB       ARG  20   2.117  -1.467  -6.258
  176   2HB   ARG  20          2HB       ARG  20   2.288   0.287  -6.248
  177   1HG   ARG  20          1HG       ARG  20   4.519  -0.017  -7.403
  178   2HG   ARG  20          2HG       ARG  20   4.114  -1.722  -7.590
  179   1HD   ARG  20          1HD       ARG  20   2.985  -1.192  -9.474
  180   2HD   ARG  20          2HD       ARG  20   1.835  -0.282  -8.481
  181    HE   ARG  20           HE       ARG  20   4.285   1.218  -9.016
  182   1HH1  ARG  20          1HH1      ARG  20   1.546   2.422  -8.723
  183   2HH1  ARG  20          2HH1      ARG  20   1.179   2.888 -10.348
  184   1HH2  ARG  20          1HH2      ARG  20   3.674   0.882 -11.745
  185   2HH2  ARG  20          2HH2      ARG  20   2.403   2.003 -12.084
  186    H    SER  21           H        SER  21   3.079   1.647  -4.205
  187    HA   SER  21           HA       SER  21   5.537   2.986  -5.067
  188   1HB   SER  21          1HB       SER  21   3.069   3.824  -4.945
  189   2HB   SER  21          2HB       SER  21   3.424   4.121  -3.249
  190    HG   SER  21           HG       SER  21   5.142   5.467  -3.935
  191    H    ILE  22           H        ILE  22   4.023   2.319  -1.885
  192    HA   ILE  22           HA       ILE  22   6.039   3.432  -0.234
  193    HB   ILE  22           HB       ILE  22   3.937   1.298   0.106
  194   1HG1  ILE  22          1HG1      ILE  22   4.321   3.996   1.428
  195   2HG1  ILE  22          2HG1      ILE  22   3.419   3.771  -0.069
  196   1HG2  ILE  22          1HG2      ILE  22   6.070   2.106   2.079
  197   2HG2  ILE  22          2HG2      ILE  22   4.475   1.609   2.637
  198   3HG2  ILE  22          3HG2      ILE  22   5.467   0.493   1.701
  199   1HD1  ILE  22          1HD1      ILE  22   1.947   2.133   1.134
  200   2HD1  ILE  22          2HD1      ILE  22   2.784   2.546   2.630
  201   3HD1  ILE  22          3HD1      ILE  22   1.845   3.772   1.778
  202    H    LYS  23           H        LYS  23   5.897   0.143  -1.667
  203    HA   LYS  23           HA       LYS  23   8.075  -1.008  -0.246
  204   1HB   LYS  23          1HB       LYS  23   6.422  -2.066  -1.914
  205   2HB   LYS  23          2HB       LYS  23   7.492  -1.462  -3.182
  206   1HG   LYS  23          1HG       LYS  23   9.364  -2.630  -1.729
  207   2HG   LYS  23          2HG       LYS  23   8.010  -3.568  -1.109
  208   1HD   LYS  23          1HD       LYS  23   8.459  -4.895  -2.905
  209   2HD   LYS  23          2HD       LYS  23   7.482  -3.706  -3.763
  210   1HE   LYS  23          1HE       LYS  23  10.051  -2.577  -3.721
  211   2HE   LYS  23          2HE       LYS  23  10.324  -4.295  -4.057
  212   1HZ   LYS  23          1HZ       LYS  23   8.639  -4.203  -5.785
  213   2HZ   LYS  23          2HZ       LYS  23   8.375  -2.550  -5.478
  214   3HZ   LYS  23          3HZ       LYS  23   9.867  -3.080  -6.095
  215    H    THR  24           H        THR  24   8.051   1.046  -3.172
  216    HA   THR  24           HA       THR  24  10.877   0.947  -3.715
  217    HB   THR  24           HB       THR  24   8.986   3.250  -4.281
  218    HG1  THR  24           HG1      THR  24   9.276   0.799  -5.695
  219   1HG2  THR  24          1HG2      THR  24  11.358   3.579  -4.871
  220   2HG2  THR  24          2HG2      THR  24  11.314   2.110  -5.849
  221   3HG2  THR  24          3HG2      THR  24  10.334   3.504  -6.305
  222    H    LEU  25           H        LEU  25   8.858   3.055  -1.667
  223    HA   LEU  25           HA       LEU  25  10.866   4.967  -0.929
  224   1HB   LEU  25          1HB       LEU  25   8.166   4.609  -0.533
  225   2HB   LEU  25          2HB       LEU  25   8.792   4.218   1.061
  226    HG   LEU  25           HG       LEU  25   8.209   6.594   0.862
  227   1HD1  LEU  25          1HD1      LEU  25  10.152   5.784   2.290
  228   2HD1  LEU  25          2HD1      LEU  25  11.219   6.337   1.001
  229   3HD1  LEU  25          3HD1      LEU  25  10.189   7.490   1.847
  230   1HD2  LEU  25          1HD2      LEU  25   9.001   6.521  -1.683
  231   2HD2  LEU  25          2HD2      LEU  25   9.045   8.021  -0.756
  232   3HD2  LEU  25          3HD2      LEU  25  10.518   7.079  -0.980
  233    H    GLU  26           H        GLU  26   9.744   1.932   0.571
  234    HA   GLU  26           HA       GLU  26  11.472   1.881   2.856
  235   1HB   GLU  26          1HB       GLU  26   9.711   0.063   1.338
  236   2HB   GLU  26          2HB       GLU  26  11.042  -0.755   2.151
  237   1HG   GLU  26          1HG       GLU  26  10.106  -0.470   4.174
  238   2HG   GLU  26          2HG       GLU  26   9.810   1.241   3.879
  239    H    HIS  27           H        HIS  27  11.860   0.614  -0.456
  240    HA   HIS  27           HA       HIS  27  14.560  -0.430   0.099
  241   1HB   HIS  27          1HB       HIS  27  12.754  -0.302  -2.333
  242   2HB   HIS  27          2HB       HIS  27  14.377  -0.980  -2.390
  243    HD1  HIS  27           HD1      HIS  27  11.054  -1.506  -0.614
  244    HD2  HIS  27           HD2      HIS  27  14.557  -3.608  -1.458
  245    HE1  HIS  27           HE1      HIS  27  10.660  -3.889   0.143
  246    H    LYS  28           H        LYS  28  14.646   2.234   0.683
  247    HA   LYS  28           HA       LYS  28  16.172   3.413  -1.598
  248   1HB   LYS  28          1HB       LYS  28  13.697   4.243  -0.889
  249   2HB   LYS  28          2HB       LYS  28  14.640   5.206   0.244
  250   1HG   LYS  28          1HG       LYS  28  15.208   5.103  -2.730
  251   2HG   LYS  28          2HG       LYS  28  14.179   6.320  -1.977
  252   1HD   LYS  28          1HD       LYS  28  16.026   7.082  -0.579
  253   2HD   LYS  28          2HD       LYS  28  17.070   5.811  -1.217
  254   1HE   LYS  28          1HE       LYS  28  16.223   6.999  -3.540
  255   2HE   LYS  28          2HE       LYS  28  16.300   8.390  -2.444
  256   1HZ   LYS  28          1HZ       LYS  28  18.528   7.654  -1.761
  257   2HZ   LYS  28          2HZ       LYS  28  18.465   6.406  -2.916
  258   3HZ   LYS  28          3HZ       LYS  28  18.456   8.022  -3.417
  259    H    ARG  29           H        ARG  29  15.480   4.337   1.824
  260    HA   ARG  29           HA       ARG  29  18.341   4.868   2.221
  261   1HB   ARG  29          1HB       ARG  29  17.624   5.794   4.350
  262   2HB   ARG  29          2HB       ARG  29  16.559   6.366   3.078
  263   1HG   ARG  29          1HG       ARG  29  14.809   5.610   4.262
  264   2HG   ARG  29          2HG       ARG  29  15.399   3.965   4.049
  265   1HD   ARG  29          1HD       ARG  29  16.216   3.847   6.176
  266   2HD   ARG  29          2HD       ARG  29  16.805   5.518   6.151
  267    HE   ARG  29           HE       ARG  29  14.706   6.242   6.972
  268   1HH1  ARG  29          1HH2      ARG  29  14.542   3.556   8.320
  269   2HH1  ARG  29          2HH2      ARG  29  12.986   2.991   7.818
  270   1HH2  ARG  29          1HH1      ARG  29  12.696   5.302   5.227
  271   2HH2  ARG  29          2HH1      ARG  29  11.930   3.997   6.059
  272    H    GLU  30           H        GLU  30  16.141   2.218   2.860
  273    HA   GLU  30           HA       GLU  30  18.026   0.972   4.789
  274   1HB   GLU  30          1HB       GLU  30  15.255   0.285   3.775
  275   2HB   GLU  30          2HB       GLU  30  16.166  -0.759   4.862
  276   1HG   GLU  30          1HG       GLU  30  15.762   0.557   6.658
  277   2HG   GLU  30          2HG       GLU  30  16.095   2.035   5.759
  278    H    ASN  31           H        ASN  31  17.583   1.058   1.389
  279    HA   ASN  31           HA       ASN  31  18.801  -1.660   1.070
  280   1HB   ASN  31          1HB       ASN  31  16.446  -0.762   0.096
  281   2HB   ASN  31          2HB       ASN  31  17.508  -0.215  -1.199
  282   1HD2  ASN  31          2HD2      ASN  31  18.868  -1.947  -2.288
  283   2HD2  ASN  31          1HD2      ASN  31  18.311  -3.552  -2.270
  284    H    ALA  32           H        ALA  32  20.441   0.557   1.782
  285    HA   ALA  32           HA       ALA  32  22.183   0.770  -0.613
  286   1HB   ALA  32          1HB       ALA  32  20.924   3.089   0.872
  287   2HB   ALA  32          2HB       ALA  32  22.269   3.267  -0.255
  288   3HB   ALA  32          3HB       ALA  32  20.712   2.668  -0.826
  289    H    LYS  33           H        LYS  33  24.343   0.842  -0.016
  290    HA   LYS  33           HA       LYS  33  26.246   0.685   1.299
  291   1HB   LYS  33          1HB       LYS  33  24.660   2.714   2.906
  292   2HB   LYS  33          2HB       LYS  33  26.390   2.441   3.056
  293   1HG   LYS  33          1HG       LYS  33  25.081   3.211   0.436
  294   2HG   LYS  33          2HG       LYS  33  25.692   4.397   1.583
  295   1HD   LYS  33          1HD       LYS  33  27.696   4.172   0.588
  296   2HD   LYS  33          2HD       LYS  33  27.795   2.577   1.332
  297   1HE   LYS  33          1HE       LYS  33  26.673   1.586  -0.651
  298   2HE   LYS  33          2HE       LYS  33  26.629   3.187  -1.411
  299   1HZ   LYS  33          1HZ       LYS  33  29.044   3.319  -1.189
  300   2HZ   LYS  33          2HZ       LYS  33  29.080   1.758  -0.513
  301   3HZ   LYS  33          3HZ       LYS  33  28.589   1.983  -2.122
  302    H    GLU  34           H        GLU  34  25.409   1.234   4.482
  303    HA   GLU  34           HA       GLU  34  24.396  -1.484   5.054
  304   1HB   GLU  34          1HB       GLU  34  26.865  -1.611   4.716
  305   2HB   GLU  34          2HB       GLU  34  27.077  -0.439   6.013
  306   1HG   GLU  34          1HG       GLU  34  25.376  -2.700   6.790
  307   2HG   GLU  34          2HG       GLU  34  27.004  -3.191   6.327
  Start of MODEL    2
    1   1H    CYS   1          1H        CYS   1 -24.297  -8.459   2.359
    2   2H    CYS   1          2H        CYS   1 -25.497  -9.360   1.559
    3   3H    CYS   1          3H        CYS   1 -25.168  -7.772   1.075
    4    HA   CYS   1           HA       CYS   1 -27.161  -7.649   2.328
    5   1HB   CYS   1          1HB       CYS   1 -25.642  -9.644   3.955
    6   2HB   CYS   1          2HB       CYS   1 -26.782  -8.609   4.812
    7    HG   CYS   1           HG       CYS   1 -27.579 -10.945   3.150
    8    H    ALA   2           H        ALA   2 -27.050  -5.478   2.697
    9    HA   ALA   2           HA       ALA   2 -26.393  -3.377   3.521
   10   1HB   ALA   2          1HB       ALA   2 -27.348  -4.509   5.484
   11   2HB   ALA   2          2HB       ALA   2 -25.752  -5.139   5.893
   12   3HB   ALA   2          3HB       ALA   2 -26.052  -3.403   5.940
   13    H    VAL   3           H        VAL   3 -24.211  -4.935   2.108
   14    HA   VAL   3           HA       VAL   3 -21.905  -4.984   1.785
   15    HB   VAL   3           HB       VAL   3 -20.986  -2.805   1.607
   16   1HG1  VAL   3          1HG1      VAL   3 -23.064  -3.474   0.196
   17   2HG1  VAL   3          2HG1      VAL   3 -23.906  -2.259   1.159
   18   3HG1  VAL   3          3HG1      VAL   3 -22.521  -1.797   0.170
   19   1HG2  VAL   3          1HG2      VAL   3 -21.680  -2.087   3.944
   20   2HG2  VAL   3          2HG2      VAL   3 -21.823  -0.847   2.703
   21   3HG2  VAL   3          3HG2      VAL   3 -23.260  -1.700   3.269
   22    H    GLU   4           H        GLU   4 -22.744  -5.600   4.639
   23    HA   GLU   4           HA       GLU   4 -21.785  -6.092   6.652
   24   1HB   GLU   4          1HB       GLU   4 -19.514  -5.972   4.730
   25   2HB   GLU   4          2HB       GLU   4 -19.117  -6.062   6.445
   26   1HG   GLU   4          1HG       GLU   4 -21.150  -7.929   5.236
   27   2HG   GLU   4          2HG       GLU   4 -19.424  -8.292   5.163
   28    H    LEU   5           H        LEU   5 -22.078  -3.105   5.705
   29    HA   LEU   5           HA       LEU   5 -21.759  -0.991   6.546
   30   1HB   LEU   5          1HB       LEU   5 -21.566  -2.676   9.051
   31   2HB   LEU   5          2HB       LEU   5 -21.902  -0.944   9.028
   32    HG   LEU   5           HG       LEU   5 -23.583  -2.907   7.459
   33   1HD1  LEU   5          1HD1      LEU   5 -23.559  -3.499   9.906
   34   2HD1  LEU   5          2HD1      LEU   5 -24.232  -1.899  10.230
   35   3HD1  LEU   5          3HD1      LEU   5 -25.140  -3.059   9.260
   36   1HD2  LEU   5          1HD2      LEU   5 -23.763  -0.502   6.888
   37   2HD2  LEU   5          2HD2      LEU   5 -25.257  -1.113   7.596
   38   3HD2  LEU   5          3HD2      LEU   5 -24.155  -0.139   8.570
   39    H    ARG   6           H        ARG   6 -19.221  -2.661   5.879
   40    HA   ARG   6           HA       ARG   6 -17.271  -0.635   6.567
   41   1HB   ARG   6          1HB       ARG   6 -15.919  -2.015   8.030
   42   2HB   ARG   6          2HB       ARG   6 -17.557  -1.918   8.657
   43   1HG   ARG   6          1HG       ARG   6 -17.524  -4.164   8.774
   44   2HG   ARG   6          2HG       ARG   6 -17.621  -4.169   7.016
   45   1HD   ARG   6          1HD       ARG   6 -14.953  -3.776   7.312
   46   2HD   ARG   6          2HD       ARG   6 -15.288  -4.723   8.776
   47    HE   ARG   6           HE       ARG   6 -16.166  -5.639   6.061
   48   1HH1  ARG   6          1HH2      ARG   6 -13.488  -6.523   7.182
   49   2HH1  ARG   6          2HH2      ARG   6 -13.883  -8.055   7.876
   50   1HH2  ARG   6          1HH1      ARG   6 -17.334  -7.445   7.823
   51   2HH2  ARG   6          2HH1      ARG   6 -16.106  -8.586   8.245
   52    H    SER   7           H        SER   7 -18.323  -2.277   4.141
   53    HA   SER   7           HA       SER   7 -16.153  -3.963   3.263
   54   1HB   SER   7          1HB       SER   7 -17.365  -3.667   1.021
   55   2HB   SER   7          2HB       SER   7 -18.297  -4.347   2.340
   56    HG   SER   7           HG       SER   7 -18.378  -1.771   1.183
   57    HA   PRO   8           HA       PRO   8 -13.497  -0.614   1.975
   58   1HB   PRO   8          1HB       PRO   8 -11.461  -2.120   0.983
   59   2HB   PRO   8          2HB       PRO   8 -11.757  -1.869   2.715
   60   1HG   PRO   8          1HG       PRO   8 -12.229  -4.243   1.060
   61   2HG   PRO   8          2HG       PRO   8 -11.934  -4.106   2.798
   62   1HD   PRO   8          1HD       PRO   8 -14.412  -4.520   1.536
   63   2HD   PRO   8          2HD       PRO   8 -14.127  -4.159   3.252
   64    H    GLY   9           H        GLY   9 -13.600  -3.279  -0.490
   65   1HA   GLY   9          1HA       GLY   9 -13.856  -3.190  -2.813
   66   2HA   GLY   9          2HA       GLY   9 -14.786  -1.713  -2.552
   67    H    ILE  10           H        ILE  10 -13.872   0.214  -3.117
   68    HA   ILE  10           HA       ILE  10 -11.534   0.390  -4.706
   69    HB   ILE  10           HB       ILE  10 -13.517   1.917  -4.563
   70   1HG1  ILE  10          1HG1      ILE  10 -11.198   2.423  -5.616
   71   2HG1  ILE  10          2HG1      ILE  10 -12.368   3.717  -5.423
   72   1HG2  ILE  10          1HG2      ILE  10 -12.142   2.954  -2.083
   73   2HG2  ILE  10          2HG2      ILE  10 -13.413   3.812  -2.950
   74   3HG2  ILE  10          3HG2      ILE  10 -13.757   2.253  -2.202
   75   1HD1  ILE  10          1HD1      ILE  10 -10.622   3.438  -3.083
   76   2HD1  ILE  10          2HD1      ILE  10  -9.726   3.760  -4.565
   77   3HD1  ILE  10          3HD1      ILE  10 -10.993   4.868  -4.046
   78    H    SER  11           H        SER  11 -11.936   0.704  -1.189
   79    HA   SER  11           HA       SER  11  -9.352   1.801  -0.584
   80   1HB   SER  11          1HB       SER  11 -10.905  -0.094   1.186
   81   2HB   SER  11          2HB       SER  11  -9.896   1.260   1.660
   82    HG   SER  11           HG       SER  11 -11.483   2.651   0.924
   83    H    ARG  12           H        ARG  12 -10.491  -1.547  -1.049
   84    HA   ARG  12           HA       ARG  12  -8.079  -2.891  -0.208
   85   1HB   ARG  12          1HB       ARG  12 -10.649  -3.570  -1.177
   86   2HB   ARG  12          2HB       ARG  12  -9.532  -4.199  -2.385
   87   1HG   ARG  12          1HG       ARG  12  -8.305  -4.933  -0.026
   88   2HG   ARG  12          2HG       ARG  12 -10.016  -5.100   0.370
   89   1HD   ARG  12          1HD       ARG  12 -10.337  -6.500  -1.669
   90   2HD   ARG  12          2HD       ARG  12  -8.595  -6.393  -1.988
   91    HE   ARG  12           HE       ARG  12  -8.314  -7.394   0.365
   92   1HH1  ARG  12          1HH1      ARG  12 -11.200  -7.577   1.063
   93   2HH1  ARG  12          2HH1      ARG  12 -11.585  -9.211   0.646
   94   1HH2  ARG  12          1HH2      ARG  12  -8.747  -9.635  -1.341
   95   2HH2  ARG  12          2HH2      ARG  12 -10.179 -10.392  -0.736
   96    H    PHE  13           H        PHE  13  -9.317  -1.696  -3.315
   97    HA   PHE  13           HA       PHE  13  -7.119  -2.449  -4.992
   98   1HB   PHE  13          1HB       PHE  13  -9.018  -1.902  -6.181
   99   2HB   PHE  13          2HB       PHE  13  -9.522  -0.689  -5.024
  100    HD1  PHE  13           HD1      PHE  13  -7.045  -1.334  -7.766
  101    HD2  PHE  13           HD2      PHE  13  -9.232   1.586  -5.497
  102    HE1  PHE  13           HE1      PHE  13  -6.263   0.448  -9.303
  103    HE2  PHE  13           HE2      PHE  13  -8.449   3.368  -7.033
  104    HZ   PHE  13           HZ       PHE  13  -6.966   2.798  -8.936
  105    H    ARG  14           H        ARG  14  -7.798   0.455  -3.030
  106    HA   ARG  14           HA       ARG  14  -5.576   2.075  -3.801
  107   1HB   ARG  14          1HB       ARG  14  -7.455   1.863  -1.490
  108   2HB   ARG  14          2HB       ARG  14  -5.979   2.791  -1.232
  109   1HG   ARG  14          1HG       ARG  14  -6.526   4.024  -3.397
  110   2HG   ARG  14          2HG       ARG  14  -8.116   3.262  -3.317
  111   1HD   ARG  14          1HD       ARG  14  -8.792   4.534  -1.522
  112   2HD   ARG  14          2HD       ARG  14  -7.164   4.619  -0.829
  113    HE   ARG  14           HE       ARG  14  -8.133   6.302  -3.096
  114   1HH1  ARG  14          1HH2      ARG  14  -7.327   7.400  -0.388
  115   2HH1  ARG  14          2HH2      ARG  14  -5.734   7.990  -0.704
  116   1HH2  ARG  14          1HH1      ARG  14  -5.404   6.203  -3.687
  117   2HH2  ARG  14          2HH1      ARG  14  -4.626   7.299  -2.601
  118    H    ARG  15           H        ARG  15  -5.871  -0.534  -1.392
  119    HA   ARG  15           HA       ARG  15  -3.298  -0.235  -0.143
  120   1HB   ARG  15          1HB       ARG  15  -5.302  -2.465  -0.472
  121   2HB   ARG  15          2HB       ARG  15  -3.753  -2.773   0.307
  122   1HG   ARG  15          1HG       ARG  15  -4.274  -1.548   2.158
  123   2HG   ARG  15          2HG       ARG  15  -5.191  -0.355   1.239
  124   1HD   ARG  15          1HD       ARG  15  -7.091  -1.870   1.060
  125   2HD   ARG  15          2HD       ARG  15  -6.177  -3.161   1.870
  126    HE   ARG  15           HE       ARG  15  -6.037  -1.677   3.871
  127   1HH1  ARG  15          1HH1      ARG  15  -6.890   0.889   2.616
  128   2HH1  ARG  15          2HH1      ARG  15  -8.539   1.021   3.118
  129   1HH2  ARG  15          1HH2      ARG  15  -8.800  -2.347   3.997
  130   2HH2  ARG  15          2HH2      ARG  15  -9.641  -0.842   3.899
  131    H    LYS  16           H        LYS  16  -4.396  -2.029  -3.028
  132    HA   LYS  16           HA       LYS  16  -1.915  -3.415  -3.524
  133   1HB   LYS  16          1HB       LYS  16  -4.342  -3.753  -4.469
  134   2HB   LYS  16          2HB       LYS  16  -3.864  -2.549  -5.664
  135   1HG   LYS  16          1HG       LYS  16  -3.295  -4.585  -6.695
  136   2HG   LYS  16          2HG       LYS  16  -1.766  -4.025  -6.023
  137   1HD   LYS  16          1HD       LYS  16  -2.380  -5.425  -3.939
  138   2HD   LYS  16          2HD       LYS  16  -3.590  -6.186  -4.969
  139   1HE   LYS  16          1HE       LYS  16  -1.304  -6.237  -6.556
  140   2HE   LYS  16          2HE       LYS  16  -0.688  -6.588  -4.932
  141   1HZ   LYS  16          1HZ       LYS  16  -3.044  -7.928  -6.161
  142   2HZ   LYS  16          2HZ       LYS  16  -1.485  -8.594  -6.092
  143   3HZ   LYS  16          3HZ       LYS  16  -2.336  -8.297  -4.661
  144    H    ILE  17           H        ILE  17  -3.222  -0.265  -4.585
  145    HA   ILE  17           HA       ILE  17  -1.110   0.484  -6.378
  146    HB   ILE  17           HB       ILE  17  -2.888   2.159  -4.555
  147   1HG1  ILE  17          1HG1      ILE  17  -3.309   1.831  -7.514
  148   2HG1  ILE  17          2HG1      ILE  17  -3.878   0.563  -6.427
  149   1HG2  ILE  17          1HG2      ILE  17  -1.097   2.901  -6.870
  150   2HG2  ILE  17          2HG2      ILE  17  -2.465   3.909  -6.395
  151   3HG2  ILE  17          3HG2      ILE  17  -1.154   3.607  -5.256
  152   1HD1  ILE  17          1HD1      ILE  17  -4.611   3.152  -5.370
  153   2HD1  ILE  17          2HD1      ILE  17  -5.173   2.996  -7.033
  154   3HD1  ILE  17          3HD1      ILE  17  -5.650   1.800  -5.829
  155    H    ALA  18           H        ALA  18  -1.576   0.849  -2.868
  156    HA   ALA  18           HA       ALA  18   0.847   2.300  -2.304
  157   1HB   ALA  18          1HB       ALA  18  -1.355   1.862  -0.922
  158   2HB   ALA  18          2HB       ALA  18  -0.494   0.426  -0.366
  159   3HB   ALA  18          3HB       ALA  18   0.181   2.029  -0.073
  160    H    LYS  19           H        LYS  19   0.042  -1.192  -2.408
  161    HA   LYS  19           HA       LYS  19   2.385  -2.327  -1.320
  162   1HB   LYS  19          1HB       LYS  19   0.108  -3.173  -2.726
  163   2HB   LYS  19          2HB       LYS  19   1.467  -3.722  -3.699
  164   1HG   LYS  19          1HG       LYS  19   2.145  -5.233  -2.147
  165   2HG   LYS  19          2HG       LYS  19   1.787  -4.162  -0.792
  166   1HD   LYS  19          1HD       LYS  19  -0.357  -5.563  -2.409
  167   2HD   LYS  19          2HD       LYS  19   0.327  -6.225  -0.924
  168   1HE   LYS  19          1HE       LYS  19  -0.292  -3.634  -0.171
  169   2HE   LYS  19          2HE       LYS  19  -1.629  -4.050  -1.256
  170   1HZ   LYS  19          1HZ       LYS  19  -0.662  -5.775   0.969
  171   2HZ   LYS  19          2HZ       LYS  19  -2.031  -4.776   1.044
  172   3HZ   LYS  19          3HZ       LYS  19  -2.001  -6.075  -0.039
  173    H    ARG  20           H        ARG  20   1.894  -0.883  -4.524
  174    HA   ARG  20           HA       ARG  20   4.546  -1.774  -5.481
  175   1HB   ARG  20          1HB       ARG  20   2.118  -0.433  -6.609
  176   2HB   ARG  20          2HB       ARG  20   3.651  -0.277  -7.469
  177   1HG   ARG  20          1HG       ARG  20   3.676  -2.457  -8.099
  178   2HG   ARG  20          2HG       ARG  20   3.052  -3.017  -6.550
  179   1HD   ARG  20          1HD       ARG  20   0.836  -2.794  -7.194
  180   2HD   ARG  20          2HD       ARG  20   1.194  -1.517  -8.375
  181    HE   ARG  20           HE       ARG  20   1.641  -4.425  -8.812
  182   1HH1  ARG  20          1HH2      ARG  20  -0.069  -2.914 -10.683
  183   2HH1  ARG  20          2HH2      ARG  20   1.002  -2.548 -11.988
  184   1HH2  ARG  20          1HH1      ARG  20   3.885  -3.205 -10.131
  185   2HH2  ARG  20          2HH1      ARG  20   3.273  -2.716 -11.671
  186    H    SER  21           H        SER  21   3.199   1.025  -3.889
  187    HA   SER  21           HA       SER  21   5.436   2.787  -4.745
  188   1HB   SER  21          1HB       SER  21   2.800   3.267  -4.478
  189   2HB   SER  21          2HB       SER  21   3.312   3.636  -2.835
  190    HG   SER  21           HG       SER  21   3.374   5.374  -4.534
  191    H    ILE  22           H        ILE  22   4.052   1.279  -1.820
  192    HA   ILE  22           HA       ILE  22   5.608   2.449   0.207
  193    HB   ILE  22           HB       ILE  22   4.415  -0.306  -0.179
  194   1HG1  ILE  22          1HG1      ILE  22   3.555   1.835   1.763
  195   2HG1  ILE  22          2HG1      ILE  22   3.044   1.891   0.077
  196   1HG2  ILE  22          1HG2      ILE  22   6.067   0.722   2.084
  197   2HG2  ILE  22          2HG2      ILE  22   4.613  -0.184   2.494
  198   3HG2  ILE  22          3HG2      ILE  22   5.860  -0.927   1.496
  199   1HD1  ILE  22          1HD1      ILE  22   2.317  -0.584   0.454
  200   2HD1  ILE  22          2HD1      ILE  22   2.407  -0.180   2.169
  201   3HD1  ILE  22          3HD1      ILE  22   1.304   0.701   1.113
  202    H    LYS  23           H        LYS  23   6.443  -0.400  -1.807
  203    HA   LYS  23           HA       LYS  23   8.938  -1.071  -0.642
  204   1HB   LYS  23          1HB       LYS  23   7.606  -1.422  -3.285
  205   2HB   LYS  23          2HB       LYS  23   9.348  -1.691  -3.234
  206   1HG   LYS  23          1HG       LYS  23   8.970  -3.207  -1.245
  207   2HG   LYS  23          2HG       LYS  23   7.240  -3.077  -1.555
  208   1HD   LYS  23          1HD       LYS  23   9.192  -3.953  -3.692
  209   2HD   LYS  23          2HD       LYS  23   8.438  -5.097  -2.585
  210   1HE   LYS  23          1HE       LYS  23   6.497  -5.060  -3.747
  211   2HE   LYS  23          2HE       LYS  23   6.450  -3.288  -3.718
  212   1HZ   LYS  23          1HZ       LYS  23   8.089  -3.254  -5.507
  213   2HZ   LYS  23          2HZ       LYS  23   8.083  -4.950  -5.575
  214   3HZ   LYS  23          3HZ       LYS  23   6.680  -4.073  -5.978
  215    H    THR  24           H        THR  24   8.185   1.467  -3.039
  216    HA   THR  24           HA       THR  24  10.970   2.144  -3.540
  217    HB   THR  24           HB       THR  24   8.702   4.075  -3.967
  218    HG1  THR  24           HG1      THR  24   7.905   2.915  -5.615
  219   1HG2  THR  24          1HG2      THR  24  11.027   4.623  -4.608
  220   2HG2  THR  24          2HG2      THR  24  11.047   3.218  -5.673
  221   3HG2  THR  24          3HG2      THR  24   9.947   4.558  -6.003
  222    H    LEU  25           H        LEU  25   8.443   3.254  -1.293
  223    HA   LEU  25           HA       LEU  25   9.825   5.584  -0.295
  224   1HB   LEU  25          1HB       LEU  25   7.359   4.933  -0.073
  225   2HB   LEU  25          2HB       LEU  25   7.862   3.800   1.178
  226    HG   LEU  25           HG       LEU  25   8.933   6.529   1.514
  227   1HD1  LEU  25          1HD1      LEU  25   5.961   5.994   1.782
  228   2HD1  LEU  25          2HD1      LEU  25   6.793   7.432   2.371
  229   3HD1  LEU  25          3HD1      LEU  25   6.720   7.105   0.641
  230   1HD2  LEU  25          1HD2      LEU  25   9.104   4.642   3.174
  231   2HD2  LEU  25          2HD2      LEU  25   8.356   6.093   3.838
  232   3HD2  LEU  25          3HD2      LEU  25   7.352   4.719   3.371
  233    H    GLU  26           H        GLU  26   9.803   2.147   0.587
  234    HA   GLU  26           HA       GLU  26  11.511   2.430   2.955
  235   1HB   GLU  26          1HB       GLU  26  10.606   0.061   1.295
  236   2HB   GLU  26          2HB       GLU  26  11.416  -0.064   2.851
  237   1HG   GLU  26          1HG       GLU  26   9.569   0.859   4.009
  238   2HG   GLU  26          2HG       GLU  26   8.854   1.504   2.533
  239    H    HIS  27           H        HIS  27  11.941   1.098  -0.342
  240    HA   HIS  27           HA       HIS  27  13.834   0.588  -1.583
  241   1HB   HIS  27          1HB       HIS  27  13.963   3.223  -0.511
  242   2HB   HIS  27          2HB       HIS  27  15.602   2.579  -0.569
  243    HD1  HIS  27           HD1      HIS  27  12.760   3.624  -2.753
  244    HD2  HIS  27           HD2      HIS  27  16.518   1.865  -3.195
  245    HE1  HIS  27           HE1      HIS  27  13.304   3.701  -5.227
  246    H    LYS  28           H        LYS  28  13.753  -0.553   1.368
  247    HA   LYS  28           HA       LYS  28  15.109  -1.829   2.757
  248   1HB   LYS  28          1HB       LYS  28  16.854  -2.038   0.281
  249   2HB   LYS  28          2HB       LYS  28  16.749  -3.192   1.601
  250   1HG   LYS  28          1HG       LYS  28  15.227  -4.282   0.346
  251   2HG   LYS  28          2HG       LYS  28  14.110  -2.977   0.745
  252   1HD   LYS  28          1HD       LYS  28  15.648  -1.925  -1.334
  253   2HD   LYS  28          2HD       LYS  28  15.399  -3.601  -1.804
  254   1HE   LYS  28          1HE       LYS  28  13.086  -1.891  -0.859
  255   2HE   LYS  28          2HE       LYS  28  13.603  -1.901  -2.554
  256   1HZ   LYS  28          1HZ       LYS  28  13.513  -4.399  -2.414
  257   2HZ   LYS  28          2HZ       LYS  28  12.707  -4.220  -0.933
  258   3HZ   LYS  28          3HZ       LYS  28  12.010  -3.605  -2.352
  259    H    ARG  29           H        ARG  29  15.558   1.018   2.739
  260    HA   ARG  29           HA       ARG  29  17.997   1.240   4.242
  261   1HB   ARG  29          1HB       ARG  29  19.279   2.630   2.679
  262   2HB   ARG  29          2HB       ARG  29  18.966   1.050   1.979
  263   1HG   ARG  29          1HG       ARG  29  16.869   2.244   0.920
  264   2HG   ARG  29          2HG       ARG  29  17.778   3.714   1.255
  265   1HD   ARG  29          1HD       ARG  29  19.477   1.673   0.023
  266   2HD   ARG  29          2HD       ARG  29  18.100   2.107  -1.005
  267    HE   ARG  29           HE       ARG  29  18.858   4.387  -1.042
  268   1HH1  ARG  29          1HH2      ARG  29  21.504   3.145  -1.543
  269   2HH1  ARG  29          2HH2      ARG  29  22.509   3.889  -0.346
  270   1HH2  ARG  29          1HH1      ARG  29  19.817   4.995   1.577
  271   2HH2  ARG  29          2HH1      ARG  29  21.538   4.954   1.448
  272    H    GLU  30           H        GLU  30  15.614   3.038   2.271
  273    HA   GLU  30           HA       GLU  30  15.760   5.604   3.447
  274   1HB   GLU  30          1HB       GLU  30  14.282   4.280   1.527
  275   2HB   GLU  30          2HB       GLU  30  13.084   4.596   2.772
  276   1HG   GLU  30          1HG       GLU  30  14.909   6.719   1.630
  277   2HG   GLU  30          2HG       GLU  30  13.295   6.386   1.016
  278    H    ASN  31           H        ASN  31  14.274   2.635   4.673
  279    HA   ASN  31           HA       ASN  31  12.813   4.022   6.831
  280   1HB   ASN  31          1HB       ASN  31  12.004   1.997   5.513
  281   2HB   ASN  31          2HB       ASN  31  13.227   1.061   6.363
  282   1HD2  ASN  31          2HD2      ASN  31  13.026   0.940   8.800
  283   2HD2  ASN  31          1HD2      ASN  31  11.499   1.165   9.506
  284    H    ALA  32           H        ALA  32  15.626   1.814   6.496
  285    HA   ALA  32           HA       ALA  32  16.228   2.069   9.397
  286   1HB   ALA  32          1HB       ALA  32  17.335   0.322   7.191
  287   2HB   ALA  32          2HB       ALA  32  17.781   0.207   8.893
  288   3HB   ALA  32          3HB       ALA  32  16.127  -0.144   8.390
  289    H    LYS  33           H        LYS  33  17.405   3.879   9.844
  290    HA   LYS  33           HA       LYS  33  19.195   5.352   9.965
  291   1HB   LYS  33          1HB       LYS  33  20.225   2.879   9.377
  292   2HB   LYS  33          2HB       LYS  33  20.898   3.862   8.083
  293   1HG   LYS  33          1HG       LYS  33  21.192   5.406  10.427
  294   2HG   LYS  33          2HG       LYS  33  21.633   3.764  10.884
  295   1HD   LYS  33          1HD       LYS  33  23.654   4.695  10.097
  296   2HD   LYS  33          2HD       LYS  33  23.065   3.746   8.731
  297   1HE   LYS  33          1HE       LYS  33  22.036   5.806   7.777
  298   2HE   LYS  33          2HE       LYS  33  22.749   6.748   9.097
  299   1HZ   LYS  33          1HZ       LYS  33  24.288   5.033   7.219
  300   2HZ   LYS  33          2HZ       LYS  33  24.120   6.720   7.081
  301   3HZ   LYS  33          3HZ       LYS  33  24.934   6.061   8.414
  302    H    GLU  34           H        GLU  34  20.416   6.956   8.704
  303    HA   GLU  34           HA       GLU  34  19.074   7.592   6.120
  304   1HB   GLU  34          1HB       GLU  34  20.631   9.198   8.169
  305   2HB   GLU  34          2HB       GLU  34  20.109   9.871   6.627
  306   1HG   GLU  34          1HG       GLU  34  17.853   9.777   7.186
  307   2HG   GLU  34          2HG       GLU  34  18.090   8.487   8.364
  Start of MODEL    3
    1   1H    CYS   1          1H        CYS   1 -15.057   6.807   0.710
    2   2H    CYS   1          2H        CYS   1 -15.361   8.090  -0.361
    3   3H    CYS   1          3H        CYS   1 -15.438   8.348   1.309
    4    HA   CYS   1           HA       CYS   1 -17.678   8.201   0.387
    5   1HB   CYS   1          1HB       CYS   1 -16.485   5.647  -0.685
    6   2HB   CYS   1          2HB       CYS   1 -18.226   5.823  -0.502
    7    HG   CYS   1           HG       CYS   1 -18.293   7.402  -2.427
    8    H    ALA   2           H        ALA   2 -19.416   7.016   1.537
    9    HA   ALA   2           HA       ALA   2 -18.745   5.036   3.593
   10   1HB   ALA   2          1HB       ALA   2 -19.473   7.893   4.323
   11   2HB   ALA   2          2HB       ALA   2 -19.322   6.559   5.467
   12   3HB   ALA   2          3HB       ALA   2 -17.906   7.125   4.581
   13    H    VAL   3           H        VAL   3 -20.517   4.551   1.666
   14    HA   VAL   3           HA       VAL   3 -23.171   5.501   1.911
   15    HB   VAL   3           HB       VAL   3 -23.813   3.458   0.698
   16   1HG1  VAL   3          1HG1      VAL   3 -22.437   5.448  -0.318
   17   2HG1  VAL   3          2HG1      VAL   3 -21.172   4.231  -0.488
   18   3HG1  VAL   3          3HG1      VAL   3 -22.731   3.996  -1.273
   19   1HG2  VAL   3          1HG2      VAL   3 -21.005   2.550   1.398
   20   2HG2  VAL   3          2HG2      VAL   3 -22.526   1.714   1.709
   21   3HG2  VAL   3          3HG2      VAL   3 -21.923   1.858   0.061
   22    H    GLU   4           H        GLU   4 -21.545   2.889   3.611
   23    HA   GLU   4           HA       GLU   4 -23.682   2.860   5.698
   24   1HB   GLU   4          1HB       GLU   4 -22.546   0.605   4.022
   25   2HB   GLU   4          2HB       GLU   4 -23.163   0.277   5.638
   26   1HG   GLU   4          1HG       GLU   4 -24.870   1.847   3.735
   27   2HG   GLU   4          2HG       GLU   4 -24.762   0.099   3.544
   28    H    LEU   5           H        LEU   5 -21.254   4.282   5.717
   29    HA   LEU   5           HA       LEU   5 -19.289   4.650   6.888
   30   1HB   LEU   5          1HB       LEU   5 -21.239   3.421   8.572
   31   2HB   LEU   5          2HB       LEU   5 -19.683   2.731   9.007
   32    HG   LEU   5           HG       LEU   5 -20.248   4.771  10.310
   33   1HD1  LEU   5          1HD1      LEU   5 -17.864   4.043   9.675
   34   2HD1  LEU   5          2HD1      LEU   5 -17.898   5.380   8.524
   35   3HD1  LEU   5          3HD1      LEU   5 -18.083   5.697  10.248
   36   1HD2  LEU   5          1HD2      LEU   5 -21.308   5.812   8.091
   37   2HD2  LEU   5          2HD2      LEU   5 -20.631   6.841   9.351
   38   3HD2  LEU   5          3HD2      LEU   5 -19.684   6.472   7.911
   39    H    ARG   6           H        ARG   6 -19.077   2.859   4.749
   40    HA   ARG   6           HA       ARG   6 -16.660   1.363   5.485
   41   1HB   ARG   6          1HB       ARG   6 -18.594  -0.061   6.168
   42   2HB   ARG   6          2HB       ARG   6 -19.106  -0.105   4.485
   43   1HG   ARG   6          1HG       ARG   6 -17.816  -2.109   5.013
   44   2HG   ARG   6          2HG       ARG   6 -16.923  -1.116   3.863
   45   1HD   ARG   6          1HD       ARG   6 -15.278  -0.585   5.384
   46   2HD   ARG   6          2HD       ARG   6 -16.394  -0.613   6.764
   47    HE   ARG   6           HE       ARG   6 -15.830  -3.200   5.428
   48   1HH1  ARG   6          1HH1      ARG   6 -17.126  -2.813   8.158
   49   2HH1  ARG   6          2HH1      ARG   6 -15.829  -3.237   9.219
   50   1HH2  ARG   6          1HH2      ARG   6 -13.392  -2.970   6.724
   51   2HH2  ARG   6          2HH2      ARG   6 -13.671  -3.329   8.393
   52    H    SER   7           H        SER   7 -19.123   1.846   2.917
   53    HA   SER   7           HA       SER   7 -18.996   1.847   0.613
   54   1HB   SER   7          1HB       SER   7 -17.341   3.514  -0.217
   55   2HB   SER   7          2HB       SER   7 -18.284   4.073   1.148
   56    HG   SER   7           HG       SER   7 -16.503   4.098   2.331
   57    HA   PRO   8           HA       PRO   8 -15.994  -1.593   0.177
   58   1HB   PRO   8          1HB       PRO   8 -17.739  -3.289  -1.066
   59   2HB   PRO   8          2HB       PRO   8 -17.606  -3.148   0.700
   60   1HG   PRO   8          1HG       PRO   8 -19.631  -2.006  -1.138
   61   2HG   PRO   8          2HG       PRO   8 -19.823  -2.657   0.498
   62   1HD   PRO   8          1HD       PRO   8 -19.750   0.004  -0.076
   63   2HD   PRO   8          2HD       PRO   8 -19.284  -0.690   1.493
   64    H    GLY   9           H        GLY   9 -15.264   0.260  -1.318
   65   1HA   GLY   9          1HA       GLY   9 -15.020  -0.708  -4.040
   66   2HA   GLY   9          2HA       GLY   9 -16.004   0.757  -3.939
   67    H    ILE  10           H        ILE  10 -13.086   0.087  -4.840
   68    HA   ILE  10           HA       ILE  10 -11.131   1.187  -5.058
   69    HB   ILE  10           HB       ILE  10 -13.040   3.062  -4.848
   70   1HG1  ILE  10          1HG1      ILE  10 -10.888   2.743  -6.262
   71   2HG1  ILE  10          2HG1      ILE  10 -11.618   4.330  -6.103
   72   1HG2  ILE  10          1HG2      ILE  10 -11.560   3.404  -2.386
   73   2HG2  ILE  10          2HG2      ILE  10 -11.391   4.813  -3.432
   74   3HG2  ILE  10          3HG2      ILE  10 -12.992   4.243  -2.977
   75   1HD1  ILE  10          1HD1      ILE  10  -9.337   3.356  -4.356
   76   2HD1  ILE  10          2HD1      ILE  10  -9.100   4.294  -5.830
   77   3HD1  ILE  10          3HD1      ILE  10  -9.966   4.999  -4.465
   78    H    SER  11           H        SER  11 -12.256   0.691  -1.775
   79    HA   SER  11           HA       SER  11  -9.741   1.408  -0.526
   80   1HB   SER  11          1HB       SER  11 -12.058   1.286   0.525
   81   2HB   SER  11          2HB       SER  11 -11.908  -0.463   0.482
   82    HG   SER  11           HG       SER  11 -10.867   1.331   2.233
   83    H    ARG  12           H        ARG  12 -11.202  -1.760  -1.454
   84    HA   ARG  12           HA       ARG  12  -8.925  -3.351  -0.715
   85   1HB   ARG  12          1HB       ARG  12 -11.343  -4.051  -1.358
   86   2HB   ARG  12          2HB       ARG  12 -10.790  -3.934  -3.032
   87   1HG   ARG  12          1HG       ARG  12  -8.828  -5.448  -2.270
   88   2HG   ARG  12          2HG       ARG  12  -9.830  -5.802  -0.866
   89   1HD   ARG  12          1HD       ARG  12 -11.071  -6.041  -3.592
   90   2HD   ARG  12          2HD       ARG  12  -9.992  -7.328  -3.029
   91    HE   ARG  12           HE       ARG  12 -12.405  -6.433  -1.502
   92   1HH1  ARG  12          1HH2      ARG  12 -12.625  -8.935  -3.096
   93   2HH1  ARG  12          2HH2      ARG  12 -12.226 -10.159  -1.942
   94   1HH2  ARG  12          1HH1      ARG  12 -10.766  -7.912   0.299
   95   2HH2  ARG  12          2HH1      ARG  12 -11.158  -9.571   0.011
   96    H    PHE  13           H        PHE  13  -9.804  -1.591  -3.657
   97    HA   PHE  13           HA       PHE  13  -7.650  -2.469  -5.352
   98   1HB   PHE  13          1HB       PHE  13  -9.589  -1.585  -6.355
   99   2HB   PHE  13          2HB       PHE  13  -9.651  -0.220  -5.257
  100    HD1  PHE  13           HD1      PHE  13  -7.294  -1.677  -7.815
  101    HD2  PHE  13           HD2      PHE  13  -9.084   1.836  -6.117
  102    HE1  PHE  13           HE1      PHE  13  -6.119  -0.271  -9.487
  103    HE2  PHE  13           HE2      PHE  13  -7.911   3.244  -7.787
  104    HZ   PHE  13           HZ       PHE  13  -6.430   2.191  -9.472
  105    H    ARG  14           H        ARG  14  -8.059   0.433  -3.229
  106    HA   ARG  14           HA       ARG  14  -5.504   1.561  -3.892
  107   1HB   ARG  14          1HB       ARG  14  -6.086   3.230  -2.426
  108   2HB   ARG  14          2HB       ARG  14  -7.668   2.543  -2.727
  109   1HG   ARG  14          1HG       ARG  14  -7.277   1.120  -0.630
  110   2HG   ARG  14          2HG       ARG  14  -5.892   2.157  -0.311
  111   1HD   ARG  14          1HD       ARG  14  -8.137   3.842  -0.925
  112   2HD   ARG  14          2HD       ARG  14  -8.633   2.674   0.309
  113    HE   ARG  14           HE       ARG  14  -6.097   3.567   1.118
  114   1HH1  ARG  14          1HH1      ARG  14  -7.070   6.161  -0.098
  115   2HH1  ARG  14          2HH1      ARG  14  -7.822   6.924   1.260
  116   1HH2  ARG  14          1HH2      ARG  14  -7.993   3.975   3.125
  117   2HH2  ARG  14          2HH2      ARG  14  -8.355   5.664   3.110
  118    H    ARG  15           H        ARG  15  -6.395  -0.970  -1.629
  119    HA   ARG  15           HA       ARG  15  -4.117  -0.913   0.088
  120   1HB   ARG  15          1HB       ARG  15  -6.343  -2.682  -0.549
  121   2HB   ARG  15          2HB       ARG  15  -4.870  -3.599  -0.247
  122   1HG   ARG  15          1HG       ARG  15  -4.879  -1.634   1.750
  123   2HG   ARG  15          2HG       ARG  15  -6.556  -2.148   1.632
  124   1HD   ARG  15          1HD       ARG  15  -5.812  -3.771   3.093
  125   2HD   ARG  15          2HD       ARG  15  -5.370  -4.584   1.581
  126    HE   ARG  15           HE       ARG  15  -3.415  -2.823   3.019
  127   1HH1  ARG  15          1HH1      ARG  15  -2.580  -3.952   0.417
  128   2HH1  ARG  15          2HH1      ARG  15  -1.759  -5.407   0.867
  129   1HH2  ARG  15          1HH2      ARG  15  -3.133  -5.468   4.082
  130   2HH2  ARG  15          2HH2      ARG  15  -2.077  -6.283   2.983
  131    H    LYS  16           H        LYS  16  -4.526  -2.135  -3.211
  132    HA   LYS  16           HA       LYS  16  -1.930  -3.540  -3.186
  133   1HB   LYS  16          1HB       LYS  16  -4.072  -4.238  -4.438
  134   2HB   LYS  16          2HB       LYS  16  -3.726  -2.908  -5.546
  135   1HG   LYS  16          1HG       LYS  16  -1.501  -3.877  -6.012
  136   2HG   LYS  16          2HG       LYS  16  -1.864  -5.220  -4.929
  137   1HD   LYS  16          1HD       LYS  16  -3.773  -4.614  -7.158
  138   2HD   LYS  16          2HD       LYS  16  -2.267  -5.451  -7.533
  139   1HE   LYS  16          1HE       LYS  16  -2.793  -7.293  -6.140
  140   2HE   LYS  16          2HE       LYS  16  -4.061  -6.397  -5.285
  141   1HZ   LYS  16          1HZ       LYS  16  -4.121  -7.110  -8.175
  142   2HZ   LYS  16          2HZ       LYS  16  -5.005  -7.880  -6.954
  143   3HZ   LYS  16          3HZ       LYS  16  -5.326  -6.256  -7.329
  144    H    ILE  17           H        ILE  17  -3.342  -0.495  -4.391
  145    HA   ILE  17           HA       ILE  17  -1.169   0.397  -6.019
  146    HB   ILE  17           HB       ILE  17  -3.149   1.942  -4.305
  147   1HG1  ILE  17          1HG1      ILE  17  -3.269   1.490  -7.295
  148   2HG1  ILE  17          2HG1      ILE  17  -4.030   0.373  -6.162
  149   1HG2  ILE  17          1HG2      ILE  17  -1.094   2.804  -6.301
  150   2HG2  ILE  17          2HG2      ILE  17  -2.635   3.662  -6.265
  151   3HG2  ILE  17          3HG2      ILE  17  -1.626   3.599  -4.820
  152   1HD1  ILE  17          1HD1      ILE  17  -4.768   3.016  -5.380
  153   2HD1  ILE  17          2HD1      ILE  17  -5.030   2.879  -7.118
  154   3HD1  ILE  17          3HD1      ILE  17  -5.803   1.740  -6.017
  155    H    ALA  18           H        ALA  18  -1.797   0.731  -2.517
  156    HA   ALA  18           HA       ALA  18   0.487   2.368  -1.904
  157   1HB   ALA  18          1HB       ALA  18  -1.566   2.040  -0.507
  158   2HB   ALA  18          2HB       ALA  18  -0.995   0.412  -0.131
  159   3HB   ALA  18          3HB       ALA  18  -0.062   1.817   0.388
  160    H    LYS  19           H        LYS  19   0.083  -1.169  -2.176
  161    HA   LYS  19           HA       LYS  19   2.405  -2.033  -0.830
  162   1HB   LYS  19          1HB       LYS  19   1.793  -4.055  -1.660
  163   2HB   LYS  19          2HB       LYS  19   0.359  -3.196  -2.188
  164   1HG   LYS  19          1HG       LYS  19   1.512  -2.804  -4.401
  165   2HG   LYS  19          2HG       LYS  19   2.820  -3.839  -3.837
  166   1HD   LYS  19          1HD       LYS  19   1.425  -5.753  -3.756
  167   2HD   LYS  19          2HD       LYS  19  -0.043  -4.785  -3.845
  168   1HE   LYS  19          1HE       LYS  19   0.237  -5.718  -6.030
  169   2HE   LYS  19          2HE       LYS  19   0.757  -4.034  -6.168
  170   1HZ   LYS  19          1HZ       LYS  19   2.729  -6.122  -5.455
  171   2HZ   LYS  19          2HZ       LYS  19   2.280  -5.898  -7.072
  172   3HZ   LYS  19          3HZ       LYS  19   2.973  -4.617  -6.202
  173    H    ARG  20           H        ARG  20   2.123  -0.672  -4.097
  174    HA   ARG  20           HA       ARG  20   4.934  -1.206  -4.754
  175   1HB   ARG  20          1HB       ARG  20   2.962  -1.160  -6.359
  176   2HB   ARG  20          2HB       ARG  20   2.945   0.590  -6.169
  177   1HG   ARG  20          1HG       ARG  20   4.572   0.774  -7.704
  178   2HG   ARG  20          2HG       ARG  20   5.644  -0.162  -6.669
  179   1HD   ARG  20          1HD       ARG  20   3.815  -1.978  -7.948
  180   2HD   ARG  20          2HD       ARG  20   4.548  -0.938  -9.180
  181    HE   ARG  20           HE       ARG  20   6.768  -1.544  -7.858
  182   1HH1  ARG  20          1HH2      ARG  20   6.200  -3.282 -10.155
  183   2HH1  ARG  20          2HH2      ARG  20   6.162  -4.866  -9.464
  184   1HH2  ARG  20          1HH1      ARG  20   5.774  -3.687  -6.198
  185   2HH2  ARG  20          2HH1      ARG  20   5.916  -5.100  -7.186
  186    H    SER  21           H        SER  21   3.097   1.489  -3.362
  187    HA   SER  21           HA       SER  21   5.333   3.377  -3.729
  188   1HB   SER  21          1HB       SER  21   2.552   3.568  -3.430
  189   2HB   SER  21          2HB       SER  21   3.208   4.217  -1.930
  190    HG   SER  21           HG       SER  21   4.091   5.831  -3.031
  191    H    ILE  22           H        ILE  22   5.307   0.833  -1.788
  192    HA   ILE  22           HA       ILE  22   6.198   2.257   0.682
  193    HB   ILE  22           HB       ILE  22   4.999  -0.460   0.068
  194   1HG1  ILE  22          1HG1      ILE  22   4.269   1.429   2.298
  195   2HG1  ILE  22          2HG1      ILE  22   3.687   1.716   0.658
  196   1HG2  ILE  22          1HG2      ILE  22   6.586   0.359   2.506
  197   2HG2  ILE  22          2HG2      ILE  22   5.330  -0.876   2.597
  198   3HG2  ILE  22          3HG2      ILE  22   6.729  -1.117   1.551
  199   1HD1  ILE  22          1HD1      ILE  22   2.747  -0.588   0.620
  200   2HD1  ILE  22          2HD1      ILE  22   3.253  -0.795   2.297
  201   3HD1  ILE  22          3HD1      ILE  22   2.031   0.411   1.886
  202    H    LYS  23           H        LYS  23   6.970  -0.625  -1.335
  203    HA   LYS  23           HA       LYS  23   9.625  -1.032  -0.374
  204   1HB   LYS  23          1HB       LYS  23   8.147  -2.585  -1.728
  205   2HB   LYS  23          2HB       LYS  23   8.559  -1.626  -3.149
  206   1HG   LYS  23          1HG       LYS  23  11.037  -2.143  -2.020
  207   2HG   LYS  23          2HG       LYS  23  10.149  -3.633  -1.718
  208   1HD   LYS  23          1HD       LYS  23  11.058  -4.025  -3.832
  209   2HD   LYS  23          2HD       LYS  23   9.445  -3.448  -4.223
  210   1HE   LYS  23          1HE       LYS  23  10.580  -2.020  -5.614
  211   2HE   LYS  23          2HE       LYS  23  10.818  -1.075  -4.136
  212   1HZ   LYS  23          1HZ       LYS  23  12.660  -3.224  -5.065
  213   2HZ   LYS  23          2HZ       LYS  23  12.917  -1.567  -5.300
  214   3HZ   LYS  23          3HZ       LYS  23  12.881  -2.196  -3.725
  215    H    THR  24           H        THR  24   8.498   0.751  -3.287
  216    HA   THR  24           HA       THR  24  11.049   1.616  -4.227
  217    HB   THR  24           HB       THR  24   8.314   2.931  -4.416
  218    HG1  THR  24           HG1      THR  24   7.889   1.389  -5.764
  219   1HG2  THR  24          1HG2      THR  24  10.754   3.190  -6.196
  220   2HG2  THR  24          2HG2      THR  24   9.165   3.880  -6.528
  221   3HG2  THR  24          3HG2      THR  24  10.100   4.448  -5.145
  222    H    LEU  25           H        LEU  25   8.823   3.049  -1.841
  223    HA   LEU  25           HA       LEU  25  10.197   5.523  -1.411
  224   1HB   LEU  25          1HB       LEU  25   7.831   4.550  -0.674
  225   2HB   LEU  25          2HB       LEU  25   8.725   4.075   0.770
  226    HG   LEU  25           HG       LEU  25   9.597   6.535   0.739
  227   1HD1  LEU  25          1HD1      LEU  25   8.561   6.969  -1.536
  228   2HD1  LEU  25          2HD1      LEU  25   6.982   6.890  -0.753
  229   3HD1  LEU  25          3HD1      LEU  25   8.131   8.144  -0.293
  230   1HD2  LEU  25          1HD2      LEU  25   7.939   5.385   2.346
  231   2HD2  LEU  25          2HD2      LEU  25   7.854   7.143   2.242
  232   3HD2  LEU  25          3HD2      LEU  25   6.668   6.153   1.394
  233    H    GLU  26           H        GLU  26  10.381   2.369   0.290
  234    HA   GLU  26           HA       GLU  26  12.312   3.037   2.255
  235   1HB   GLU  26          1HB       GLU  26  11.040   0.688   1.207
  236   2HB   GLU  26          2HB       GLU  26  12.772   0.369   1.322
  237   1HG   GLU  26          1HG       GLU  26  11.210   1.604   3.595
  238   2HG   GLU  26          2HG       GLU  26  11.393  -0.140   3.411
  239    H    HIS  27           H        HIS  27  12.793   1.862  -1.091
  240    HA   HIS  27           HA       HIS  27  15.625   1.653  -1.112
  241   1HB   HIS  27          1HB       HIS  27  14.193   0.827  -2.905
  242   2HB   HIS  27          2HB       HIS  27  13.622   2.456  -3.249
  243    HD1  HIS  27           HD1      HIS  27  16.851   0.433  -3.345
  244    HD2  HIS  27           HD2      HIS  27  15.188   3.849  -5.059
  245    HE1  HIS  27           HE1      HIS  27  18.486   1.213  -5.114
  246    H    LYS  28           H        LYS  28  13.499   4.448  -1.708
  247    HA   LYS  28           HA       LYS  28  15.509   6.370  -2.383
  248   1HB   LYS  28          1HB       LYS  28  12.658   6.259  -1.815
  249   2HB   LYS  28          2HB       LYS  28  13.379   7.689  -1.084
  250   1HG   LYS  28          1HG       LYS  28  12.902   8.486  -3.203
  251   2HG   LYS  28          2HG       LYS  28  14.561   7.941  -3.425
  252   1HD   LYS  28          1HD       LYS  28  13.940   6.383  -4.930
  253   2HD   LYS  28          2HD       LYS  28  12.661   5.775  -3.884
  254   1HE   LYS  28          1HE       LYS  28  11.050   6.955  -4.974
  255   2HE   LYS  28          2HE       LYS  28  12.047   8.415  -5.057
  256   1HZ   LYS  28          1HZ       LYS  28  13.365   7.341  -6.817
  257   2HZ   LYS  28          2HZ       LYS  28  12.301   6.011  -6.791
  258   3HZ   LYS  28          3HZ       LYS  28  11.742   7.537  -7.264
  259    H    ARG  29           H        ARG  29  14.248   5.250   0.757
  260    HA   ARG  29           HA       ARG  29  15.439   7.266   2.423
  261   1HB   ARG  29          1HB       ARG  29  14.932   4.334   3.059
  262   2HB   ARG  29          2HB       ARG  29  15.080   5.644   4.222
  263   1HG   ARG  29          1HG       ARG  29  13.067   6.662   2.797
  264   2HG   ARG  29          2HG       ARG  29  12.809   4.966   2.399
  265   1HD   ARG  29          1HD       ARG  29  11.947   4.526   4.446
  266   2HD   ARG  29          2HD       ARG  29  13.296   5.335   5.265
  267    HE   ARG  29           HE       ARG  29  10.875   6.739   4.216
  268   1HH1  ARG  29          1HH1      ARG  29  13.670   8.134   4.486
  269   2HH1  ARG  29          2HH1      ARG  29  13.435   8.977   5.976
  270   1HH2  ARG  29          1HH2      ARG  29  10.590   7.154   6.854
  271   2HH2  ARG  29          2HH2      ARG  29  11.670   8.414   7.336
  272    H    GLU  30           H        GLU  30  16.564   4.043   1.383
  273    HA   GLU  30           HA       GLU  30  19.154   4.138   2.639
  274   1HB   GLU  30          1HB       GLU  30  17.807   2.558   0.458
  275   2HB   GLU  30          2HB       GLU  30  19.535   2.348   0.742
  276   1HG   GLU  30          1HG       GLU  30  17.713   2.282   3.114
  277   2HG   GLU  30          2HG       GLU  30  17.739   0.878   2.050
  278    H    ASN  31           H        ASN  31  18.025   4.913  -0.656
  279    HA   ASN  31           HA       ASN  31  20.524   5.605  -1.849
  280   1HB   ASN  31          1HB       ASN  31  17.626   6.109  -2.341
  281   2HB   ASN  31          2HB       ASN  31  18.762   7.159  -3.174
  282   1HD2  ASN  31          2HD2      ASN  31  18.397   6.230  -5.308
  283   2HD2  ASN  31          1HD2      ASN  31  18.862   4.640  -5.678
  284    H    ALA  32           H        ALA  32  18.222   7.526   0.075
  285    HA   ALA  32           HA       ALA  32  19.538  10.084  -0.331
  286   1HB   ALA  32          1HB       ALA  32  17.540   9.078   1.711
  287   2HB   ALA  32          2HB       ALA  32  17.982  10.771   1.494
  288   3HB   ALA  32          3HB       ALA  32  17.172   9.897   0.195
  289    H    LYS  33           H        LYS  33  20.429  11.343   1.544
  290    HA   LYS  33           HA       LYS  33  22.190   9.634   3.265
  291   1HB   LYS  33          1HB       LYS  33  22.536  12.090   1.657
  292   2HB   LYS  33          2HB       LYS  33  23.261  12.171   3.261
  293   1HG   LYS  33          1HG       LYS  33  24.439  10.033   2.828
  294   2HG   LYS  33          2HG       LYS  33  23.743   9.990   1.210
  295   1HD   LYS  33          1HD       LYS  33  25.810  10.960   0.772
  296   2HD   LYS  33          2HD       LYS  33  24.804  12.387   0.991
  297   1HE   LYS  33          1HE       LYS  33  26.646  12.884   2.354
  298   2HE   LYS  33          2HE       LYS  33  25.528  12.164   3.525
  299   1HZ   LYS  33          1HZ       LYS  33  26.582   9.977   3.024
  300   2HZ   LYS  33          2HZ       LYS  33  27.753  10.796   2.102
  301   3HZ   LYS  33          3HZ       LYS  33  27.618  11.088   3.769
  302    H    GLU  34           H        GLU  34  20.554  12.839   3.315
  303    HA   GLU  34           HA       GLU  34  20.436  12.767   6.267
  304   1HB   GLU  34          1HB       GLU  34  20.638  14.747   4.247
  305   2HB   GLU  34          2HB       GLU  34  19.071  14.991   5.010
  306   1HG   GLU  34          1HG       GLU  34  20.140  16.061   6.670
  307   2HG   GLU  34          2HG       GLU  34  20.820  14.512   7.147
  Start of MODEL    4
    1   1H    CYS   1          1H        CYS   1 -11.319  11.778  -8.161
    2   2H    CYS   1          2H        CYS   1 -12.237  10.955  -9.322
    3   3H    CYS   1          3H        CYS   1 -10.729  11.613  -9.743
    4    HA   CYS   1           HA       CYS   1 -11.500  13.822  -9.606
    5   1HB   CYS   1          1HB       CYS   1 -13.275  11.835 -11.004
    6   2HB   CYS   1          2HB       CYS   1 -13.608  13.561 -11.124
    7    HG   CYS   1           HG       CYS   1 -11.678  13.818 -12.657
    8    H    ALA   2           H        ALA   2 -14.429  11.825  -8.940
    9    HA   ALA   2           HA       ALA   2 -15.091  13.306  -6.498
   10   1HB   ALA   2          1HB       ALA   2 -16.677  13.698  -9.059
   11   2HB   ALA   2          2HB       ALA   2 -17.167  14.282  -7.468
   12   3HB   ALA   2          3HB       ALA   2 -15.717  14.929  -8.237
   13    H    VAL   3           H        VAL   3 -16.996  12.398  -5.485
   14    HA   VAL   3           HA       VAL   3 -18.309  10.706  -4.723
   15    HB   VAL   3           HB       VAL   3 -19.919   9.876  -6.135
   16   1HG1  VAL   3          1HG1      VAL   3 -19.893  12.352  -6.042
   17   2HG1  VAL   3          2HG1      VAL   3 -18.988  12.373  -7.556
   18   3HG1  VAL   3          3HG1      VAL   3 -20.628  11.730  -7.519
   19   1HG2  VAL   3          1HG2      VAL   3 -18.032   9.022  -7.851
   20   2HG2  VAL   3          2HG2      VAL   3 -19.728   9.173  -8.304
   21   3HG2  VAL   3          3HG2      VAL   3 -18.586  10.443  -8.735
   22    H    GLU   4           H        GLU   4 -15.405   9.877  -5.850
   23    HA   GLU   4           HA       GLU   4 -15.818   6.937  -5.913
   24   1HB   GLU   4          1HB       GLU   4 -13.433   8.748  -6.366
   25   2HB   GLU   4          2HB       GLU   4 -13.379   6.993  -6.505
   26   1HG   GLU   4          1HG       GLU   4 -14.647   6.963  -8.439
   27   2HG   GLU   4          2HG       GLU   4 -15.482   8.463  -8.047
   28    H    LEU   5           H        LEU   5 -15.792   8.932  -3.421
   29    HA   LEU   5           HA       LEU   5 -13.805   7.491  -1.736
   30   1HB   LEU   5          1HB       LEU   5 -14.157   9.459  -0.210
   31   2HB   LEU   5          2HB       LEU   5 -13.451   9.843  -1.767
   32    HG   LEU   5           HG       LEU   5 -16.404  10.001  -1.705
   33   1HD1  LEU   5          1HD1      LEU   5 -15.315  10.957   0.574
   34   2HD1  LEU   5          2HD1      LEU   5 -15.098  12.360  -0.474
   35   3HD1  LEU   5          3HD1      LEU   5 -16.710  11.697  -0.214
   36   1HD2  LEU   5          1HD2      LEU   5 -14.833  10.761  -3.565
   37   2HD2  LEU   5          2HD2      LEU   5 -16.020  11.953  -3.037
   38   3HD2  LEU   5          3HD2      LEU   5 -14.347  12.075  -2.495
   39    H    ARG   6           H        ARG   6 -17.268   8.132  -2.036
   40    HA   ARG   6           HA       ARG   6 -17.918   7.077   0.623
   41   1HB   ARG   6          1HB       ARG   6 -19.116   8.907  -0.698
   42   2HB   ARG   6          2HB       ARG   6 -19.767   7.616  -1.707
   43   1HG   ARG   6          1HG       ARG   6 -21.007   6.688   0.056
   44   2HG   ARG   6          2HG       ARG   6 -20.037   7.487   1.292
   45   1HD   ARG   6          1HD       ARG   6 -21.573   9.195  -0.648
   46   2HD   ARG   6          2HD       ARG   6 -22.441   8.431   0.695
   47    HE   ARG   6           HE       ARG   6 -20.126   9.571   1.829
   48   1HH1  ARG   6          1HH2      ARG   6 -22.755  10.331   2.855
   49   2HH1  ARG   6          2HH2      ARG   6 -22.905  11.991   2.398
   50   1HH2  ARG   6          1HH1      ARG   6 -20.361  11.828   0.016
   51   2HH2  ARG   6          2HH1      ARG   6 -21.531  12.851   0.771
   52    H    SER   7           H        SER   7 -18.080   5.899  -2.749
   53    HA   SER   7           HA       SER   7 -19.356   3.376  -2.019
   54   1HB   SER   7          1HB       SER   7 -18.022   4.374  -4.548
   55   2HB   SER   7          2HB       SER   7 -18.904   2.859  -4.420
   56    HG   SER   7           HG       SER   7 -20.740   3.953  -4.356
   57    HA   PRO   8           HA       PRO   8 -15.607   1.242  -0.967
   58   1HB   PRO   8          1HB       PRO   8 -16.531  -1.319  -1.135
   59   2HB   PRO   8          2HB       PRO   8 -16.928  -0.231   0.213
   60   1HG   PRO   8          1HG       PRO   8 -18.564  -0.985  -2.144
   61   2HG   PRO   8          2HG       PRO   8 -19.054  -0.706  -0.464
   62   1HD   PRO   8          1HD       PRO   8 -19.415   1.104  -2.460
   63   2HD   PRO   8          2HD       PRO   8 -19.241   1.543  -0.745
   64    H    GLY   9           H        GLY   9 -14.208  -0.593  -1.959
   65   1HA   GLY   9          1HA       GLY   9 -13.725  -1.948  -3.981
   66   2HA   GLY   9          2HA       GLY   9 -14.488  -0.678  -4.941
   67    H    ILE  10           H        ILE  10 -13.396   1.636  -4.112
   68    HA   ILE  10           HA       ILE  10 -10.792   1.654  -5.247
   69    HB   ILE  10           HB       ILE  10 -12.431   3.549  -5.125
   70   1HG1  ILE  10          1HG1      ILE  10  -9.617   4.008  -4.107
   71   2HG1  ILE  10          2HG1      ILE  10 -10.114   3.887  -5.791
   72   1HG2  ILE  10          1HG2      ILE  10 -13.041   3.329  -2.729
   73   2HG2  ILE  10          2HG2      ILE  10 -11.410   3.832  -2.283
   74   3HG2  ILE  10          3HG2      ILE  10 -12.482   4.952  -3.119
   75   1HD1  ILE  10          1HD1      ILE  10 -11.574   5.903  -5.444
   76   2HD1  ILE  10          2HD1      ILE  10 -10.890   6.061  -3.826
   77   3HD1  ILE  10          3HD1      ILE  10  -9.853   6.235  -5.242
   78    H    SER  11           H        SER  11 -11.800   1.453  -1.821
   79    HA   SER  11           HA       SER  11  -9.080   1.735  -0.820
   80   1HB   SER  11          1HB       SER  11 -11.465   2.096   0.317
   81   2HB   SER  11          2HB       SER  11 -11.271   0.398   0.738
   82    HG   SER  11           HG       SER  11 -10.362   2.211   2.167
   83    H    ARG  12           H        ARG  12 -11.173  -0.963  -1.742
   84    HA   ARG  12           HA       ARG  12  -9.559  -3.100  -0.685
   85   1HB   ARG  12          1HB       ARG  12 -11.824  -2.728  -2.567
   86   2HB   ARG  12          2HB       ARG  12 -10.854  -4.169  -2.846
   87   1HG   ARG  12          1HG       ARG  12 -11.557  -3.645  -0.012
   88   2HG   ARG  12          2HG       ARG  12 -12.904  -4.058  -1.067
   89   1HD   ARG  12          1HD       ARG  12 -12.107  -6.152  -0.240
   90   2HD   ARG  12          2HD       ARG  12 -11.439  -6.034  -1.877
   91    HE   ARG  12           HE       ARG  12  -9.289  -5.352  -0.903
   92   1HH1  ARG  12          1HH1      ARG  12 -10.253  -4.257   1.715
   93   2HH1  ARG  12          2HH1      ARG  12  -9.793  -5.503   2.822
   94   1HH2  ARG  12          1HH2      ARG  12  -9.340  -7.899   0.325
   95   2HH2  ARG  12          2HH2      ARG  12  -9.271  -7.591   2.024
   96    H    PHE  13           H        PHE  13  -9.483  -1.238  -3.703
   97    HA   PHE  13           HA       PHE  13  -7.398  -2.931  -4.906
   98   1HB   PHE  13          1HB       PHE  13  -8.487  -2.220  -6.731
   99   2HB   PHE  13          2HB       PHE  13  -9.487  -1.173  -5.750
  100    HD1  PHE  13           HD1      PHE  13  -6.469  -1.382  -7.868
  101    HD2  PHE  13           HD2      PHE  13  -9.011   1.212  -5.581
  102    HE1  PHE  13           HE1      PHE  13  -5.403   0.596  -8.920
  103    HE2  PHE  13           HE2      PHE  13  -7.944   3.189  -6.631
  104    HZ   PHE  13           HZ       PHE  13  -6.143   2.881  -8.297
  105    H    ARG  14           H        ARG  14  -7.643   0.341  -3.431
  106    HA   ARG  14           HA       ARG  14  -5.022   1.197  -4.132
  107   1HB   ARG  14          1HB       ARG  14  -5.367   2.961  -2.626
  108   2HB   ARG  14          2HB       ARG  14  -6.977   2.539  -3.183
  109   1HG   ARG  14          1HG       ARG  14  -7.358   1.245  -1.127
  110   2HG   ARG  14          2HG       ARG  14  -5.728   1.613  -0.574
  111   1HD   ARG  14          1HD       ARG  14  -7.183   4.041  -1.322
  112   2HD   ARG  14          2HD       ARG  14  -7.993   3.143  -0.022
  113    HE   ARG  14           HE       ARG  14  -5.082   3.843   0.114
  114   1HH1  ARG  14          1HH1      ARG  14  -6.512   1.940   2.077
  115   2HH1  ARG  14          2HH1      ARG  14  -6.785   3.001   3.417
  116   1HH2  ARG  14          1HH2      ARG  14  -6.178   5.896   1.559
  117   2HH2  ARG  14          2HH2      ARG  14  -6.593   5.273   3.117
  118    H    ARG  15           H        ARG  15  -5.934  -1.253  -1.846
  119    HA   ARG  15           HA       ARG  15  -3.791  -1.065   0.040
  120   1HB   ARG  15          1HB       ARG  15  -5.933  -2.465   0.081
  121   2HB   ARG  15          2HB       ARG  15  -5.118  -3.579  -1.016
  122   1HG   ARG  15          1HG       ARG  15  -3.269  -3.788   0.671
  123   2HG   ARG  15          2HG       ARG  15  -4.237  -2.822   1.786
  124   1HD   ARG  15          1HD       ARG  15  -5.995  -4.476   1.825
  125   2HD   ARG  15          2HD       ARG  15  -5.233  -5.395   0.512
  126    HE   ARG  15           HE       ARG  15  -4.153  -5.165   3.283
  127   1HH1  ARG  15          1HH2      ARG  15  -5.064  -7.554   1.309
  128   2HH1  ARG  15          2HH2      ARG  15  -3.538  -8.354   1.172
  129   1HH2  ARG  15          1HH1      ARG  15  -1.743  -5.718   2.590
  130   2HH2  ARG  15          2HH1      ARG  15  -1.632  -7.303   1.911
  131    H    LYS  16           H        LYS  16  -4.064  -2.762  -3.102
  132    HA   LYS  16           HA       LYS  16  -1.385  -3.888  -3.053
  133   1HB   LYS  16          1HB       LYS  16  -3.465  -4.618  -4.398
  134   2HB   LYS  16          2HB       LYS  16  -3.113  -3.266  -5.471
  135   1HG   LYS  16          1HG       LYS  16  -0.687  -4.334  -5.492
  136   2HG   LYS  16          2HG       LYS  16  -1.567  -5.793  -5.034
  137   1HD   LYS  16          1HD       LYS  16  -3.087  -5.415  -7.004
  138   2HD   LYS  16          2HD       LYS  16  -2.036  -4.091  -7.498
  139   1HE   LYS  16          1HE       LYS  16  -1.188  -5.900  -8.739
  140   2HE   LYS  16          2HE       LYS  16  -0.120  -5.885  -7.324
  141   1HZ   LYS  16          1HZ       LYS  16  -2.609  -7.506  -7.537
  142   2HZ   LYS  16          2HZ       LYS  16  -1.040  -8.107  -7.776
  143   3HZ   LYS  16          3HZ       LYS  16  -1.492  -7.526  -6.253
  144    H    ILE  17           H        ILE  17  -2.888  -0.990  -4.458
  145    HA   ILE  17           HA       ILE  17  -0.615   0.061  -5.843
  146    HB   ILE  17           HB       ILE  17  -3.256   1.006  -4.787
  147   1HG1  ILE  17          1HG1      ILE  17  -3.467   1.754  -7.165
  148   2HG1  ILE  17          2HG1      ILE  17  -1.844   1.136  -7.464
  149   1HG2  ILE  17          1HG2      ILE  17  -1.063   2.906  -5.647
  150   2HG2  ILE  17          2HG2      ILE  17  -2.775   3.329  -5.648
  151   3HG2  ILE  17          3HG2      ILE  17  -1.965   2.928  -4.133
  152   1HD1  ILE  17          1HD1      ILE  17  -4.165  -0.533  -6.450
  153   2HD1  ILE  17          2HD1      ILE  17  -3.631  -0.470  -8.128
  154   3HD1  ILE  17          3HD1      ILE  17  -2.562  -1.126  -6.891
  155    H    ALA  18           H        ALA  18  -1.773   0.417  -2.487
  156    HA   ALA  18           HA       ALA  18   0.216   2.277  -1.580
  157   1HB   ALA  18          1HB       ALA  18  -1.432   0.147  -0.173
  158   2HB   ALA  18          2HB       ALA  18  -0.475   1.363   0.674
  159   3HB   ALA  18          3HB       ALA  18  -1.833   1.857  -0.337
  160    H    LYS  19           H        LYS  19   0.178  -1.311  -1.759
  161    HA   LYS  19           HA       LYS  19   2.633  -1.762  -0.334
  162   1HB   LYS  19          1HB       LYS  19   0.691  -3.307  -1.587
  163   2HB   LYS  19          2HB       LYS  19   2.106  -3.569  -2.600
  164   1HG   LYS  19          1HG       LYS  19   1.993  -3.945   0.406
  165   2HG   LYS  19          2HG       LYS  19   1.989  -5.236  -0.791
  166   1HD   LYS  19          1HD       LYS  19   4.216  -4.049  -1.605
  167   2HD   LYS  19          2HD       LYS  19   4.236  -3.432   0.043
  168   1HE   LYS  19          1HE       LYS  19   3.977  -6.378  -0.648
  169   2HE   LYS  19          2HE       LYS  19   5.509  -5.590  -0.258
  170   1HZ   LYS  19          1HZ       LYS  19   3.716  -4.829   1.737
  171   2HZ   LYS  19          2HZ       LYS  19   3.484  -6.489   1.503
  172   3HZ   LYS  19          3HZ       LYS  19   5.026  -5.896   1.874
  173    H    ARG  20           H        ARG  20   1.916  -0.926  -3.688
  174    HA   ARG  20           HA       ARG  20   4.540  -1.265  -4.821
  175   1HB   ARG  20          1HB       ARG  20   2.187  -0.983  -5.897
  176   2HB   ARG  20          2HB       ARG  20   2.437   0.741  -5.662
  177   1HG   ARG  20          1HG       ARG  20   3.404   0.657  -7.706
  178   2HG   ARG  20          2HG       ARG  20   4.806   0.042  -6.834
  179   1HD   ARG  20          1HD       ARG  20   2.718  -1.951  -7.618
  180   2HD   ARG  20          2HD       ARG  20   3.747  -1.299  -8.903
  181    HE   ARG  20           HE       ARG  20   5.309  -2.073  -6.574
  182   1HH1  ARG  20          1HH1      ARG  20   6.024  -2.374  -9.528
  183   2HH1  ARG  20          2HH1      ARG  20   6.034  -4.094  -9.701
  184   1HH2  ARG  20          1HH2      ARG  20   4.308  -4.629  -6.703
  185   2HH2  ARG  20          2HH2      ARG  20   5.046  -5.398  -8.068
  186    H    SER  21           H        SER  21   2.817   1.489  -3.325
  187    HA   SER  21           HA       SER  21   4.861   3.483  -3.703
  188   1HB   SER  21          1HB       SER  21   2.353   3.705  -3.072
  189   2HB   SER  21          2HB       SER  21   2.877   3.372  -1.427
  190    HG   SER  21           HG       SER  21   3.213   5.481  -1.451
  191    H    ILE  22           H        ILE  22   4.191   1.158  -1.070
  192    HA   ILE  22           HA       ILE  22   6.134   2.121   0.805
  193    HB   ILE  22           HB       ILE  22   4.868  -0.590   0.299
  194   1HG1  ILE  22          1HG1      ILE  22   4.413   1.377   2.559
  195   2HG1  ILE  22          2HG1      ILE  22   3.474   1.411   1.069
  196   1HG2  ILE  22          1HG2      ILE  22   6.693   0.298   2.552
  197   2HG2  ILE  22          2HG2      ILE  22   5.617  -1.095   2.679
  198   3HG2  ILE  22          3HG2      ILE  22   6.907  -1.082   1.476
  199   1HD1  ILE  22          1HD1      ILE  22   3.407  -1.273   1.850
  200   2HD1  ILE  22          2HD1      ILE  22   3.235  -0.374   3.358
  201   3HD1  ILE  22          3HD1      ILE  22   2.105  -0.098   2.033
  202    H    LYS  23           H        LYS  23   6.385  -0.203  -1.904
  203    HA   LYS  23           HA       LYS  23   9.073  -1.067  -1.392
  204   1HB   LYS  23          1HB       LYS  23   7.288  -2.059  -2.934
  205   2HB   LYS  23          2HB       LYS  23   7.710  -0.791  -4.087
  206   1HG   LYS  23          1HG       LYS  23  10.006  -1.569  -4.191
  207   2HG   LYS  23          2HG       LYS  23   9.702  -2.764  -2.930
  208   1HD   LYS  23          1HD       LYS  23   7.747  -3.108  -5.003
  209   2HD   LYS  23          2HD       LYS  23   9.346  -3.052  -5.741
  210   1HE   LYS  23          1HE       LYS  23  10.145  -4.807  -4.205
  211   2HE   LYS  23          2HE       LYS  23   8.548  -4.868  -3.435
  212   1HZ   LYS  23          1HZ       LYS  23   7.581  -5.341  -5.641
  213   2HZ   LYS  23          2HZ       LYS  23   9.143  -5.422  -6.296
  214   3HZ   LYS  23          3HZ       LYS  23   8.654  -6.548  -5.126
  215    H    THR  24           H        THR  24   7.806   1.567  -3.509
  216    HA   THR  24           HA       THR  24  10.412   2.488  -4.349
  217    HB   THR  24           HB       THR  24   9.105   4.579  -4.967
  218    HG1  THR  24           HG1      THR  24   7.475   4.607  -3.498
  219   1HG2  THR  24          1HG2      THR  24   8.587   1.832  -5.903
  220   2HG2  THR  24          2HG2      THR  24   7.393   3.034  -6.391
  221   3HG2  THR  24          3HG2      THR  24   9.092   3.262  -6.804
  222    H    LEU  25           H        LEU  25   8.269   3.327  -1.637
  223    HA   LEU  25           HA       LEU  25   9.667   5.597  -0.631
  224   1HB   LEU  25          1HB       LEU  25   7.490   3.926   0.103
  225   2HB   LEU  25          2HB       LEU  25   8.574   3.969   1.484
  226    HG   LEU  25           HG       LEU  25   8.415   6.624   0.450
  227   1HD1  LEU  25          1HD1      LEU  25   6.298   5.933  -0.613
  228   2HD1  LEU  25          2HD1      LEU  25   5.711   5.340   0.942
  229   3HD1  LEU  25          3HD1      LEU  25   6.006   7.063   0.709
  230   1HD2  LEU  25          1HD2      LEU  25   8.811   5.753   2.819
  231   2HD2  LEU  25          2HD2      LEU  25   7.711   7.126   2.687
  232   3HD2  LEU  25          3HD2      LEU  25   7.067   5.500   2.920
  233    H    GLU  26           H        GLU  26  10.385   2.142  -0.358
  234    HA   GLU  26           HA       GLU  26  12.461   2.591   1.712
  235   1HB   GLU  26          1HB       GLU  26  10.682   0.524   1.020
  236   2HB   GLU  26          2HB       GLU  26  12.282  -0.082   0.598
  237   1HG   GLU  26          1HG       GLU  26  11.455   1.046   3.284
  238   2HG   GLU  26          2HG       GLU  26  11.727  -0.653   2.916
  239    H    HIS  27           H        HIS  27  12.207   1.578  -1.713
  240    HA   HIS  27           HA       HIS  27  15.122   1.226  -1.945
  241   1HB   HIS  27          1HB       HIS  27  13.241  -0.154  -3.033
  242   2HB   HIS  27          2HB       HIS  27  13.102   1.181  -4.179
  243    HD1  HIS  27           HD1      HIS  27  15.402  -1.577  -3.109
  244    HD2  HIS  27           HD2      HIS  27  15.343   1.505  -5.918
  245    HE1  HIS  27           HE1      HIS  27  17.329  -2.012  -4.694
  246    H    LYS  28           H        LYS  28  12.695   3.393  -3.463
  247    HA   LYS  28           HA       LYS  28  14.520   4.957  -4.983
  248   1HB   LYS  28          1HB       LYS  28  11.888   4.747  -4.919
  249   2HB   LYS  28          2HB       LYS  28  12.023   6.151  -3.863
  250   1HG   LYS  28          1HG       LYS  28  12.105   7.385  -5.745
  251   2HG   LYS  28          2HG       LYS  28  13.748   6.780  -5.945
  252   1HD   LYS  28          1HD       LYS  28  13.143   5.254  -7.562
  253   2HD   LYS  28          2HD       LYS  28  11.520   5.038  -6.908
  254   1HE   LYS  28          1HE       LYS  28  10.877   7.278  -7.749
  255   2HE   LYS  28          2HE       LYS  28  12.501   7.481  -8.432
  256   1HZ   LYS  28          1HZ       LYS  28  10.626   5.265  -9.100
  257   2HZ   LYS  28          2HZ       LYS  28  10.960   6.608 -10.084
  258   3HZ   LYS  28          3HZ       LYS  28  12.186   5.491  -9.751
  259    H    ARG  29           H        ARG  29  13.776   5.197  -1.527
  260    HA   ARG  29           HA       ARG  29  14.601   7.929  -1.161
  261   1HB   ARG  29          1HB       ARG  29  13.281   6.465   0.426
  262   2HB   ARG  29          2HB       ARG  29  14.776   5.609   0.792
  263   1HG   ARG  29          1HG       ARG  29  14.486   7.261   2.501
  264   2HG   ARG  29          2HG       ARG  29  15.781   7.835   1.453
  265   1HD   ARG  29          1HD       ARG  29  13.538   8.910   0.234
  266   2HD   ARG  29          2HD       ARG  29  13.127   9.015   1.954
  267    HE   ARG  29           HE       ARG  29  14.889  10.554   2.254
  268   1HH1  ARG  29          1HH2      ARG  29  14.379  11.154  -0.728
  269   2HH1  ARG  29          2HH2      ARG  29  15.997  11.174  -1.332
  270   1HH2  ARG  29          1HH1      ARG  29  17.324   9.594   1.486
  271   2HH2  ARG  29          2HH1      ARG  29  17.691  10.269  -0.061
  272    H    GLU  30           H        GLU  30  16.401   4.875  -0.613
  273    HA   GLU  30           HA       GLU  30  18.954   6.304  -0.353
  274   1HB   GLU  30          1HB       GLU  30  18.237   3.356  -0.426
  275   2HB   GLU  30          2HB       GLU  30  19.822   4.005  -0.004
  276   1HG   GLU  30          1HG       GLU  30  18.500   5.420   1.754
  277   2HG   GLU  30          2HG       GLU  30  17.236   4.215   1.517
  278    H    ASN  31           H        ASN  31  17.184   4.720  -2.950
  279    HA   ASN  31           HA       ASN  31  19.612   4.748  -4.684
  280   1HB   ASN  31          1HB       ASN  31  17.981   2.721  -4.213
  281   2HB   ASN  31          2HB       ASN  31  16.960   3.520  -5.406
  282   1HD2  ASN  31          2HD2      ASN  31  18.161   4.072  -7.564
  283   2HD2  ASN  31          1HD2      ASN  31  19.307   2.942  -8.101
  284    H    ALA  32           H        ALA  32  18.772   7.244  -4.196
  285    HA   ALA  32           HA       ALA  32  17.059   8.093  -6.509
  286   1HB   ALA  32          1HB       ALA  32  17.339   8.895  -3.671
  287   2HB   ALA  32          2HB       ALA  32  17.193  10.234  -4.810
  288   3HB   ALA  32          3HB       ALA  32  15.940   8.998  -4.737
  289    H    LYS  33           H        LYS  33  18.363   8.798  -8.158
  290    HA   LYS  33           HA       LYS  33  20.155  11.004  -7.915
  291   1HB   LYS  33          1HB       LYS  33  22.302   9.811  -8.373
  292   2HB   LYS  33          2HB       LYS  33  21.643   9.504  -6.779
  293   1HG   LYS  33          1HG       LYS  33  22.051   7.329  -7.312
  294   2HG   LYS  33          2HG       LYS  33  20.522   7.444  -8.175
  295   1HD   LYS  33          1HD       LYS  33  21.594   7.011 -10.103
  296   2HD   LYS  33          2HD       LYS  33  22.513   8.496  -9.909
  297   1HE   LYS  33          1HE       LYS  33  24.173   6.812 -10.067
  298   2HE   LYS  33          2HE       LYS  33  24.042   7.105  -8.324
  299   1HZ   LYS  33          1HZ       LYS  33  22.445   5.042  -9.749
  300   2HZ   LYS  33          2HZ       LYS  33  23.929   4.716  -8.992
  301   3HZ   LYS  33          3HZ       LYS  33  22.604   5.245  -8.071
  302    H    GLU  34           H        GLU  34  19.403   8.102  -9.847
  303    HA   GLU  34           HA       GLU  34  19.087   7.757 -12.091
  304   1HB   GLU  34          1HB       GLU  34  18.465  10.649 -11.670
  305   2HB   GLU  34          2HB       GLU  34  18.625  10.094 -13.333
  306   1HG   GLU  34          1HG       GLU  34  16.764   8.766 -13.226
  307   2HG   GLU  34          2HG       GLU  34  17.003   8.379 -11.524
  Start of MODEL    5
    1   1H    CYS   1          1H        CYS   1 -24.432   7.013 -13.509
    2   2H    CYS   1          2H        CYS   1 -24.336   8.033 -12.155
    3   3H    CYS   1          3H        CYS   1 -23.950   8.621 -13.701
    4    HA   CYS   1           HA       CYS   1 -22.009   7.246 -13.840
    5   1HB   CYS   1          1HB       CYS   1 -22.182   9.490 -12.518
    6   2HB   CYS   1          2HB       CYS   1 -21.975   8.480 -11.090
    7    HG   CYS   1           HG       CYS   1 -19.598   8.024 -11.724
    8    H    ALA   2           H        ALA   2 -23.227   6.905 -10.460
    9    HA   ALA   2           HA       ALA   2 -23.221   5.122  -8.979
   10   1HB   ALA   2          1HB       ALA   2 -24.622   4.326 -10.976
   11   2HB   ALA   2          2HB       ALA   2 -23.214   3.369 -11.439
   12   3HB   ALA   2          3HB       ALA   2 -24.007   3.081  -9.891
   13    H    VAL   3           H        VAL   3 -22.037   2.615  -9.053
   14    HA   VAL   3           HA       VAL   3 -20.182   1.415  -8.692
   15    HB   VAL   3           HB       VAL   3 -18.476   1.396 -10.206
   16   1HG1  VAL   3          1HG1      VAL   3 -20.763   1.363 -11.301
   17   2HG1  VAL   3          2HG1      VAL   3 -20.417   3.007 -11.840
   18   3HG1  VAL   3          3HG1      VAL   3 -19.381   1.675 -12.351
   19   1HG2  VAL   3          1HG2      VAL   3 -17.794   3.887  -9.660
   20   2HG2  VAL   3          2HG2      VAL   3 -17.336   3.158 -11.194
   21   3HG2  VAL   3          3HG2      VAL   3 -18.712   4.247 -11.121
   22    H    GLU   4           H        GLU   4 -19.555   4.883  -8.325
   23    HA   GLU   4           HA       GLU   4 -17.673   4.210  -6.098
   24   1HB   GLU   4          1HB       GLU   4 -17.893   6.307  -8.160
   25   2HB   GLU   4          2HB       GLU   4 -17.458   6.908  -6.560
   26   1HG   GLU   4          1HG       GLU   4 -15.497   5.659  -6.466
   27   2HG   GLU   4          2HG       GLU   4 -16.069   4.478  -7.644
   28    H    LEU   5           H        LEU   5 -20.647   4.088  -5.852
   29    HA   LEU   5           HA       LEU   5 -21.354   6.426  -4.183
   30   1HB   LEU   5          1HB       LEU   5 -22.775   5.122  -5.972
   31   2HB   LEU   5          2HB       LEU   5 -23.066   4.001  -4.645
   32    HG   LEU   5           HG       LEU   5 -23.665   6.178  -3.297
   33   1HD1  LEU   5          1HD1      LEU   5 -22.897   7.670  -5.190
   34   2HD1  LEU   5          2HD1      LEU   5 -24.277   7.089  -6.120
   35   3HD1  LEU   5          3HD1      LEU   5 -24.537   7.987  -4.626
   36   1HD2  LEU   5          1HD2      LEU   5 -25.393   4.905  -5.440
   37   2HD2  LEU   5          2HD2      LEU   5 -25.326   4.492  -3.725
   38   3HD2  LEU   5          3HD2      LEU   5 -26.026   6.026  -4.236
   39    H    ARG   6           H        ARG   6 -21.060   2.854  -3.799
   40    HA   ARG   6           HA       ARG   6 -20.276   3.196  -0.974
   41   1HB   ARG   6          1HB       ARG   6 -22.877   3.255  -1.422
   42   2HB   ARG   6          2HB       ARG   6 -22.688   1.507  -1.523
   43   1HG   ARG   6          1HG       ARG   6 -21.268   2.581   0.779
   44   2HG   ARG   6          2HG       ARG   6 -22.967   3.039   0.812
   45   1HD   ARG   6          1HD       ARG   6 -21.941   0.197   0.471
   46   2HD   ARG   6          2HD       ARG   6 -22.611   0.875   1.962
   47    HE   ARG   6           HE       ARG   6 -24.519   1.351  -0.082
   48   1HH1  ARG   6          1HH2      ARG   6 -25.234  -0.009   2.437
   49   2HH1  ARG   6          2HH2      ARG   6 -25.616  -1.614   1.921
   50   1HH2  ARG   6          1HH1      ARG   6 -24.031  -1.268  -1.167
   51   2HH2  ARG   6          2HH1      ARG   6 -24.929  -2.336  -0.146
   52    H    SER   7           H        SER   7 -18.913   1.996  -3.284
   53    HA   SER   7           HA       SER   7 -19.002  -0.908  -2.570
   54   1HB   SER   7          1HB       SER   7 -18.734   0.627  -5.077
   55   2HB   SER   7          2HB       SER   7 -17.651  -0.752  -4.937
   56    HG   SER   7           HG       SER   7 -20.482  -0.722  -4.582
   57    HA   PRO   8           HA       PRO   8 -14.912  -0.079  -0.955
   58   1HB   PRO   8          1HB       PRO   8 -14.569  -2.493   0.251
   59   2HB   PRO   8          2HB       PRO   8 -15.567  -1.192   0.929
   60   1HG   PRO   8          1HG       PRO   8 -16.383  -3.700  -0.349
   61   2HG   PRO   8          2HG       PRO   8 -17.237  -2.690   0.823
   62   1HD   PRO   8          1HD       PRO   8 -17.690  -2.828  -1.950
   63   2HD   PRO   8          2HD       PRO   8 -18.402  -1.678  -0.797
   64    H    GLY   9           H        GLY   9 -15.608  -1.911  -3.661
   65   1HA   GLY   9          1HA       GLY   9 -13.457  -3.721  -3.955
   66   2HA   GLY   9          2HA       GLY   9 -14.288  -2.922  -5.292
   67    H    ILE  10           H        ILE  10 -13.682  -0.298  -5.014
   68    HA   ILE  10           HA       ILE  10 -11.027  -0.061  -5.999
   69    HB   ILE  10           HB       ILE  10 -13.021   1.433  -6.333
   70   1HG1  ILE  10          1HG1      ILE  10 -10.604   1.994  -6.902
   71   2HG1  ILE  10          2HG1      ILE  10 -11.736   3.333  -6.786
   72   1HG2  ILE  10          1HG2      ILE  10 -13.691   1.677  -3.971
   73   2HG2  ILE  10          2HG2      ILE  10 -12.251   2.653  -3.680
   74   3HG2  ILE  10          3HG2      ILE  10 -13.496   3.227  -4.787
   75   1HD1  ILE  10          1HD1      ILE  10 -10.672   3.035  -4.190
   76   2HD1  ILE  10          2HD1      ILE  10  -9.303   2.856  -5.287
   77   3HD1  ILE  10          3HD1      ILE  10 -10.301   4.309  -5.348
   78    H    SER  11           H        SER  11 -12.308   0.309  -2.699
   79    HA   SER  11           HA       SER  11  -9.981   1.373  -1.430
   80   1HB   SER  11          1HB       SER  11 -11.780  -0.555  -0.009
   81   2HB   SER  11          2HB       SER  11 -11.155   0.991   0.529
   82    HG   SER  11           HG       SER  11 -13.280   1.333   0.073
   83    H    ARG  12           H        ARG  12 -11.057  -1.995  -1.950
   84    HA   ARG  12           HA       ARG  12  -8.983  -3.378  -0.584
   85   1HB   ARG  12          1HB       ARG  12 -11.198  -4.181  -1.677
   86   2HB   ARG  12          2HB       ARG  12 -10.264  -4.292  -3.167
   87   1HG   ARG  12          1HG       ARG  12  -8.989  -6.053  -2.409
   88   2HG   ARG  12          2HG       ARG  12  -9.104  -5.558  -0.723
   89   1HD   ARG  12          1HD       ARG  12 -11.051  -6.725  -0.376
   90   2HD   ARG  12          2HD       ARG  12 -11.661  -6.401  -2.010
   91    HE   ARG  12           HE       ARG  12 -10.373  -8.241  -2.844
   92   1HH1  ARG  12          1HH1      ARG  12  -7.981  -7.732  -1.021
   93   2HH1  ARG  12          2HH1      ARG  12  -7.976  -9.158  -0.046
   94   1HH2  ARG  12          1HH2      ARG  12 -11.237 -10.057  -0.936
   95   2HH2  ARG  12          2HH2      ARG  12  -9.854 -10.498   0.002
   96    H    PHE  13           H        PHE  13  -9.129  -2.000  -3.840
   97    HA   PHE  13           HA       PHE  13  -6.482  -2.986  -4.645
   98   1HB   PHE  13          1HB       PHE  13  -7.802  -2.885  -6.501
   99   2HB   PHE  13          2HB       PHE  13  -8.881  -1.706  -5.789
  100    HD1  PHE  13           HD1      PHE  13  -5.442  -2.004  -7.284
  101    HD2  PHE  13           HD2      PHE  13  -8.886   0.473  -6.598
  102    HE1  PHE  13           HE1      PHE  13  -4.466  -0.242  -8.729
  103    HE2  PHE  13           HE2      PHE  13  -7.909   2.234  -8.041
  104    HZ   PHE  13           HZ       PHE  13  -5.699   1.878  -9.108
  105    H    ARG  14           H        ARG  14  -7.912   0.004  -3.369
  106    HA   ARG  14           HA       ARG  14  -5.837   1.862  -3.863
  107   1HB   ARG  14          1HB       ARG  14  -8.209   1.640  -2.240
  108   2HB   ARG  14          2HB       ARG  14  -6.918   2.358  -1.282
  109   1HG   ARG  14          1HG       ARG  14  -6.564   4.093  -2.917
  110   2HG   ARG  14          2HG       ARG  14  -7.663   3.313  -4.057
  111   1HD   ARG  14          1HD       ARG  14  -9.530   3.625  -2.417
  112   2HD   ARG  14          2HD       ARG  14  -8.419   4.536  -1.378
  113    HE   ARG  14           HE       ARG  14  -8.463   5.522  -4.130
  114   1HH1  ARG  14          1HH1      ARG  14  -8.045   7.176  -1.621
  115   2HH1  ARG  14          2HH1      ARG  14  -9.513   8.085  -1.558
  116   1HH2  ARG  14          1HH2      ARG  14 -11.187   6.009  -3.809
  117   2HH2  ARG  14          2HH2      ARG  14 -11.319   7.419  -2.819
  118    H    ARG  15           H        ARG  15  -6.247  -0.356  -1.054
  119    HA   ARG  15           HA       ARG  15  -3.854   0.470   0.288
  120   1HB   ARG  15          1HB       ARG  15  -4.187  -1.474   1.657
  121   2HB   ARG  15          2HB       ARG  15  -5.778  -0.862   1.241
  122   1HG   ARG  15          1HG       ARG  15  -6.243  -2.991   0.625
  123   2HG   ARG  15          2HG       ARG  15  -5.275  -2.660  -0.805
  124   1HD   ARG  15          1HD       ARG  15  -4.244  -4.594   0.031
  125   2HD   ARG  15          2HD       ARG  15  -3.247  -3.322   0.756
  126    HE   ARG  15           HE       ARG  15  -5.561  -4.049   2.403
  127   1HH1  ARG  15          1HH2      ARG  15  -4.172  -6.624   2.150
  128   2HH1  ARG  15          2HH2      ARG  15  -2.976  -6.557   3.396
  129   1HH2  ARG  15          1HH1      ARG  15  -3.204  -3.092   3.768
  130   2HH2  ARG  15          2HH1      ARG  15  -2.420  -4.527   4.328
  131    H    LYS  16           H        LYS  16  -4.375  -1.736  -2.419
  132    HA   LYS  16           HA       LYS  16  -1.757  -2.975  -2.342
  133   1HB   LYS  16          1HB       LYS  16  -4.005  -3.662  -3.538
  134   2HB   LYS  16          2HB       LYS  16  -3.426  -2.608  -4.828
  135   1HG   LYS  16          1HG       LYS  16  -1.188  -3.972  -4.522
  136   2HG   LYS  16          2HG       LYS  16  -2.263  -5.184  -3.825
  137   1HD   LYS  16          1HD       LYS  16  -3.407  -4.127  -6.263
  138   2HD   LYS  16          2HD       LYS  16  -1.773  -4.707  -6.566
  139   1HE   LYS  16          1HE       LYS  16  -3.224  -6.576  -4.866
  140   2HE   LYS  16          2HE       LYS  16  -4.088  -6.291  -6.387
  141   1HZ   LYS  16          1HZ       LYS  16  -1.180  -6.904  -6.213
  142   2HZ   LYS  16          2HZ       LYS  16  -2.380  -8.044  -6.557
  143   3HZ   LYS  16          3HZ       LYS  16  -2.115  -6.758  -7.629
  144    H    ILE  17           H        ILE  17  -3.117  -0.042  -3.830
  145    HA   ILE  17           HA       ILE  17  -0.891   0.615  -5.536
  146    HB   ILE  17           HB       ILE  17  -2.881   2.412  -4.085
  147   1HG1  ILE  17          1HG1      ILE  17  -3.057   1.558  -6.978
  148   2HG1  ILE  17          2HG1      ILE  17  -3.778   0.574  -5.705
  149   1HG2  ILE  17          1HG2      ILE  17  -1.183   2.942  -6.542
  150   2HG2  ILE  17          2HG2      ILE  17  -2.402   4.033  -5.884
  151   3HG2  ILE  17          3HG2      ILE  17  -0.954   3.664  -4.950
  152   1HD1  ILE  17          1HD1      ILE  17  -4.605   3.174  -5.103
  153   2HD1  ILE  17          2HD1      ILE  17  -4.727   3.073  -6.859
  154   3HD1  ILE  17          3HD1      ILE  17  -5.585   1.913  -5.848
  155    H    ALA  18           H        ALA  18  -1.764   1.477  -2.183
  156    HA   ALA  18           HA       ALA  18   0.522   3.082  -1.564
  157   1HB   ALA  18          1HB       ALA  18  -1.545   1.540  -0.019
  158   2HB   ALA  18          2HB       ALA  18  -0.185   2.268   0.837
  159   3HB   ALA  18          3HB       ALA  18  -1.283   3.283  -0.097
  160    H    LYS  19           H        LYS  19   0.000  -0.470  -1.217
  161    HA   LYS  19           HA       LYS  19   2.484  -0.941   0.143
  162   1HB   LYS  19          1HB       LYS  19   1.950  -3.207  -0.083
  163   2HB   LYS  19          2HB       LYS  19   0.384  -2.418  -0.102
  164   1HG   LYS  19          1HG       LYS  19  -0.061  -3.415  -2.063
  165   2HG   LYS  19          2HG       LYS  19   1.277  -2.546  -2.805
  166   1HD   LYS  19          1HD       LYS  19   2.832  -4.307  -2.193
  167   2HD   LYS  19          2HD       LYS  19   1.577  -5.148  -1.285
  168   1HE   LYS  19          1HE       LYS  19   1.207  -6.306  -3.209
  169   2HE   LYS  19          2HE       LYS  19   0.391  -4.839  -3.775
  170   1HZ   LYS  19          1HZ       LYS  19   2.680  -4.033  -4.440
  171   2HZ   LYS  19          2HZ       LYS  19   3.213  -5.629  -4.196
  172   3HZ   LYS  19          3HZ       LYS  19   2.037  -5.294  -5.370
  173    H    ARG  20           H        ARG  20   1.757  -0.401  -3.231
  174    HA   ARG  20           HA       ARG  20   4.303  -1.438  -4.249
  175   1HB   ARG  20          1HB       ARG  20   1.912  -1.113  -5.385
  176   2HB   ARG  20          2HB       ARG  20   2.527   0.509  -5.704
  177   1HG   ARG  20          1HG       ARG  20   3.333  -0.515  -7.593
  178   2HG   ARG  20          2HG       ARG  20   4.672  -0.892  -6.512
  179   1HD   ARG  20          1HD       ARG  20   3.562  -3.071  -5.965
  180   2HD   ARG  20          2HD       ARG  20   2.333  -2.713  -7.193
  181    HE   ARG  20           HE       ARG  20   5.228  -3.176  -7.754
  182   1HH1  ARG  20          1HH2      ARG  20   2.844  -4.859  -8.762
  183   2HH1  ARG  20          2HH2      ARG  20   2.763  -4.335 -10.408
  184   1HH2  ARG  20          1HH1      ARG  20   4.755  -1.526  -9.902
  185   2HH2  ARG  20          2HH1      ARG  20   3.851  -2.438 -11.056
  186    H    SER  21           H        SER  21   2.876   1.704  -3.321
  187    HA   SER  21           HA       SER  21   5.002   3.419  -4.201
  188   1HB   SER  21          1HB       SER  21   3.016   3.634  -1.905
  189   2HB   SER  21          2HB       SER  21   4.029   4.958  -2.463
  190    HG   SER  21           HG       SER  21   2.063   5.107  -3.515
  191    H    ILE  22           H        ILE  22   4.375   1.701  -1.139
  192    HA   ILE  22           HA       ILE  22   6.617   2.641   0.365
  193    HB   ILE  22           HB       ILE  22   4.993   0.076   0.451
  194   1HG1  ILE  22          1HG1      ILE  22   4.961   2.365   2.423
  195   2HG1  ILE  22          2HG1      ILE  22   3.974   2.412   0.963
  196   1HG2  ILE  22          1HG2      ILE  22   7.213   1.060   2.243
  197   2HG2  ILE  22          2HG2      ILE  22   5.924   0.043   2.886
  198   3HG2  ILE  22          3HG2      ILE  22   6.957  -0.556   1.589
  199   1HD1  ILE  22          1HD1      ILE  22   3.128   0.081   1.685
  200   2HD1  ILE  22          2HD1      ILE  22   3.822   0.461   3.261
  201   3HD1  ILE  22          3HD1      ILE  22   2.543   1.474   2.592
  202    H    LYS  23           H        LYS  23   6.280  -0.100  -1.933
  203    HA   LYS  23           HA       LYS  23   8.783  -1.366  -1.508
  204   1HB   LYS  23          1HB       LYS  23   7.226  -0.931  -4.080
  205   2HB   LYS  23          2HB       LYS  23   8.532  -2.094  -3.885
  206   1HG   LYS  23          1HG       LYS  23   6.828  -2.659  -1.751
  207   2HG   LYS  23          2HG       LYS  23   5.732  -2.292  -3.081
  208   1HD   LYS  23          1HD       LYS  23   6.668  -3.989  -4.466
  209   2HD   LYS  23          2HD       LYS  23   8.055  -4.197  -3.395
  210   1HE   LYS  23          1HE       LYS  23   6.255  -4.812  -1.587
  211   2HE   LYS  23          2HE       LYS  23   5.213  -5.115  -2.989
  212   1HZ   LYS  23          1HZ       LYS  23   7.923  -6.267  -2.583
  213   2HZ   LYS  23          2HZ       LYS  23   6.464  -7.100  -2.383
  214   3HZ   LYS  23          3HZ       LYS  23   6.914  -6.546  -3.923
  215    H    THR  24           H        THR  24   7.954   1.348  -3.701
  216    HA   THR  24           HA       THR  24  10.622   1.779  -4.712
  217    HB   THR  24           HB       THR  24   8.375   3.802  -4.376
  218    HG1  THR  24           HG1      THR  24   7.347   2.384  -5.558
  219   1HG2  THR  24          1HG2      THR  24  10.653   3.560  -6.355
  220   2HG2  THR  24          2HG2      THR  24   9.335   4.722  -6.489
  221   3HG2  THR  24          3HG2      THR  24  10.450   4.808  -5.125
  222    H    LEU  25           H        LEU  25   8.781   3.132  -1.983
  223    HA   LEU  25           HA       LEU  25  10.685   5.058  -1.057
  224   1HB   LEU  25          1HB       LEU  25   8.227   3.713  -0.145
  225   2HB   LEU  25          2HB       LEU  25   9.301   4.146   1.172
  226    HG   LEU  25           HG       LEU  25   7.637   5.911   0.648
  227   1HD1  LEU  25          1HD1      LEU  25  10.511   6.685   0.083
  228   2HD1  LEU  25          2HD1      LEU  25   9.227   7.790   0.568
  229   3HD1  LEU  25          3HD1      LEU  25   9.769   6.532   1.675
  230   1HD2  LEU  25          1HD2      LEU  25   7.508   5.528  -1.798
  231   2HD2  LEU  25          2HD2      LEU  25   7.867   7.214  -1.426
  232   3HD2  LEU  25          3HD2      LEU  25   9.154   6.141  -1.974
  233    H    GLU  26           H        GLU  26  10.193   1.615  -0.254
  234    HA   GLU  26           HA       GLU  26  12.187   1.394   1.785
  235   1HB   GLU  26          1HB       GLU  26  10.392  -0.323   0.291
  236   2HB   GLU  26          2HB       GLU  26  11.977  -1.082   0.437
  237   1HG   GLU  26          1HG       GLU  26  10.574   0.153   2.810
  238   2HG   GLU  26          2HG       GLU  26  10.327  -1.530   2.341
  239    H    HIS  27           H        HIS  27  12.366   0.871  -1.751
  240    HA   HIS  27           HA       HIS  27  15.054  -0.096  -1.879
  241   1HB   HIS  27          1HB       HIS  27  13.259   1.436  -3.777
  242   2HB   HIS  27          2HB       HIS  27  14.872   0.923  -4.245
  243    HD1  HIS  27           HD1      HIS  27  13.268  -1.543  -2.024
  244    HD2  HIS  27           HD2      HIS  27  13.325  -0.763  -6.121
  245    HE1  HIS  27           HE1      HIS  27  12.398  -3.623  -3.158
  246    H    LYS  28           H        LYS  28  13.736   3.221  -1.899
  247    HA   LYS  28           HA       LYS  28  16.306   4.513  -2.260
  248   1HB   LYS  28          1HB       LYS  28  13.599   5.222  -2.331
  249   2HB   LYS  28          2HB       LYS  28  14.254   6.130  -0.970
  250   1HG   LYS  28          1HG       LYS  28  15.721   7.340  -2.292
  251   2HG   LYS  28          2HG       LYS  28  15.819   6.081  -3.523
  252   1HD   LYS  28          1HD       LYS  28  13.307   6.604  -3.943
  253   2HD   LYS  28          2HD       LYS  28  13.634   8.108  -3.085
  254   1HE   LYS  28          1HE       LYS  28  15.679   7.532  -5.104
  255   2HE   LYS  28          2HE       LYS  28  14.058   7.677  -5.804
  256   1HZ   LYS  28          1HZ       LYS  28  15.285   9.631  -3.922
  257   2HZ   LYS  28          2HZ       LYS  28  15.137   9.843  -5.593
  258   3HZ   LYS  28          3HZ       LYS  28  13.743   9.755  -4.630
  259    H    ARG  29           H        ARG  29  14.864   3.047   0.541
  260    HA   ARG  29           HA       ARG  29  16.481   4.742   2.387
  261   1HB   ARG  29          1HB       ARG  29  13.999   4.310   2.716
  262   2HB   ARG  29          2HB       ARG  29  14.416   2.626   3.043
  263   1HG   ARG  29          1HG       ARG  29  15.870   3.312   4.890
  264   2HG   ARG  29          2HG       ARG  29  15.532   5.007   4.553
  265   1HD   ARG  29          1HD       ARG  29  13.635   4.928   5.782
  266   2HD   ARG  29          2HD       ARG  29  13.042   3.539   4.851
  267    HE   ARG  29           HE       ARG  29  14.046   2.059   6.439
  268   1HH1  ARG  29          1HH2      ARG  29  13.025   4.328   8.263
  269   2HH1  ARG  29          2HH2      ARG  29  14.374   4.521   9.325
  270   1HH2  ARG  29          1HH1      ARG  29  16.560   2.734   7.267
  271   2HH2  ARG  29          2HH1      ARG  29  16.406   3.605   8.756
  272    H    GLU  30           H        GLU  30  15.835   1.287   1.640
  273    HA   GLU  30           HA       GLU  30  18.070   0.356   3.289
  274   1HB   GLU  30          1HB       GLU  30  15.713  -0.717   2.445
  275   2HB   GLU  30          2HB       GLU  30  16.826  -1.437   1.284
  276   1HG   GLU  30          1HG       GLU  30  17.212  -1.517   4.290
  277   2HG   GLU  30          2HG       GLU  30  16.498  -2.818   3.346
  278    H    ASN  31           H        ASN  31  17.471   0.729  -0.238
  279    HA   ASN  31           HA       ASN  31  20.248  -0.182  -0.798
  280   1HB   ASN  31          1HB       ASN  31  17.863   0.450  -2.565
  281   2HB   ASN  31          2HB       ASN  31  19.419  -0.092  -3.169
  282   1HD2  ASN  31          2HD2      ASN  31  20.180  -2.284  -1.903
  283   2HD2  ASN  31          1HD2      ASN  31  18.946  -3.438  -1.737
  284    H    ALA  32           H        ALA  32  20.219   2.221   0.574
  285    HA   ALA  32           HA       ALA  32  20.582   4.387  -1.451
  286   1HB   ALA  32          1HB       ALA  32  19.066   4.607   0.571
  287   2HB   ALA  32          2HB       ALA  32  20.519   4.559   1.569
  288   3HB   ALA  32          3HB       ALA  32  20.288   5.869   0.411
  289    H    LYS  33           H        LYS  33  22.592   5.419  -1.666
  290    HA   LYS  33           HA       LYS  33  24.907   4.225  -0.174
  291   1HB   LYS  33          1HB       LYS  33  24.394   4.033  -2.815
  292   2HB   LYS  33          2HB       LYS  33  25.260   5.566  -2.812
  293   1HG   LYS  33          1HG       LYS  33  26.438   3.307  -1.250
  294   2HG   LYS  33          2HG       LYS  33  26.537   3.224  -3.006
  295   1HD   LYS  33          1HD       LYS  33  27.271   5.834  -1.789
  296   2HD   LYS  33          2HD       LYS  33  28.376   4.501  -1.476
  297   1HE   LYS  33          1HE       LYS  33  27.423   4.926  -4.292
  298   2HE   LYS  33          2HE       LYS  33  28.681   5.992  -3.645
  299   1HZ   LYS  33          1HZ       LYS  33  28.806   3.025  -3.463
  300   2HZ   LYS  33          2HZ       LYS  33  29.542   3.919  -4.699
  301   3HZ   LYS  33          3HZ       LYS  33  30.036   4.139  -3.090
  302    H    GLU  34           H        GLU  34  26.151   5.646   0.969
  303    HA   GLU  34           HA       GLU  34  25.935   8.563   0.394
  304   1HB   GLU  34          1HB       GLU  34  26.073   8.802   2.967
  305   2HB   GLU  34          2HB       GLU  34  24.537   8.338   2.256
  306   1HG   GLU  34          1HG       GLU  34  24.647   6.184   3.105
  307   2HG   GLU  34          2HG       GLU  34  26.408   6.157   3.110
  Start of MODEL    6
    1   1H    CYS   1          1H        CYS   1  -8.543 -11.822   6.885
    2   2H    CYS   1          2H        CYS   1  -8.235 -10.823   8.222
    3   3H    CYS   1          3H        CYS   1  -8.609 -12.459   8.456
    4    HA   CYS   1           HA       CYS   1 -10.851 -12.142   7.654
    5   1HB   CYS   1          1HB       CYS   1  -9.703 -10.448   9.848
    6   2HB   CYS   1          2HB       CYS   1 -11.417 -10.303   9.469
    7    HG   CYS   1           HG       CYS   1 -11.820 -12.676  10.244
    8    H    ALA   2           H        ALA   2 -12.370 -10.852   6.557
    9    HA   ALA   2           HA       ALA   2 -11.855  -8.022   5.925
   10   1HB   ALA   2          1HB       ALA   2 -11.472 -10.279   3.957
   11   2HB   ALA   2          2HB       ALA   2 -11.862  -8.649   3.413
   12   3HB   ALA   2          3HB       ALA   2 -10.381  -8.942   4.323
   13    H    VAL   3           H        VAL   3 -14.045  -9.009   7.259
   14    HA   VAL   3           HA       VAL   3 -16.237  -9.015   5.221
   15    HB   VAL   3           HB       VAL   3 -17.579 -10.195   6.964
   16   1HG1  VAL   3          1HG1      VAL   3 -16.436 -11.412   5.155
   17   2HG1  VAL   3          2HG1      VAL   3 -15.011 -11.588   6.179
   18   3HG1  VAL   3          3HG1      VAL   3 -16.525 -12.369   6.632
   19   1HG2  VAL   3          1HG2      VAL   3 -16.186  -9.474   8.945
   20   2HG2  VAL   3          2HG2      VAL   3 -16.497 -11.207   8.882
   21   3HG2  VAL   3          3HG2      VAL   3 -14.925 -10.578   8.394
   22    H    GLU   4           H        GLU   4 -15.231  -7.617   8.341
   23    HA   GLU   4           HA       GLU   4 -17.637  -5.943   8.507
   24   1HB   GLU   4          1HB       GLU   4 -15.105  -6.299  10.105
   25   2HB   GLU   4          2HB       GLU   4 -16.261  -5.026  10.486
   26   1HG   GLU   4          1HG       GLU   4 -17.370  -7.767  10.106
   27   2HG   GLU   4          2HG       GLU   4 -16.427  -7.483  11.567
   28    H    LEU   5           H        LEU   5 -15.583  -5.603   6.172
   29    HA   LEU   5           HA       LEU   5 -14.928  -2.714   6.595
   30   1HB   LEU   5          1HB       LEU   5 -13.536  -5.061   5.595
   31   2HB   LEU   5          2HB       LEU   5 -13.567  -3.806   4.369
   32    HG   LEU   5           HG       LEU   5 -11.565  -3.693   5.817
   33   1HD1  LEU   5          1HD1      LEU   5 -13.341  -1.562   5.158
   34   2HD1  LEU   5          2HD1      LEU   5 -12.604  -1.202   6.720
   35   3HD1  LEU   5          3HD1      LEU   5 -11.586  -1.525   5.317
   36   1HD2  LEU   5          1HD2      LEU   5 -13.564  -3.059   8.015
   37   2HD2  LEU   5          2HD2      LEU   5 -12.559  -4.505   7.917
   38   3HD2  LEU   5          3HD2      LEU   5 -11.814  -2.928   8.162
   39    H    ARG   6           H        ARG   6 -17.567  -3.544   5.895
   40    HA   ARG   6           HA       ARG   6 -19.252  -3.446   4.340
   41   1HB   ARG   6          1HB       ARG   6 -19.437  -1.210   3.390
   42   2HB   ARG   6          2HB       ARG   6 -18.857  -1.153   5.043
   43   1HG   ARG   6          1HG       ARG   6 -16.857  -0.243   4.432
   44   2HG   ARG   6          2HG       ARG   6 -16.729  -1.237   2.984
   45   1HD   ARG   6          1HD       ARG   6 -18.867   0.842   2.972
   46   2HD   ARG   6          2HD       ARG   6 -17.189   1.401   2.842
   47    HE   ARG   6           HE       ARG   6 -17.558  -0.846   1.103
   48   1HH1  ARG   6          1HH1      ARG   6 -17.222   2.532   1.131
   49   2HH1  ARG   6          2HH1      ARG   6 -17.890   2.767  -0.443
   50   1HH2  ARG   6          1HH2      ARG   6 -18.916  -0.541  -0.806
   51   2HH2  ARG   6          2HH2      ARG   6 -18.858   1.020  -1.550
   52    H    SER   7           H        SER   7 -17.691  -5.302   3.365
   53    HA   SER   7           HA       SER   7 -17.307  -6.570   1.485
   54   1HB   SER   7          1HB       SER   7 -19.448  -4.984   0.868
   55   2HB   SER   7          2HB       SER   7 -18.338  -4.594  -0.438
   56    HG   SER   7           HG       SER   7 -19.799  -6.831  -0.009
   57    HA   PRO   8           HA       PRO   8 -13.412  -4.847   0.170
   58   1HB   PRO   8          1HB       PRO   8 -12.517  -7.010  -1.229
   59   2HB   PRO   8          2HB       PRO   8 -12.514  -6.935   0.544
   60   1HG   PRO   8          1HG       PRO   8 -14.377  -8.336  -1.279
   61   2HG   PRO   8          2HG       PRO   8 -13.776  -8.814   0.317
   62   1HD   PRO   8          1HD       PRO   8 -16.260  -7.767  -0.145
   63   2HD   PRO   8          2HD       PRO   8 -15.409  -7.692   1.415
   64    H    GLY   9           H        GLY   9 -12.238  -4.552  -2.021
   65   1HA   GLY   9          1HA       GLY   9 -13.060  -4.997  -4.562
   66   2HA   GLY   9          2HA       GLY   9 -14.193  -3.747  -4.061
   67    H    ILE  10           H        ILE  10 -13.572  -1.708  -4.472
   68    HA   ILE  10           HA       ILE  10 -11.060  -1.022  -5.628
   69    HB   ILE  10           HB       ILE  10 -13.331   0.009  -5.922
   70   1HG1  ILE  10          1HG1      ILE  10 -11.127   0.974  -6.722
   71   2HG1  ILE  10          2HG1      ILE  10 -12.471   2.094  -6.570
   72   1HG2  ILE  10          1HG2      ILE  10 -13.972   0.334  -3.597
   73   2HG2  ILE  10          2HG2      ILE  10 -12.659   1.494  -3.379
   74   3HG2  ILE  10          3HG2      ILE  10 -13.991   1.863  -4.472
   75   1HD1  ILE  10          1HD1      ILE  10 -11.284   2.293  -4.086
   76   2HD1  ILE  10          2HD1      ILE  10  -9.897   2.040  -5.145
   77   3HD1  ILE  10          3HD1      ILE  10 -10.993   3.389  -5.433
   78    H    SER  11           H        SER  11 -12.219  -0.543  -2.252
   79    HA   SER  11           HA       SER  11  -9.979   0.990  -1.357
   80   1HB   SER  11          1HB       SER  11 -11.981  -0.828  -0.009
   81   2HB   SER  11          2HB       SER  11 -10.694  -0.051   0.905
   82    HG   SER  11           HG       SER  11 -12.781   1.133   0.649
   83    H    ARG  12           H        ARG  12 -10.475  -2.540  -1.531
   84    HA   ARG  12           HA       ARG  12  -8.038  -3.338  -0.233
   85   1HB   ARG  12          1HB       ARG  12  -9.723  -4.682  -2.377
   86   2HB   ARG  12          2HB       ARG  12  -8.481  -5.493  -1.436
   87   1HG   ARG  12          1HG       ARG  12 -10.932  -4.159  -0.246
   88   2HG   ARG  12          2HG       ARG  12 -10.795  -5.880  -0.583
   89   1HD   ARG  12          1HD       ARG  12  -8.542  -5.522   0.897
   90   2HD   ARG  12          2HD       ARG  12  -9.597  -4.286   1.613
   91    HE   ARG  12           HE       ARG  12 -10.574  -7.095   1.270
   92   1HH1  ARG  12          1HH2      ARG  12  -8.921  -6.075   3.745
   93   2HH1  ARG  12          2HH2      ARG  12 -10.206  -5.870   4.882
   94   1HH2  ARG  12          1HH1      ARG  12 -12.721  -6.058   2.484
   95   2HH2  ARG  12          2HH1      ARG  12 -12.361  -5.872   4.166
   96    H    PHE  13           H        PHE  13  -8.780  -2.234  -3.490
   97    HA   PHE  13           HA       PHE  13  -6.152  -2.953  -4.601
   98   1HB   PHE  13          1HB       PHE  13  -7.719  -3.213  -6.248
   99   2HB   PHE  13          2HB       PHE  13  -8.843  -2.102  -5.493
  100    HD1  PHE  13           HD1      PHE  13  -5.797  -2.315  -7.633
  101    HD2  PHE  13           HD2      PHE  13  -9.034   0.145  -6.240
  102    HE1  PHE  13           HE1      PHE  13  -5.224  -0.594  -9.328
  103    HE2  PHE  13           HE2      PHE  13  -8.461   1.860  -7.936
  104    HZ   PHE  13           HZ       PHE  13  -6.556   1.490  -9.478
  105    H    ARG  14           H        ARG  14  -7.886  -0.116  -3.382
  106    HA   ARG  14           HA       ARG  14  -6.159   1.984  -4.233
  107   1HB   ARG  14          1HB       ARG  14  -8.503   1.869  -2.982
  108   2HB   ARG  14          2HB       ARG  14  -7.498   1.961  -1.539
  109   1HG   ARG  14          1HG       ARG  14  -6.374   3.975  -2.838
  110   2HG   ARG  14          2HG       ARG  14  -7.913   3.992  -3.700
  111   1HD   ARG  14          1HD       ARG  14  -8.848   5.101  -1.974
  112   2HD   ARG  14          2HD       ARG  14  -8.533   3.707  -0.928
  113    HE   ARG  14           HE       ARG  14  -6.067   5.035  -1.133
  114   1HH1  ARG  14          1HH2      ARG  14  -7.357   4.652   1.487
  115   2HH1  ARG  14          2HH2      ARG  14  -7.716   6.266   1.993
  116   1HH2  ARG  14          1HH1      ARG  14  -7.356   7.607  -1.214
  117   2HH2  ARG  14          2HH1      ARG  14  -7.715   7.967   0.438
  118    H    ARG  15           H        ARG  15  -6.162   0.065  -1.198
  119    HA   ARG  15           HA       ARG  15  -3.789   1.222  -0.085
  120   1HB   ARG  15          1HB       ARG  15  -3.812  -0.792   1.378
  121   2HB   ARG  15          2HB       ARG  15  -5.386  -0.027   1.265
  122   1HG   ARG  15          1HG       ARG  15  -6.002  -2.229   0.965
  123   2HG   ARG  15          2HG       ARG  15  -5.714  -1.784  -0.711
  124   1HD   ARG  15          1HD       ARG  15  -3.773  -3.030  -0.857
  125   2HD   ARG  15          2HD       ARG  15  -3.374  -2.814   0.860
  126    HE   ARG  15           HE       ARG  15  -5.527  -4.642  -0.133
  127   1HH1  ARG  15          1HH1      ARG  15  -5.483  -3.567   2.770
  128   2HH1  ARG  15          2HH1      ARG  15  -4.733  -4.890   3.592
  129   1HH2  ARG  15          1HH2      ARG  15  -3.558  -6.374   0.661
  130   2HH2  ARG  15          2HH2      ARG  15  -3.630  -6.492   2.381
  131    H    LYS  16           H        LYS  16  -4.260  -1.393  -2.430
  132    HA   LYS  16           HA       LYS  16  -1.603  -2.490  -2.355
  133   1HB   LYS  16          1HB       LYS  16  -3.914  -2.477  -4.285
  134   2HB   LYS  16          2HB       LYS  16  -2.350  -3.053  -4.846
  135   1HG   LYS  16          1HG       LYS  16  -2.354  -4.544  -2.733
  136   2HG   LYS  16          2HG       LYS  16  -4.076  -4.181  -2.646
  137   1HD   LYS  16          1HD       LYS  16  -2.784  -5.244  -5.164
  138   2HD   LYS  16          2HD       LYS  16  -3.422  -6.308  -3.916
  139   1HE   LYS  16          1HE       LYS  16  -5.653  -5.228  -4.142
  140   2HE   LYS  16          2HE       LYS  16  -5.009  -4.211  -5.442
  141   1HZ   LYS  16          1HZ       LYS  16  -4.350  -6.268  -6.625
  142   2HZ   LYS  16          2HZ       LYS  16  -5.126  -7.182  -5.421
  143   3HZ   LYS  16          3HZ       LYS  16  -6.025  -6.137  -6.408
  144    H    ILE  17           H        ILE  17  -3.091   0.182  -4.183
  145    HA   ILE  17           HA       ILE  17  -0.899   0.787  -5.926
  146    HB   ILE  17           HB       ILE  17  -3.042   2.552  -4.665
  147   1HG1  ILE  17          1HG1      ILE  17  -3.087   1.605  -7.513
  148   2HG1  ILE  17          2HG1      ILE  17  -3.589   0.484  -6.246
  149   1HG2  ILE  17          1HG2      ILE  17  -1.138   3.867  -5.584
  150   2HG2  ILE  17          2HG2      ILE  17  -1.365   3.069  -7.141
  151   3HG2  ILE  17          3HG2      ILE  17  -2.627   4.117  -6.493
  152   1HD1  ILE  17          1HD1      ILE  17  -4.921   2.731  -5.476
  153   2HD1  ILE  17          2HD1      ILE  17  -4.923   2.934  -7.228
  154   3HD1  ILE  17          3HD1      ILE  17  -5.616   1.481  -6.507
  155    H    ALA  18           H        ALA  18  -1.816   2.063  -2.703
  156    HA   ALA  18           HA       ALA  18   0.507   3.729  -2.341
  157   1HB   ALA  18          1HB       ALA  18  -1.628   2.528  -0.588
  158   2HB   ALA  18          2HB       ALA  18  -0.254   3.344   0.156
  159   3HB   ALA  18          3HB       ALA  18  -1.311   4.226  -0.946
  160    H    LYS  19           H        LYS  19  -0.202   0.333  -1.470
  161    HA   LYS  19           HA       LYS  19   2.089  -0.272   0.086
  162   1HB   LYS  19          1HB       LYS  19   0.044  -1.704  -1.473
  163   2HB   LYS  19          2HB       LYS  19   1.576  -2.564  -1.384
  164   1HG   LYS  19          1HG       LYS  19   0.885  -1.452   1.207
  165   2HG   LYS  19          2HG       LYS  19  -0.417  -2.469   0.596
  166   1HD   LYS  19          1HD       LYS  19   0.873  -4.380   0.590
  167   2HD   LYS  19          2HD       LYS  19   2.378  -3.496   0.338
  168   1HE   LYS  19          1HE       LYS  19   1.557  -2.568   2.819
  169   2HE   LYS  19          2HE       LYS  19   1.084  -4.278   2.859
  170   1HZ   LYS  19          1HZ       LYS  19   3.317  -4.844   2.018
  171   2HZ   LYS  19          2HZ       LYS  19   3.764  -3.208   2.146
  172   3HZ   LYS  19          3HZ       LYS  19   3.368  -4.086   3.536
  173    H    ARG  20           H        ARG  20   1.662  -0.168  -3.442
  174    HA   ARG  20           HA       ARG  20   4.266  -1.221  -4.151
  175   1HB   ARG  20          1HB       ARG  20   2.092  -1.053  -5.530
  176   2HB   ARG  20          2HB       ARG  20   2.512   0.640  -5.776
  177   1HG   ARG  20          1HG       ARG  20   4.768  -1.149  -6.299
  178   2HG   ARG  20          2HG       ARG  20   3.380  -1.497  -7.329
  179   1HD   ARG  20          1HD       ARG  20   3.286   0.888  -8.005
  180   2HD   ARG  20          2HD       ARG  20   4.710   1.216  -6.999
  181    HE   ARG  20           HE       ARG  20   5.276  -0.986  -8.760
  182   1HH1  ARG  20          1HH1      ARG  20   7.206   1.236  -8.347
  183   2HH1  ARG  20          2HH1      ARG  20   7.169   2.059  -9.865
  184   1HH2  ARG  20          1HH2      ARG  20   4.175   0.585 -10.885
  185   2HH2  ARG  20          2HH2      ARG  20   5.435   1.686 -11.318
  186    H    SER  21           H        SER  21   2.933   2.079  -3.686
  187    HA   SER  21           HA       SER  21   5.229   3.561  -4.542
  188   1HB   SER  21          1HB       SER  21   3.066   4.163  -2.495
  189   2HB   SER  21          2HB       SER  21   4.199   5.353  -3.125
  190    HG   SER  21           HG       SER  21   2.433   5.481  -4.429
  191    H    ILE  22           H        ILE  22   4.222   2.465  -1.284
  192    HA   ILE  22           HA       ILE  22   6.562   3.423   0.107
  193    HB   ILE  22           HB       ILE  22   4.658   1.156   0.789
  194   1HG1  ILE  22          1HG1      ILE  22   4.398   3.773   2.155
  195   2HG1  ILE  22          2HG1      ILE  22   3.957   3.788   0.448
  196   1HG2  ILE  22          1HG2      ILE  22   6.863   2.507   2.264
  197   2HG2  ILE  22          2HG2      ILE  22   5.399   2.150   3.178
  198   3HG2  ILE  22          3HG2      ILE  22   6.280   0.849   2.378
  199   1HD1  ILE  22          1HD1      ILE  22   2.565   1.693   0.953
  200   2HD1  ILE  22          2HD1      ILE  22   2.789   2.093   2.655
  201   3HD1  ILE  22          3HD1      ILE  22   1.957   3.222   1.585
  202    H    LYS  23           H        LYS  23   5.687   0.233  -1.272
  203    HA   LYS  23           HA       LYS  23   7.911  -1.302  -0.490
  204   1HB   LYS  23          1HB       LYS  23   5.805  -1.991  -1.733
  205   2HB   LYS  23          2HB       LYS  23   6.573  -1.393  -3.203
  206   1HG   LYS  23          1HG       LYS  23   8.498  -3.039  -1.961
  207   2HG   LYS  23          2HG       LYS  23   6.968  -3.909  -1.825
  208   1HD   LYS  23          1HD       LYS  23   6.775  -3.048  -4.384
  209   2HD   LYS  23          2HD       LYS  23   8.527  -3.195  -4.247
  210   1HE   LYS  23          1HE       LYS  23   8.445  -5.499  -3.876
  211   2HE   LYS  23          2HE       LYS  23   6.782  -5.446  -3.265
  212   1HZ   LYS  23          1HZ       LYS  23   7.446  -4.682  -6.049
  213   2HZ   LYS  23          2HZ       LYS  23   7.082  -6.286  -5.618
  214   3HZ   LYS  23          3HZ       LYS  23   5.927  -5.059  -5.397
  215    H    THR  24           H        THR  24   7.641   0.925  -3.292
  216    HA   THR  24           HA       THR  24  10.247   0.386  -4.407
  217    HB   THR  24           HB       THR  24   8.486   2.869  -4.501
  218    HG1  THR  24           HG1      THR  24   7.334   1.284  -5.414
  219   1HG2  THR  24          1HG2      THR  24  11.036   2.161  -5.827
  220   2HG2  THR  24          2HG2      THR  24   9.789   2.834  -6.876
  221   3HG2  THR  24          3HG2      THR  24  10.346   3.744  -5.471
  222    H    LEU  25           H        LEU  25   9.025   2.800  -2.084
  223    HA   LEU  25           HA       LEU  25  11.457   4.235  -1.631
  224   1HB   LEU  25          1HB       LEU  25   8.813   4.364  -0.826
  225   2HB   LEU  25          2HB       LEU  25   9.616   3.882   0.658
  226    HG   LEU  25           HG       LEU  25   9.402   6.332   0.432
  227   1HD1  LEU  25          1HD1      LEU  25  12.168   5.132   0.472
  228   2HD1  LEU  25          2HD1      LEU  25  11.899   6.854   0.730
  229   3HD1  LEU  25          3HD1      LEU  25  11.185   5.678   1.830
  230   1HD2  LEU  25          1HD2      LEU  25   9.725   6.206  -2.137
  231   2HD2  LEU  25          2HD2      LEU  25  10.447   7.570  -1.286
  232   3HD2  LEU  25          3HD2      LEU  25  11.452   6.210  -1.781
  233    H    GLU  26           H        GLU  26   9.993   1.447   0.058
  234    HA   GLU  26           HA       GLU  26  12.056   1.062   1.996
  235   1HB   GLU  26          1HB       GLU  26   9.714  -0.399   0.947
  236   2HB   GLU  26          2HB       GLU  26  10.983  -1.435   1.604
  237   1HG   GLU  26          1HG       GLU  26   9.876   0.962   3.086
  238   2HG   GLU  26          2HG       GLU  26   9.264  -0.677   3.298
  239    H    HIS  27           H        HIS  27  11.777  -0.100  -1.375
  240    HA   HIS  27           HA       HIS  27  13.851  -2.055  -1.337
  241   1HB   HIS  27          1HB       HIS  27  12.521  -0.317  -3.367
  242   2HB   HIS  27          2HB       HIS  27  14.076  -1.003  -3.828
  243    HD1  HIS  27           HD1      HIS  27  10.683  -2.114  -2.527
  244    HD2  HIS  27           HD2      HIS  27  13.970  -3.684  -4.553
  245    HE1  HIS  27           HE1      HIS  27  10.041  -4.467  -3.226
  246    H    LYS  28           H        LYS  28  13.971   1.474  -1.768
  247    HA   LYS  28           HA       LYS  28  16.829   1.666  -2.207
  248   1HB   LYS  28          1HB       LYS  28  14.508   3.399  -1.989
  249   2HB   LYS  28          2HB       LYS  28  15.836   4.055  -1.038
  250   1HG   LYS  28          1HG       LYS  28  16.863   4.760  -2.896
  251   2HG   LYS  28          2HG       LYS  28  16.903   3.119  -3.532
  252   1HD   LYS  28          1HD       LYS  28  14.342   4.673  -3.682
  253   2HD   LYS  28          2HD       LYS  28  15.625   5.020  -4.840
  254   1HE   LYS  28          1HE       LYS  28  15.680   2.416  -5.178
  255   2HE   LYS  28          2HE       LYS  28  14.051   2.475  -4.477
  256   1HZ   LYS  28          1HZ       LYS  28  13.496   4.233  -6.094
  257   2HZ   LYS  28          2HZ       LYS  28  15.014   4.033  -6.826
  258   3HZ   LYS  28          3HZ       LYS  28  13.886   2.762  -6.843
  259    H    ARG  29           H        ARG  29  14.710   1.861   0.652
  260    HA   ARG  29           HA       ARG  29  16.748   2.543   2.578
  261   1HB   ARG  29          1HB       ARG  29  14.308   2.911   2.825
  262   2HB   ARG  29          2HB       ARG  29  14.066   1.169   2.903
  263   1HG   ARG  29          1HG       ARG  29  14.678   1.074   5.069
  264   2HG   ARG  29          2HG       ARG  29  16.106   2.071   4.792
  265   1HD   ARG  29          1HD       ARG  29  14.309   4.023   4.606
  266   2HD   ARG  29          2HD       ARG  29  13.337   2.908   5.586
  267    HE   ARG  29           HE       ARG  29  16.127   3.438   6.467
  268   1HH1  ARG  29          1HH1      ARG  29  13.850   2.070   8.031
  269   2HH1  ARG  29          2HH1      ARG  29  13.447   3.310   9.165
  270   1HH2  ARG  29          1HH2      ARG  29  15.142   5.810   7.408
  271   2HH2  ARG  29          2HH2      ARG  29  14.191   5.460   8.808
  272    H    GLU  30           H        GLU  30  15.551  -0.549   1.304
  273    HA   GLU  30           HA       GLU  30  16.669  -2.301   3.285
  274   1HB   GLU  30          1HB       GLU  30  14.883  -2.914   1.725
  275   2HB   GLU  30          2HB       GLU  30  15.974  -2.700   0.362
  276   1HG   GLU  30          1HG       GLU  30  16.011  -5.018   0.695
  277   2HG   GLU  30          2HG       GLU  30  17.451  -4.490   1.555
  278    H    ASN  31           H        ASN  31  17.930  -1.235   0.090
  279    HA   ASN  31           HA       ASN  31  20.477  -2.640   0.543
  280   1HB   ASN  31          1HB       ASN  31  19.019  -1.388  -1.660
  281   2HB   ASN  31          2HB       ASN  31  20.730  -0.970  -1.680
  282   1HD2  ASN  31          2HD2      ASN  31  18.505  -3.804  -1.625
  283   2HD2  ASN  31          1HD2      ASN  31  19.643  -4.877  -2.282
  284    H    ALA  32           H        ALA  32  19.694   0.795  -0.162
  285    HA   ALA  32           HA       ALA  32  20.810   2.764   0.361
  286   1HB   ALA  32          1HB       ALA  32  19.558   2.123   2.383
  287   2HB   ALA  32          2HB       ALA  32  20.967   1.253   2.985
  288   3HB   ALA  32          3HB       ALA  32  21.025   3.006   2.800
  289    H    LYS  33           H        LYS  33  23.040   1.877   2.776
  290    HA   LYS  33           HA       LYS  33  25.208   1.138   0.903
  291   1HB   LYS  33          1HB       LYS  33  24.728   3.733   1.119
  292   2HB   LYS  33          2HB       LYS  33  25.605   3.554   2.638
  293   1HG   LYS  33          1HG       LYS  33  27.241   2.171   0.945
  294   2HG   LYS  33          2HG       LYS  33  26.600   3.397  -0.145
  295   1HD   LYS  33          1HD       LYS  33  28.428   4.518   0.738
  296   2HD   LYS  33          2HD       LYS  33  27.157   5.037   1.843
  297   1HE   LYS  33          1HE       LYS  33  27.837   2.975   3.277
  298   2HE   LYS  33          2HE       LYS  33  29.324   2.982   2.311
  299   1HZ   LYS  33          1HZ       LYS  33  29.627   5.332   2.861
  300   2HZ   LYS  33          2HZ       LYS  33  28.232   5.293   3.835
  301   3HZ   LYS  33          3HZ       LYS  33  29.595   4.375   4.257
  302    H    GLU  34           H        GLU  34  26.181  -0.518   1.979
  303    HA   GLU  34           HA       GLU  34  26.912  -0.207   4.849
  304   1HB   GLU  34          1HB       GLU  34  24.662  -1.342   4.516
  305   2HB   GLU  34          2HB       GLU  34  25.534  -2.652   3.723
  306   1HG   GLU  34          1HG       GLU  34  26.843  -2.034   6.211
  307   2HG   GLU  34          2HG       GLU  34  25.123  -2.283   6.508
  Start of MODEL    7
    1   1H    CYS   1          1H        CYS   1 -16.527  -1.284   6.790
    2   2H    CYS   1          2H        CYS   1 -15.703   0.017   7.508
    3   3H    CYS   1          3H        CYS   1 -16.732   0.291   6.193
    4    HA   CYS   1           HA       CYS   1 -14.419   0.366   5.473
    5   1HB   CYS   1          1HB       CYS   1 -14.243  -1.655   7.414
    6   2HB   CYS   1          2HB       CYS   1 -13.898  -2.467   5.890
    7    HG   CYS   1           HG       CYS   1 -11.814  -1.094   5.593
    8    H    ALA   2           H        ALA   2 -13.525  -1.465   3.691
    9    HA   ALA   2           HA       ALA   2 -15.931  -2.139   2.032
   10   1HB   ALA   2          1HB       ALA   2 -14.471  -0.292   1.236
   11   2HB   ALA   2          2HB       ALA   2 -13.105  -1.407   1.202
   12   3HB   ALA   2          3HB       ALA   2 -14.474  -1.658   0.120
   13    H    VAL   3           H        VAL   3 -15.035  -3.996   3.943
   14    HA   VAL   3           HA       VAL   3 -13.908  -6.161   2.219
   15    HB   VAL   3           HB       VAL   3 -12.219  -5.451   3.818
   16   1HG1  VAL   3          1HG1      VAL   3 -13.720  -4.439   5.534
   17   2HG1  VAL   3          2HG1      VAL   3 -14.173  -6.064   6.050
   18   3HG1  VAL   3          3HG1      VAL   3 -12.507  -5.516   6.222
   19   1HG2  VAL   3          1HG2      VAL   3 -12.451  -7.867   3.338
   20   2HG2  VAL   3          2HG2      VAL   3 -11.795  -7.563   4.947
   21   3HG2  VAL   3          3HG2      VAL   3 -13.484  -8.032   4.758
   22    H    GLU   4           H        GLU   4 -15.911  -5.424   5.049
   23    HA   GLU   4           HA       GLU   4 -17.242  -7.949   5.302
   24   1HB   GLU   4          1HB       GLU   4 -18.737  -6.647   6.757
   25   2HB   GLU   4          2HB       GLU   4 -17.064  -6.196   7.051
   26   1HG   GLU   4          1HG       GLU   4 -18.400  -4.566   4.981
   27   2HG   GLU   4          2HG       GLU   4 -19.125  -4.433   6.575
   28    H    LEU   5           H        LEU   5 -19.746  -8.018   4.973
   29    HA   LEU   5           HA       LEU   5 -21.421  -8.354   3.410
   30   1HB   LEU   5          1HB       LEU   5 -22.605  -6.364   3.054
   31   2HB   LEU   5          2HB       LEU   5 -21.684  -6.096   4.519
   32    HG   LEU   5           HG       LEU   5 -20.086  -5.211   2.312
   33   1HD1  LEU   5          1HD1      LEU   5 -22.972  -4.368   2.202
   34   2HD1  LEU   5          2HD1      LEU   5 -21.679  -3.318   1.620
   35   3HD1  LEU   5          3HD1      LEU   5 -21.923  -4.901   0.886
   36   1HD2  LEU   5          1HD2      LEU   5 -20.431  -4.431   4.826
   37   2HD2  LEU   5          2HD2      LEU   5 -19.896  -3.290   3.594
   38   3HD2  LEU   5          3HD2      LEU   5 -21.588  -3.324   4.088
   39    H    ARG   6           H        ARG   6 -18.742  -8.699   2.171
   40    HA   ARG   6           HA       ARG   6 -17.697  -8.897   0.121
   41   1HB   ARG   6          1HB       ARG   6 -19.605 -10.491   0.157
   42   2HB   ARG   6          2HB       ARG   6 -20.597  -9.279  -0.644
   43   1HG   ARG   6          1HG       ARG   6 -18.897  -9.268  -2.526
   44   2HG   ARG   6          2HG       ARG   6 -18.122 -10.643  -1.745
   45   1HD   ARG   6          1HD       ARG   6 -20.967 -11.136  -1.966
   46   2HD   ARG   6          2HD       ARG   6 -20.294 -10.728  -3.556
   47    HE   ARG   6           HE       ARG   6 -19.211 -12.904  -1.807
   48   1HH1  ARG   6          1HH2      ARG   6 -20.893 -13.446  -4.286
   49   2HH1  ARG   6          2HH2      ARG   6 -19.673 -13.810  -5.457
   50   1HH2  ARG   6          1HH1      ARG   6 -17.084 -12.461  -3.539
   51   2HH2  ARG   6          2HH1      ARG   6 -17.485 -13.244  -5.026
   52    H    SER   7           H        SER   7 -17.545  -6.334   0.564
   53    HA   SER   7           HA       SER   7 -18.424  -4.994  -1.966
   54   1HB   SER   7          1HB       SER   7 -19.258  -4.514   0.722
   55   2HB   SER   7          2HB       SER   7 -18.260  -3.153   0.238
   56    HG   SER   7           HG       SER   7 -20.179  -2.624  -0.595
   57    HA   PRO   8           HA       PRO   8 -13.826  -4.694  -1.205
   58   1HB   PRO   8          1HB       PRO   8 -13.085  -5.444  -3.735
   59   2HB   PRO   8          2HB       PRO   8 -13.343  -6.591  -2.403
   60   1HG   PRO   8          1HG       PRO   8 -15.135  -5.866  -4.658
   61   2HG   PRO   8          2HG       PRO   8 -14.830  -7.446  -3.913
   62   1HD   PRO   8          1HD       PRO   8 -17.036  -5.987  -3.385
   63   2HD   PRO   8          2HD       PRO   8 -16.297  -7.090  -2.202
   64    H    GLY   9           H        GLY   9 -15.516  -3.751  -4.231
   65   1HA   GLY   9          1HA       GLY   9 -15.463  -1.817  -5.506
   66   2HA   GLY   9          2HA       GLY   9 -15.306  -0.982  -3.968
   67    H    ILE  10           H        ILE  10 -13.734   0.490  -4.241
   68    HA   ILE  10           HA       ILE  10 -11.308  -0.091  -5.826
   69    HB   ILE  10           HB       ILE  10 -12.913   1.889  -6.004
   70   1HG1  ILE  10          1HG1      ILE  10 -10.614   1.671  -7.035
   71   2HG1  ILE  10          2HG1      ILE  10 -11.226   3.302  -6.805
   72   1HG2  ILE  10          1HG2      ILE  10 -13.001   2.414  -3.577
   73   2HG2  ILE  10          2HG2      ILE  10 -11.327   2.957  -3.670
   74   3HG2  ILE  10          3HG2      ILE  10 -12.576   3.795  -4.588
   75   1HD1  ILE  10          1HD1      ILE  10  -9.889   3.234  -4.560
   76   2HD1  ILE  10          2HD1      ILE  10  -9.041   1.878  -5.297
   77   3HD1  ILE  10          3HD1      ILE  10  -9.000   3.463  -6.063
   78    H    SER  11           H        SER  11 -12.255   0.480  -2.457
   79    HA   SER  11           HA       SER  11  -9.859   1.170  -1.201
   80   1HB   SER  11          1HB       SER  11 -12.215  -0.533  -0.461
   81   2HB   SER  11          2HB       SER  11 -10.891  -0.329   0.678
   82    HG   SER  11           HG       SER  11 -12.091   1.406   1.119
   83    H    ARG  12           H        ARG  12 -10.937  -2.130  -2.026
   84    HA   ARG  12           HA       ARG  12  -8.760  -3.591  -0.920
   85   1HB   ARG  12          1HB       ARG  12  -9.526  -5.364  -2.479
   86   2HB   ARG  12          2HB       ARG  12 -10.862  -4.597  -1.635
   87   1HG   ARG  12          1HG       ARG  12 -11.788  -4.348  -3.683
   88   2HG   ARG  12          2HG       ARG  12 -10.645  -3.036  -3.906
   89   1HD   ARG  12          1HD       ARG  12  -8.994  -4.889  -4.702
   90   2HD   ARG  12          2HD       ARG  12 -10.458  -5.874  -4.908
   91    HE   ARG  12           HE       ARG  12 -10.123  -3.196  -6.206
   92   1HH1  ARG  12          1HH2      ARG  12  -9.634  -5.986  -7.530
   93   2HH1  ARG  12          2HH2      ARG  12 -11.089  -6.138  -8.450
   94   1HH2  ARG  12          1HH1      ARG  12 -12.710  -3.544  -6.746
   95   2HH2  ARG  12          2HH1      ARG  12 -12.867  -4.728  -7.999
   96    H    PHE  13           H        PHE  13  -9.056  -1.874  -3.985
   97    HA   PHE  13           HA       PHE  13  -6.471  -2.859  -5.014
   98   1HB   PHE  13          1HB       PHE  13  -8.015  -2.711  -6.722
   99   2HB   PHE  13          2HB       PHE  13  -8.910  -1.424  -5.946
  100    HD1  PHE  13           HD1      PHE  13  -5.639  -2.067  -7.699
  101    HD2  PHE  13           HD2      PHE  13  -8.777   0.715  -6.784
  102    HE1  PHE  13           HE1      PHE  13  -4.621  -0.412  -9.240
  103    HE2  PHE  13           HE2      PHE  13  -7.762   2.374  -8.323
  104    HZ   PHE  13           HZ       PHE  13  -5.685   1.809  -9.551
  105    H    ARG  14           H        ARG  14  -7.939   0.030  -3.592
  106    HA   ARG  14           HA       ARG  14  -5.943   1.995  -3.972
  107   1HB   ARG  14          1HB       ARG  14  -8.306   2.153  -3.037
  108   2HB   ARG  14          2HB       ARG  14  -7.656   1.553  -1.514
  109   1HG   ARG  14          1HG       ARG  14  -5.968   3.506  -1.693
  110   2HG   ARG  14          2HG       ARG  14  -7.064   4.158  -2.911
  111   1HD   ARG  14          1HD       ARG  14  -8.475   4.905  -1.318
  112   2HD   ARG  14          2HD       ARG  14  -8.579   3.292  -0.588
  113    HE   ARG  14           HE       ARG  14  -6.402   5.253   0.027
  114   1HH1  ARG  14          1HH2      ARG  14  -8.841   4.498   1.821
  115   2HH1  ARG  14          2HH2      ARG  14  -8.060   3.483   2.982
  116   1HH2  ARG  14          1HH1      ARG  14  -5.164   3.112   1.060
  117   2HH2  ARG  14          2HH1      ARG  14  -5.941   2.688   2.544
  118    H    ARG  15           H        ARG  15  -6.309  -0.389  -1.303
  119    HA   ARG  15           HA       ARG  15  -3.972   0.403   0.165
  120   1HB   ARG  15          1HB       ARG  15  -6.005  -1.131   0.793
  121   2HB   ARG  15          2HB       ARG  15  -5.025  -2.418   0.093
  122   1HG   ARG  15          1HG       ARG  15  -4.461  -2.440   2.390
  123   2HG   ARG  15          2HG       ARG  15  -3.129  -1.594   1.612
  124   1HD   ARG  15          1HD       ARG  15  -4.492   0.573   2.160
  125   2HD   ARG  15          2HD       ARG  15  -5.333  -0.459   3.331
  126    HE   ARG  15           HE       ARG  15  -2.353  -0.122   3.321
  127   1HH1  ARG  15          1HH2      ARG  15  -3.831   1.587   5.239
  128   2HH1  ARG  15          2HH2      ARG  15  -3.857   0.624   6.676
  129   1HH2  ARG  15          1HH1      ARG  15  -3.056  -2.337   5.010
  130   2HH2  ARG  15          2HH1      ARG  15  -3.418  -1.625   6.542
  131    H    LYS  16           H        LYS  16  -4.408  -1.899  -2.537
  132    HA   LYS  16           HA       LYS  16  -1.773  -3.054  -2.423
  133   1HB   LYS  16          1HB       LYS  16  -4.057  -3.467  -3.902
  134   2HB   LYS  16          2HB       LYS  16  -3.015  -2.697  -5.094
  135   1HG   LYS  16          1HG       LYS  16  -2.303  -5.142  -3.447
  136   2HG   LYS  16          2HG       LYS  16  -2.778  -5.152  -5.142
  137   1HD   LYS  16          1HD       LYS  16  -0.697  -3.301  -5.061
  138   2HD   LYS  16          2HD       LYS  16  -0.182  -4.548  -3.935
  139   1HE   LYS  16          1HE       LYS  16   0.584  -5.609  -5.803
  140   2HE   LYS  16          2HE       LYS  16  -1.111  -6.060  -6.052
  141   1HZ   LYS  16          1HZ       LYS  16  -0.038  -3.457  -6.988
  142   2HZ   LYS  16          2HZ       LYS  16   0.025  -4.853  -7.955
  143   3HZ   LYS  16          3HZ       LYS  16  -1.471  -4.239  -7.458
  144    H    ILE  17           H        ILE  17  -3.073  -0.161  -4.041
  145    HA   ILE  17           HA       ILE  17  -0.737   0.591  -5.520
  146    HB   ILE  17           HB       ILE  17  -2.939   2.261  -4.237
  147   1HG1  ILE  17          1HG1      ILE  17  -2.833   1.640  -7.164
  148   2HG1  ILE  17          2HG1      ILE  17  -3.380   0.365  -6.076
  149   1HG2  ILE  17          1HG2      ILE  17  -0.996   3.643  -4.883
  150   2HG2  ILE  17          2HG2      ILE  17  -1.065   2.976  -6.513
  151   3HG2  ILE  17          3HG2      ILE  17  -2.390   3.971  -5.910
  152   1HD1  ILE  17          1HD1      ILE  17  -4.675   2.739  -5.232
  153   2HD1  ILE  17          2HD1      ILE  17  -4.819   2.685  -6.988
  154   3HD1  ILE  17          3HD1      ILE  17  -5.400   1.336  -6.015
  155    H    ALA  18           H        ALA  18  -1.834   1.327  -2.196
  156    HA   ALA  18           HA       ALA  18   0.378   3.012  -1.451
  157   1HB   ALA  18          1HB       ALA  18  -1.795   1.472  -0.066
  158   2HB   ALA  18          2HB       ALA  18  -0.443   2.045   0.912
  159   3HB   ALA  18          3HB       ALA  18  -1.423   3.195   0.004
  160    H    LYS  19           H        LYS  19  -0.150  -0.514  -1.247
  161    HA   LYS  19           HA       LYS  19   2.174  -1.247   0.236
  162   1HB   LYS  19          1HB       LYS  19   0.149  -2.483  -1.485
  163   2HB   LYS  19          2HB       LYS  19   1.721  -3.257  -1.656
  164   1HG   LYS  19          1HG       LYS  19   0.700  -2.651   1.097
  165   2HG   LYS  19          2HG       LYS  19   0.046  -4.035   0.229
  166   1HD   LYS  19          1HD       LYS  19   1.851  -5.216   0.859
  167   2HD   LYS  19          2HD       LYS  19   2.836  -4.173  -0.160
  168   1HE   LYS  19          1HE       LYS  19   3.862  -3.901   1.930
  169   2HE   LYS  19          2HE       LYS  19   2.739  -2.531   1.910
  170   1HZ   LYS  19          1HZ       LYS  19   1.103  -4.347   2.866
  171   2HZ   LYS  19          2HZ       LYS  19   2.556  -5.056   3.383
  172   3HZ   LYS  19          3HZ       LYS  19   2.152  -3.485   3.879
  173    H    ARG  20           H        ARG  20   1.695  -0.516  -3.194
  174    HA   ARG  20           HA       ARG  20   4.316  -1.339  -4.123
  175   1HB   ARG  20          1HB       ARG  20   2.199  -1.190  -5.458
  176   2HB   ARG  20          2HB       ARG  20   2.292   0.565  -5.331
  177   1HG   ARG  20          1HG       ARG  20   4.529   0.490  -6.435
  178   2HG   ARG  20          2HG       ARG  20   4.335  -1.249  -6.651
  179   1HD   ARG  20          1HD       ARG  20   2.905  -0.991  -8.399
  180   2HD   ARG  20          2HD       ARG  20   2.025   0.327  -7.603
  181    HE   ARG  20           HE       ARG  20   4.478   0.640  -9.244
  182   1HH1  ARG  20          1HH2      ARG  20   1.779   2.080  -9.600
  183   2HH1  ARG  20          2HH2      ARG  20   2.176   3.664  -9.033
  184   1HH2  ARG  20          1HH1      ARG  20   5.129   2.637  -7.473
  185   2HH2  ARG  20          2HH1      ARG  20   4.098   3.983  -7.814
  186    H    SER  21           H        SER  21   2.890   1.851  -3.197
  187    HA   SER  21           HA       SER  21   5.180   3.421  -3.933
  188   1HB   SER  21          1HB       SER  21   2.629   3.884  -2.902
  189   2HB   SER  21          2HB       SER  21   3.705   4.423  -1.616
  190    HG   SER  21           HG       SER  21   4.404   5.997  -2.890
  191    H    ILE  22           H        ILE  22   4.310   1.829  -0.860
  192    HA   ILE  22           HA       ILE  22   6.490   2.817   0.728
  193    HB   ILE  22           HB       ILE  22   4.882   0.238   0.828
  194   1HG1  ILE  22          1HG1      ILE  22   4.580   2.583   2.695
  195   2HG1  ILE  22          2HG1      ILE  22   3.782   2.604   1.121
  196   1HG2  ILE  22          1HG2      ILE  22   6.986   1.351   2.646
  197   2HG2  ILE  22          2HG2      ILE  22   5.610   0.519   3.371
  198   3HG2  ILE  22          3HG2      ILE  22   6.643  -0.324   2.219
  199   1HD1  ILE  22          1HD1      ILE  22   2.872   0.281   1.734
  200   2HD1  ILE  22          2HD1      ILE  22   3.390   0.639   3.382
  201   3HD1  ILE  22          3HD1      ILE  22   2.184   1.657   2.595
  202    H    LYS  23           H        LYS  23   6.136  -0.137  -1.255
  203    HA   LYS  23           HA       LYS  23   8.701  -1.283  -0.755
  204   1HB   LYS  23          1HB       LYS  23   6.616  -1.472  -2.911
  205   2HB   LYS  23          2HB       LYS  23   8.166  -2.279  -3.139
  206   1HG   LYS  23          1HG       LYS  23   6.954  -2.711  -0.480
  207   2HG   LYS  23          2HG       LYS  23   6.024  -3.379  -1.818
  208   1HD   LYS  23          1HD       LYS  23   7.938  -4.639  -2.608
  209   2HD   LYS  23          2HD       LYS  23   8.988  -3.870  -1.418
  210   1HE   LYS  23          1HE       LYS  23   7.776  -4.929   0.416
  211   2HE   LYS  23          2HE       LYS  23   6.602  -5.620  -0.717
  212   1HZ   LYS  23          1HZ       LYS  23   9.532  -6.141  -0.804
  213   2HZ   LYS  23          2HZ       LYS  23   8.384  -7.197  -0.147
  214   3HZ   LYS  23          3HZ       LYS  23   8.350  -6.840  -1.805
  215    H    THR  24           H        THR  24   7.655   1.095  -3.208
  216    HA   THR  24           HA       THR  24  10.141   1.196  -4.670
  217    HB   THR  24           HB       THR  24   8.005   3.334  -4.334
  218    HG1  THR  24           HG1      THR  24   6.886   1.692  -5.156
  219   1HG2  THR  24          1HG2      THR  24  10.233   2.887  -6.299
  220   2HG2  THR  24          2HG2      THR  24   8.766   3.733  -6.795
  221   3HG2  THR  24          3HG2      THR  24   9.751   4.371  -5.477
  222    H    LEU  25           H        LEU  25   8.795   3.186  -2.018
  223    HA   LEU  25           HA       LEU  25  10.857   5.101  -1.737
  224   1HB   LEU  25          1HB       LEU  25   8.499   4.783  -0.634
  225   2HB   LEU  25          2HB       LEU  25   9.398   3.908   0.604
  226    HG   LEU  25           HG       LEU  25  10.973   6.054   0.450
  227   1HD1  LEU  25          1HD1      LEU  25   9.292   6.928  -1.370
  228   2HD1  LEU  25          2HD1      LEU  25   8.300   7.361   0.023
  229   3HD1  LEU  25          3HD1      LEU  25   9.915   8.044  -0.157
  230   1HD2  LEU  25          1HD2      LEU  25   8.707   5.249   2.104
  231   2HD2  LEU  25          2HD2      LEU  25  10.249   5.953   2.586
  232   3HD2  LEU  25          3HD2      LEU  25   8.918   7.000   2.099
  233    H    GLU  26           H        GLU  26  10.696   1.751  -0.558
  234    HA   GLU  26           HA       GLU  26  12.968   1.925   1.225
  235   1HB   GLU  26          1HB       GLU  26  11.109  -0.105   0.189
  236   2HB   GLU  26          2HB       GLU  26  12.725  -0.723   0.521
  237   1HG   GLU  26          1HG       GLU  26  11.076   0.889   2.485
  238   2HG   GLU  26          2HG       GLU  26  11.199  -0.869   2.492
  239    H    HIS  27           H        HIS  27  12.688   1.226  -2.270
  240    HA   HIS  27           HA       HIS  27  15.661   0.847  -2.283
  241   1HB   HIS  27          1HB       HIS  27  13.420  -0.643  -3.486
  242   2HB   HIS  27          2HB       HIS  27  14.781  -0.367  -4.574
  243    HD1  HIS  27           HD1      HIS  27  16.749  -1.907  -4.286
  244    HD2  HIS  27           HD2      HIS  27  14.344  -1.806  -0.879
  245    HE1  HIS  27           HE1      HIS  27  17.702  -3.615  -2.682
  246    H    LYS  28           H        LYS  28  14.413   3.438  -2.463
  247    HA   LYS  28           HA       LYS  28  14.940   4.203  -5.315
  248   1HB   LYS  28          1HB       LYS  28  13.062   5.086  -3.175
  249   2HB   LYS  28          2HB       LYS  28  13.755   6.377  -4.155
  250   1HG   LYS  28          1HG       LYS  28  12.489   3.919  -5.378
  251   2HG   LYS  28          2HG       LYS  28  11.566   5.372  -5.003
  252   1HD   LYS  28          1HD       LYS  28  13.457   6.592  -6.361
  253   2HD   LYS  28          2HD       LYS  28  13.743   4.988  -7.035
  254   1HE   LYS  28          1HE       LYS  28  11.323   4.861  -7.672
  255   2HE   LYS  28          2HE       LYS  28  11.130   6.537  -7.122
  256   1HZ   LYS  28          1HZ       LYS  28  12.912   7.201  -8.637
  257   2HZ   LYS  28          2HZ       LYS  28  13.048   5.601  -9.196
  258   3HZ   LYS  28          3HZ       LYS  28  11.628   6.488  -9.478
  259    H    ARG  29           H        ARG  29  15.243   5.570  -2.019
  260    HA   ARG  29           HA       ARG  29  17.472   7.280  -2.721
  261   1HB   ARG  29          1HB       ARG  29  17.407   7.896  -0.397
  262   2HB   ARG  29          2HB       ARG  29  15.746   7.685  -0.936
  263   1HG   ARG  29          1HG       ARG  29  16.022   5.243  -0.045
  264   2HG   ARG  29          2HG       ARG  29  17.400   5.899   0.837
  265   1HD   ARG  29          1HD       ARG  29  15.181   7.691   1.181
  266   2HD   ARG  29          2HD       ARG  29  14.643   6.046   1.553
  267    HE   ARG  29           HE       ARG  29  16.468   7.579   3.153
  268   1HH1  ARG  29          1HH2      ARG  29  14.837   4.863   3.558
  269   2HH1  ARG  29          2HH2      ARG  29  16.124   3.858   4.119
  270   1HH2  ARG  29          1HH1      ARG  29  18.627   6.096   3.169
  271   2HH2  ARG  29          2HH1      ARG  29  18.288   4.565   3.898
  272    H    GLU  30           H        GLU  30  17.240   3.974  -1.457
  273    HA   GLU  30           HA       GLU  30  19.859   3.679  -0.373
  274   1HB   GLU  30          1HB       GLU  30  17.745   2.122  -0.359
  275   2HB   GLU  30          2HB       GLU  30  18.440   1.463  -1.840
  276   1HG   GLU  30          1HG       GLU  30  20.583   1.075  -0.598
  277   2HG   GLU  30          2HG       GLU  30  19.778   1.596   0.878
  278    H    ASN  31           H        ASN  31  18.717   3.465  -3.741
  279    HA   ASN  31           HA       ASN  31  21.525   2.954  -4.650
  280   1HB   ASN  31          1HB       ASN  31  18.885   1.977  -5.429
  281   2HB   ASN  31          2HB       ASN  31  19.761   2.645  -6.804
  282   1HD2  ASN  31          2HD2      ASN  31  19.797   0.063  -4.380
  283   2HD2  ASN  31          1HD2      ASN  31  21.078  -0.800  -5.081
  284    H    ALA  32           H        ALA  32  18.580   4.733  -5.645
  285    HA   ALA  32           HA       ALA  32  18.220   6.830  -6.511
  286   1HB   ALA  32          1HB       ALA  32  19.828   7.382  -4.616
  287   2HB   ALA  32          2HB       ALA  32  21.100   7.452  -5.834
  288   3HB   ALA  32          3HB       ALA  32  19.735   8.566  -5.919
  289    H    LYS  33           H        LYS  33  21.617   6.086  -7.487
  290    HA   LYS  33           HA       LYS  33  20.718   6.271 -10.341
  291   1HB   LYS  33          1HB       LYS  33  23.121   7.488  -8.952
  292   2HB   LYS  33          2HB       LYS  33  23.002   7.345 -10.703
  293   1HG   LYS  33          1HG       LYS  33  20.660   8.519 -10.333
  294   2HG   LYS  33          2HG       LYS  33  21.412   9.070  -8.836
  295   1HD   LYS  33          1HD       LYS  33  23.413   9.728 -10.405
  296   2HD   LYS  33          2HD       LYS  33  22.195   9.664 -11.675
  297   1HE   LYS  33          1HE       LYS  33  21.742  11.818 -11.093
  298   2HE   LYS  33          2HE       LYS  33  20.904  11.122  -9.696
  299   1HZ   LYS  33          1HZ       LYS  33  23.809  11.770  -9.761
  300   2HZ   LYS  33          2HZ       LYS  33  22.621  12.747  -9.055
  301   3HZ   LYS  33          3HZ       LYS  33  22.926  11.201  -8.425
  302    H    GLU  34           H        GLU  34  21.422   4.564 -11.572
  303    HA   GLU  34           HA       GLU  34  22.967   2.403 -10.313
  304   1HB   GLU  34          1HB       GLU  34  21.465   2.804 -12.897
  305   2HB   GLU  34          2HB       GLU  34  22.473   1.381 -12.648
  306   1HG   GLU  34          1HG       GLU  34  21.200   0.736 -10.693
  307   2HG   GLU  34          2HG       GLU  34  20.276   2.234 -10.741
  Start of MODEL    8
    1   1H    CYS   1          1H        CYS   1 -25.770   4.736  -3.310
    2   2H    CYS   1          2H        CYS   1 -26.558   3.236  -3.391
    3   3H    CYS   1          3H        CYS   1 -27.363   4.643  -3.886
    4    HA   CYS   1           HA       CYS   1 -27.404   5.504  -1.646
    5   1HB   CYS   1          1HB       CYS   1 -28.397   2.729  -2.248
    6   2HB   CYS   1          2HB       CYS   1 -28.669   3.416  -0.652
    7    HG   CYS   1           HG       CYS   1 -30.689   4.140  -2.147
    8    H    ALA   2           H        ALA   2 -26.477   2.062  -1.250
    9    HA   ALA   2           HA       ALA   2 -24.165   2.791   0.464
   10   1HB   ALA   2          1HB       ALA   2 -26.610   1.239   1.379
   11   2HB   ALA   2          2HB       ALA   2 -25.123   1.416   2.309
   12   3HB   ALA   2          3HB       ALA   2 -26.112   2.831   1.951
   13    H    VAL   3           H        VAL   3 -22.582   1.282   0.174
   14    HA   VAL   3           HA       VAL   3 -23.081  -1.110  -1.528
   15    HB   VAL   3           HB       VAL   3 -20.638  -1.173  -1.621
   16   1HG1  VAL   3          1HG1      VAL   3 -22.069   0.524  -2.970
   17   2HG1  VAL   3          2HG1      VAL   3 -21.356   1.737  -1.907
   18   3HG1  VAL   3          3HG1      VAL   3 -20.322   0.745  -2.934
   19   1HG2  VAL   3          1HG2      VAL   3 -20.888   0.264   0.840
   20   2HG2  VAL   3          2HG2      VAL   3 -19.426  -0.379   0.102
   21   3HG2  VAL   3          3HG2      VAL   3 -19.957   1.264  -0.273
   22    H    GLU   4           H        GLU   4 -24.012  -1.025   1.284
   23    HA   GLU   4           HA       GLU   4 -24.202  -2.385   3.108
   24   1HB   GLU   4          1HB       GLU   4 -22.392  -4.297   1.619
   25   2HB   GLU   4          2HB       GLU   4 -23.485  -4.690   2.934
   26   1HG   GLU   4          1HG       GLU   4 -24.933  -5.254   1.289
   27   2HG   GLU   4          2HG       GLU   4 -25.201  -3.519   1.136
   28    H    LEU   5           H        LEU   5 -21.518  -0.711   2.519
   29    HA   LEU   5           HA       LEU   5 -19.506  -0.274   3.598
   30   1HB   LEU   5          1HB       LEU   5 -21.209  -1.185   5.947
   31   2HB   LEU   5          2HB       LEU   5 -19.838  -0.083   6.023
   32    HG   LEU   5           HG       LEU   5 -22.334   0.465   4.391
   33   1HD1  LEU   5          1HD1      LEU   5 -22.901   0.363   6.776
   34   2HD1  LEU   5          2HD1      LEU   5 -21.609   1.510   7.135
   35   3HD1  LEU   5          3HD1      LEU   5 -22.993   2.014   6.165
   36   1HD2  LEU   5          1HD2      LEU   5 -19.821   1.977   5.035
   37   2HD2  LEU   5          2HD2      LEU   5 -20.694   1.859   3.508
   38   3HD2  LEU   5          3HD2      LEU   5 -21.320   2.875   4.805
   39    H    ARG   6           H        ARG   6 -19.533  -2.726   2.376
   40    HA   ARG   6           HA       ARG   6 -17.509  -4.250   3.866
   41   1HB   ARG   6          1HB       ARG   6 -19.953  -4.875   4.566
   42   2HB   ARG   6          2HB       ARG   6 -19.974  -5.740   3.030
   43   1HG   ARG   6          1HG       ARG   6 -18.004  -7.025   3.681
   44   2HG   ARG   6          2HG       ARG   6 -17.870  -6.108   5.180
   45   1HD   ARG   6          1HD       ARG   6 -18.972  -8.164   5.759
   46   2HD   ARG   6          2HD       ARG   6 -20.242  -6.926   5.731
   47    HE   ARG   6           HE       ARG   6 -19.760  -8.411   3.206
   48   1HH1  ARG   6          1HH1      ARG   6 -22.241  -6.830   3.556
   49   2HH1  ARG   6          2HH1      ARG   6 -23.401  -8.026   4.015
   50   1HH2  ARG   6          1HH2      ARG   6 -20.989 -10.400   4.865
   51   2HH2  ARG   6          2HH2      ARG   6 -22.683 -10.075   4.765
   52    H    SER   7           H        SER   7 -19.611  -4.075   0.953
   53    HA   SER   7           HA       SER   7 -18.449  -5.981  -0.717
   54   1HB   SER   7          1HB       SER   7 -19.885  -3.400  -1.058
   55   2HB   SER   7          2HB       SER   7 -19.036  -4.017  -2.465
   56    HG   SER   7           HG       SER   7 -21.313  -4.916  -1.254
   57    HA   PRO   8           HA       PRO   8 -14.356  -4.263  -1.239
   58   1HB   PRO   8          1HB       PRO   8 -13.405  -6.127  -2.993
   59   2HB   PRO   8          2HB       PRO   8 -13.564  -6.426  -1.248
   60   1HG   PRO   8          1HG       PRO   8 -15.259  -7.350  -3.479
   61   2HG   PRO   8          2HG       PRO   8 -14.884  -8.132  -1.938
   62   1HD   PRO   8          1HD       PRO   8 -17.243  -6.824  -2.533
   63   2HD   PRO   8          2HD       PRO   8 -16.654  -7.195  -0.899
   64    H    GLY   9           H        GLY   9 -13.085  -3.310  -3.027
   65   1HA   GLY   9          1HA       GLY   9 -13.765  -3.208  -5.742
   66   2HA   GLY   9          2HA       GLY   9 -14.705  -1.932  -4.969
   67    H    ILE  10           H        ILE  10 -13.721   0.007  -4.988
   68    HA   ILE  10           HA       ILE  10 -11.034   0.484  -5.830
   69    HB   ILE  10           HB       ILE  10 -12.866   2.256  -4.197
   70   1HG1  ILE  10          1HG1      ILE  10 -12.619   2.791  -7.073
   71   2HG1  ILE  10          2HG1      ILE  10 -13.384   1.236  -6.723
   72   1HG2  ILE  10          1HG2      ILE  10 -10.332   2.848  -4.537
   73   2HG2  ILE  10          2HG2      ILE  10 -10.842   3.250  -6.176
   74   3HG2  ILE  10          3HG2      ILE  10 -11.562   4.082  -4.800
   75   1HD1  ILE  10          1HD1      ILE  10 -14.931   2.341  -5.150
   76   2HD1  ILE  10          2HD1      ILE  10 -14.193   3.898  -5.523
   77   3HD1  ILE  10          3HD1      ILE  10 -15.081   3.021  -6.772
   78    H    SER  11           H        SER  11 -12.452   0.492  -2.533
   79    HA   SER  11           HA       SER  11 -10.128   1.288  -1.139
   80   1HB   SER  11          1HB       SER  11 -12.644   0.856  -0.399
   81   2HB   SER  11          2HB       SER  11 -11.998  -0.709   0.075
   82    HG   SER  11           HG       SER  11 -11.558   0.495   1.822
   83    H    ARG  12           H        ARG  12 -11.122  -1.979  -2.151
   84    HA   ARG  12           HA       ARG  12  -9.071  -3.449  -0.783
   85   1HB   ARG  12          1HB       ARG  12 -11.224  -4.260  -1.943
   86   2HB   ARG  12          2HB       ARG  12 -10.315  -4.169  -3.450
   87   1HG   ARG  12          1HG       ARG  12  -9.138  -6.047  -2.986
   88   2HG   ARG  12          2HG       ARG  12  -8.860  -5.566  -1.313
   89   1HD   ARG  12          1HD       ARG  12 -11.495  -6.121  -1.142
   90   2HD   ARG  12          2HD       ARG  12 -11.056  -7.228  -2.458
   91    HE   ARG  12           HE       ARG  12  -9.388  -8.252  -0.979
   92   1HH1  ARG  12          1HH1      ARG  12  -8.752  -6.141   0.928
   93   2HH1  ARG  12          2HH1      ARG  12  -9.660  -6.564   2.335
   94   1HH2  ARG  12          1HH2      ARG  12 -11.786  -8.737   0.616
   95   2HH2  ARG  12          2HH2      ARG  12 -11.402  -8.054   2.157
   96    H    PHE  13           H        PHE  13  -9.219  -2.094  -4.099
   97    HA   PHE  13           HA       PHE  13  -6.501  -2.914  -4.726
   98   1HB   PHE  13          1HB       PHE  13  -7.323  -2.641  -6.792
   99   2HB   PHE  13          2HB       PHE  13  -8.831  -2.118  -6.085
  100    HD1  PHE  13           HD1      PHE  13  -9.301   0.291  -5.833
  101    HD2  PHE  13           HD2      PHE  13  -5.798  -1.103  -7.869
  102    HE1  PHE  13           HE1      PHE  13  -9.027   2.527  -6.860
  103    HE2  PHE  13           HE2      PHE  13  -5.516   1.135  -8.903
  104    HZ   PHE  13           HZ       PHE  13  -7.137   2.951  -8.395
  105    H    ARG  14           H        ARG  14  -7.923  -0.030  -3.279
  106    HA   ARG  14           HA       ARG  14  -5.863   1.880  -3.734
  107   1HB   ARG  14          1HB       ARG  14  -7.956   1.361  -1.661
  108   2HB   ARG  14          2HB       ARG  14  -6.688   2.517  -1.262
  109   1HG   ARG  14          1HG       ARG  14  -7.226   3.864  -3.206
  110   2HG   ARG  14          2HG       ARG  14  -8.384   2.659  -3.770
  111   1HD   ARG  14          1HD       ARG  14  -9.771   4.230  -2.679
  112   2HD   ARG  14          2HD       ARG  14  -9.512   3.011  -1.419
  113    HE   ARG  14           HE       ARG  14  -7.413   4.641  -0.929
  114   1HH1  ARG  14          1HH1      ARG  14  -8.895   6.764  -2.520
  115   2HH1  ARG  14          2HH1      ARG  14  -9.724   7.620  -1.269
  116   1HH2  ARG  14          1HH2      ARG  14  -9.258   5.076   1.090
  117   2HH2  ARG  14          2HH2      ARG  14  -9.934   6.645   0.819
  118    H    ARG  15           H        ARG  15  -6.162  -0.705  -1.297
  119    HA   ARG  15           HA       ARG  15  -3.834  -0.066   0.264
  120   1HB   ARG  15          1HB       ARG  15  -5.246  -2.707  -0.249
  121   2HB   ARG  15          2HB       ARG  15  -4.091  -2.418   1.048
  122   1HG   ARG  15          1HG       ARG  15  -6.590  -0.742   0.738
  123   2HG   ARG  15          2HG       ARG  15  -6.587  -2.247   1.650
  124   1HD   ARG  15          1HD       ARG  15  -4.997  -1.402   3.233
  125   2HD   ARG  15          2HD       ARG  15  -4.645   0.015   2.226
  126    HE   ARG  15           HE       ARG  15  -7.004   0.754   2.603
  127   1HH1  ARG  15          1HH1      ARG  15  -8.259  -1.667   3.652
  128   2HH1  ARG  15          2HH1      ARG  15  -8.248  -1.429   5.365
  129   1HH2  ARG  15          1HH2      ARG  15  -5.827   1.088   5.243
  130   2HH2  ARG  15          2HH2      ARG  15  -6.847   0.154   6.280
  131    H    LYS  16           H        LYS  16  -4.313  -2.062  -2.654
  132    HA   LYS  16           HA       LYS  16  -1.650  -3.162  -2.749
  133   1HB   LYS  16          1HB       LYS  16  -3.887  -3.784  -3.998
  134   2HB   LYS  16          2HB       LYS  16  -3.349  -2.587  -5.174
  135   1HG   LYS  16          1HG       LYS  16  -2.083  -4.186  -6.112
  136   2HG   LYS  16          2HG       LYS  16  -1.075  -4.152  -4.667
  137   1HD   LYS  16          1HD       LYS  16  -1.985  -6.069  -3.814
  138   2HD   LYS  16          2HD       LYS  16  -3.588  -5.731  -4.459
  139   1HE   LYS  16          1HE       LYS  16  -1.321  -6.436  -6.327
  140   2HE   LYS  16          2HE       LYS  16  -2.242  -7.708  -5.505
  141   1HZ   LYS  16          1HZ       LYS  16  -4.299  -6.588  -6.309
  142   2HZ   LYS  16          2HZ       LYS  16  -3.327  -5.567  -7.257
  143   3HZ   LYS  16          3HZ       LYS  16  -3.335  -7.232  -7.549
  144    H    ILE  17           H        ILE  17  -3.088  -0.134  -3.952
  145    HA   ILE  17           HA       ILE  17  -0.829   0.716  -5.539
  146    HB   ILE  17           HB       ILE  17  -2.934   2.346  -4.062
  147   1HG1  ILE  17          1HG1      ILE  17  -3.004   1.674  -7.004
  148   2HG1  ILE  17          2HG1      ILE  17  -3.703   0.566  -5.820
  149   1HG2  ILE  17          1HG2      ILE  17  -1.037   3.038  -6.315
  150   2HG2  ILE  17          2HG2      ILE  17  -2.464   4.000  -5.931
  151   3HG2  ILE  17          3HG2      ILE  17  -1.179   3.817  -4.739
  152   1HD1  ILE  17          1HD1      ILE  17  -4.562   3.231  -5.191
  153   2HD1  ILE  17          2HD1      ILE  17  -4.876   2.920  -6.898
  154   3HD1  ILE  17          3HD1      ILE  17  -5.539   1.843  -5.671
  155    H    ALA  18           H        ALA  18  -1.827   1.235  -2.147
  156    HA   ALA  18           HA       ALA  18   0.323   2.933  -1.335
  157   1HB   ALA  18          1HB       ALA  18  -1.723   1.186  -0.039
  158   2HB   ALA  18          2HB       ALA  18  -0.353   1.687   0.953
  159   3HB   ALA  18          3HB       ALA  18  -1.389   2.900   0.206
  160    H    LYS  19           H        LYS  19   0.033  -0.655  -1.290
  161    HA   LYS  19           HA       LYS  19   2.519  -1.184   0.029
  162   1HB   LYS  19          1HB       LYS  19   0.471  -2.693  -0.790
  163   2HB   LYS  19          2HB       LYS  19   1.531  -2.957  -2.176
  164   1HG   LYS  19          1HG       LYS  19   3.172  -4.008  -0.903
  165   2HG   LYS  19          2HG       LYS  19   2.660  -3.229   0.593
  166   1HD   LYS  19          1HD       LYS  19   1.590  -5.157   1.067
  167   2HD   LYS  19          2HD       LYS  19   0.411  -4.669  -0.149
  168   1HE   LYS  19          1HE       LYS  19   2.004  -5.775  -1.869
  169   2HE   LYS  19          2HE       LYS  19   2.751  -6.555  -0.466
  170   1HZ   LYS  19          1HZ       LYS  19   0.161  -6.952   0.077
  171   2HZ   LYS  19          2HZ       LYS  19   0.115  -6.967  -1.620
  172   3HZ   LYS  19          3HZ       LYS  19   1.120  -8.051  -0.785
  173    H    ARG  20           H        ARG  20   1.725  -0.520  -3.348
  174    HA   ARG  20           HA       ARG  20   4.289  -1.083  -4.542
  175   1HB   ARG  20          1HB       ARG  20   1.807  -0.669  -5.447
  176   2HB   ARG  20          2HB       ARG  20   2.405   0.977  -5.618
  177   1HG   ARG  20          1HG       ARG  20   3.780   0.436  -7.351
  178   2HG   ARG  20          2HG       ARG  20   4.237  -1.110  -6.637
  179   1HD   ARG  20          1HD       ARG  20   2.979  -1.649  -8.601
  180   2HD   ARG  20          2HD       ARG  20   1.872  -1.921  -7.245
  181    HE   ARG  20           HE       ARG  20   0.849   0.291  -7.731
  182   1HH1  ARG  20          1HH2      ARG  20   0.261  -1.208 -10.166
  183   2HH1  ARG  20          2HH2      ARG  20   0.873  -0.202 -11.433
  184   1HH2  ARG  20          1HH1      ARG  20   2.869   1.690  -9.267
  185   2HH2  ARG  20          2HH1      ARG  20   2.381   1.475 -10.912
  186    H    SER  21           H        SER  21   2.785   1.887  -3.230
  187    HA   SER  21           HA       SER  21   4.962   3.652  -3.972
  188   1HB   SER  21          1HB       SER  21   2.509   3.796  -2.242
  189   2HB   SER  21          2HB       SER  21   3.675   5.117  -2.248
  190    HG   SER  21           HG       SER  21   2.907   5.668  -4.136
  191    H    ILE  22           H        ILE  22   4.581   1.449  -1.274
  192    HA   ILE  22           HA       ILE  22   6.505   2.943   0.412
  193    HB   ILE  22           HB       ILE  22   4.849   0.420   0.735
  194   1HG1  ILE  22          1HG1      ILE  22   4.716   2.887   2.450
  195   2HG1  ILE  22          2HG1      ILE  22   3.939   2.891   0.867
  196   1HG2  ILE  22          1HG2      ILE  22   7.074   1.492   2.422
  197   2HG2  ILE  22          2HG2      ILE  22   5.648   0.872   3.250
  198   3HG2  ILE  22          3HG2      ILE  22   6.558  -0.174   2.165
  199   1HD1  ILE  22          1HD1      ILE  22   2.943   0.588   1.694
  200   2HD1  ILE  22          2HD1      ILE  22   3.291   1.252   3.288
  201   3HD1  ILE  22          3HD1      ILE  22   2.205   2.107   2.197
  202    H    LYS  23           H        LYS  23   6.298  -0.208  -1.290
  203    HA   LYS  23           HA       LYS  23   8.857  -1.240  -0.645
  204   1HB   LYS  23          1HB       LYS  23   7.097  -1.517  -3.098
  205   2HB   LYS  23          2HB       LYS  23   8.553  -2.476  -2.848
  206   1HG   LYS  23          1HG       LYS  23   6.236  -2.366  -0.897
  207   2HG   LYS  23          2HG       LYS  23   6.455  -3.631  -2.104
  208   1HD   LYS  23          1HD       LYS  23   8.641  -4.205  -1.107
  209   2HD   LYS  23          2HD       LYS  23   8.416  -2.956   0.114
  210   1HE   LYS  23          1HE       LYS  23   6.459  -5.241  -0.276
  211   2HE   LYS  23          2HE       LYS  23   7.806  -5.304   0.867
  212   1HZ   LYS  23          1HZ       LYS  23   6.883  -3.027   1.649
  213   2HZ   LYS  23          2HZ       LYS  23   5.446  -3.530   0.899
  214   3HZ   LYS  23          3HZ       LYS  23   6.119  -4.455   2.155
  215    H    THR  24           H        THR  24   7.964   0.706  -3.526
  216    HA   THR  24           HA       THR  24  10.604   0.908  -4.604
  217    HB   THR  24           HB       THR  24   8.412   1.405  -5.748
  218    HG1  THR  24           HG1      THR  24   9.982   2.160  -6.954
  219   1HG2  THR  24          1HG2      THR  24   7.555   2.881  -3.832
  220   2HG2  THR  24          2HG2      THR  24   8.600   4.141  -4.488
  221   3HG2  THR  24          3HG2      THR  24   7.295   3.478  -5.470
  222    H    LEU  25           H        LEU  25   8.928   2.805  -2.145
  223    HA   LEU  25           HA       LEU  25  10.796   4.982  -1.909
  224   1HB   LEU  25          1HB       LEU  25   8.324   4.142  -0.829
  225   2HB   LEU  25          2HB       LEU  25   9.400   4.296   0.550
  226    HG   LEU  25           HG       LEU  25   9.351   6.477  -1.515
  227   1HD1  LEU  25          1HD1      LEU  25   7.286   5.983   0.641
  228   2HD1  LEU  25          2HD1      LEU  25   7.568   7.572  -0.070
  229   3HD1  LEU  25          3HD1      LEU  25   7.010   6.239  -1.082
  230   1HD2  LEU  25          1HD2      LEU  25  10.899   6.216   0.613
  231   2HD2  LEU  25          2HD2      LEU  25  10.216   7.788   0.207
  232   3HD2  LEU  25          3HD2      LEU  25   9.475   6.807   1.469
  233    H    GLU  26           H        GLU  26  10.407   1.920  -0.104
  234    HA   GLU  26           HA       GLU  26  12.575   2.249   1.741
  235   1HB   GLU  26          1HB       GLU  26  11.160  -0.155   0.569
  236   2HB   GLU  26          2HB       GLU  26  12.332  -0.278   1.877
  237   1HG   GLU  26          1HG       GLU  26  10.977   0.960   3.370
  238   2HG   GLU  26          2HG       GLU  26   9.964   1.586   2.069
  239    H    HIS  27           H        HIS  27  12.435   0.780  -1.493
  240    HA   HIS  27           HA       HIS  27  14.806  -0.540  -1.837
  241   1HB   HIS  27          1HB       HIS  27  12.842   0.173  -3.433
  242   2HB   HIS  27          2HB       HIS  27  13.959   1.448  -3.913
  243    HD1  HIS  27           HD1      HIS  27  15.537   0.806  -5.729
  244    HD2  HIS  27           HD2      HIS  27  14.221  -2.532  -3.607
  245    HE1  HIS  27           HE1      HIS  27  16.562  -1.213  -6.862
  246    H    LYS  28           H        LYS  28  14.521   3.042  -1.937
  247    HA   LYS  28           HA       LYS  28  17.512   3.178  -1.980
  248   1HB   LYS  28          1HB       LYS  28  17.339   5.083  -3.284
  249   2HB   LYS  28          2HB       LYS  28  15.973   4.134  -3.847
  250   1HG   LYS  28          1HG       LYS  28  14.784   5.532  -1.836
  251   2HG   LYS  28          2HG       LYS  28  16.019   6.685  -2.333
  252   1HD   LYS  28          1HD       LYS  28  14.202   7.212  -3.726
  253   2HD   LYS  28          2HD       LYS  28  15.215   6.188  -4.748
  254   1HE   LYS  28          1HE       LYS  28  13.839   4.216  -4.140
  255   2HE   LYS  28          2HE       LYS  28  12.795   5.261  -3.159
  256   1HZ   LYS  28          1HZ       LYS  28  13.340   5.676  -6.058
  257   2HZ   LYS  28          2HZ       LYS  28  11.944   4.942  -5.430
  258   3HZ   LYS  28          3HZ       LYS  28  12.265   6.567  -5.086
  259    H    ARG  29           H        ARG  29  14.937   3.571   0.195
  260    HA   ARG  29           HA       ARG  29  16.240   5.778   1.700
  261   1HB   ARG  29          1HB       ARG  29  13.551   4.445   1.685
  262   2HB   ARG  29          2HB       ARG  29  14.058   5.382   3.086
  263   1HG   ARG  29          1HG       ARG  29  14.440   6.626   0.399
  264   2HG   ARG  29          2HG       ARG  29  12.797   6.523   1.020
  265   1HD   ARG  29          1HD       ARG  29  15.049   7.625   2.716
  266   2HD   ARG  29          2HD       ARG  29  14.105   8.659   1.627
  267    HE   ARG  29           HE       ARG  29  12.062   7.558   2.888
  268   1HH1  ARG  29          1HH1      ARG  29  13.651   6.203   4.975
  269   2HH1  ARG  29          2HH1      ARG  29  13.720   7.377   6.240
  270   1HH2  ARG  29          1HH2      ARG  29  12.782  10.030   4.168
  271   2HH2  ARG  29          2HH2      ARG  29  13.219   9.577   5.778
  272    H    GLU  30           H        GLU  30  15.152   2.385   2.242
  273    HA   GLU  30           HA       GLU  30  16.056   2.161   4.939
  274   1HB   GLU  30          1HB       GLU  30  15.238   0.369   2.741
  275   2HB   GLU  30          2HB       GLU  30  16.357  -0.366   3.883
  276   1HG   GLU  30          1HG       GLU  30  13.876   1.121   4.772
  277   2HG   GLU  30          2HG       GLU  30  13.888  -0.610   4.446
  278    H    ASN  31           H        ASN  31  17.788   1.735   1.861
  279    HA   ASN  31           HA       ASN  31  20.301   1.157   3.359
  280   1HB   ASN  31          1HB       ASN  31  19.289  -0.252   1.389
  281   2HB   ASN  31          2HB       ASN  31  19.929   1.030   0.360
  282   1HD2  ASN  31          2HD2      ASN  31  22.359   1.483   0.633
  283   2HD2  ASN  31          1HD2      ASN  31  23.364   0.175   1.045
  284    H    ALA  32           H        ALA  32  19.492   3.721   3.713
  285    HA   ALA  32           HA       ALA  32  21.091   5.378   1.788
  286   1HB   ALA  32          1HB       ALA  32  18.642   5.783   1.834
  287   2HB   ALA  32          2HB       ALA  32  18.756   6.164   3.552
  288   3HB   ALA  32          3HB       ALA  32  19.561   7.190   2.366
  289    H    LYS  33           H        LYS  33  22.574   6.832   2.635
  290    HA   LYS  33           HA       LYS  33  23.227   6.595   5.546
  291   1HB   LYS  33          1HB       LYS  33  24.846   5.853   3.747
  292   2HB   LYS  33          2HB       LYS  33  24.947   7.534   3.233
  293   1HG   LYS  33          1HG       LYS  33  25.436   7.903   5.838
  294   2HG   LYS  33          2HG       LYS  33  26.009   6.242   5.709
  295   1HD   LYS  33          1HD       LYS  33  26.899   8.461   3.850
  296   2HD   LYS  33          2HD       LYS  33  27.775   8.009   5.310
  297   1HE   LYS  33          1HE       LYS  33  27.905   5.646   4.405
  298   2HE   LYS  33          2HE       LYS  33  27.251   6.268   2.879
  299   1HZ   LYS  33          1HZ       LYS  33  29.064   7.942   2.895
  300   2HZ   LYS  33          2HZ       LYS  33  29.747   7.146   4.234
  301   3HZ   LYS  33          3HZ       LYS  33  29.621   6.345   2.749
  302    H    GLU  34           H        GLU  34  23.454   9.052   2.922
  303    HA   GLU  34           HA       GLU  34  22.810  11.173   4.936
  304   1HB   GLU  34          1HB       GLU  34  24.680  10.925   2.632
  305   2HB   GLU  34          2HB       GLU  34  23.909  12.493   2.840
  306   1HG   GLU  34          1HG       GLU  34  24.902  12.869   4.908
  307   2HG   GLU  34          2HG       GLU  34  25.120  11.152   5.233
  Start of MODEL    9
    1   1H    CYS   1          1H        CYS   1 -16.234 -10.128   6.602
    2   2H    CYS   1          2H        CYS   1 -17.029  -9.111   7.703
    3   3H    CYS   1          3H        CYS   1 -17.318 -10.787   7.721
    4    HA   CYS   1           HA       CYS   1 -18.453 -10.725   5.642
    5   1HB   CYS   1          1HB       CYS   1 -19.427  -9.782   7.927
    6   2HB   CYS   1          2HB       CYS   1 -19.471  -8.267   7.024
    7    HG   CYS   1           HG       CYS   1 -21.346  -9.135   5.641
    8    H    ALA   2           H        ALA   2 -18.323  -9.928   3.579
    9    HA   ALA   2           HA       ALA   2 -17.234  -7.162   3.162
   10   1HB   ALA   2          1HB       ALA   2 -15.946  -9.355   2.561
   11   2HB   ALA   2          2HB       ALA   2 -17.049  -9.414   1.185
   12   3HB   ALA   2          3HB       ALA   2 -15.979  -8.030   1.400
   13    H    VAL   3           H        VAL   3 -20.178  -8.302   3.277
   14    HA   VAL   3           HA       VAL   3 -21.014  -7.199   0.628
   15    HB   VAL   3           HB       VAL   3 -23.053  -8.712   0.987
   16   1HG1  VAL   3          1HG1      VAL   3 -20.279  -9.745   0.386
   17   2HG1  VAL   3          2HG1      VAL   3 -21.738 -10.699   0.118
   18   3HG1  VAL   3          3HG1      VAL   3 -21.504  -9.186  -0.755
   19   1HG2  VAL   3          1HG2      VAL   3 -22.139  -9.244   3.438
   20   2HG2  VAL   3          2HG2      VAL   3 -22.970 -10.475   2.495
   21   3HG2  VAL   3          3HG2      VAL   3 -21.209 -10.469   2.574
   22    H    GLU   4           H        GLU   4 -21.742  -7.132   4.117
   23    HA   GLU   4           HA       GLU   4 -24.026  -5.310   3.610
   24   1HB   GLU   4          1HB       GLU   4 -22.963  -6.927   5.887
   25   2HB   GLU   4          2HB       GLU   4 -23.981  -5.537   6.260
   26   1HG   GLU   4          1HG       GLU   4 -25.507  -7.330   6.038
   27   2HG   GLU   4          2HG       GLU   4 -25.613  -6.468   4.504
   28    H    LEU   5           H        LEU   5 -21.702  -4.130   2.779
   29    HA   LEU   5           HA       LEU   5 -21.515  -1.782   4.543
   30   1HB   LEU   5          1HB       LEU   5 -19.064  -1.960   4.748
   31   2HB   LEU   5          2HB       LEU   5 -19.876  -3.337   5.481
   32    HG   LEU   5           HG       LEU   5 -19.174  -3.710   2.632
   33   1HD1  LEU   5          1HD1      LEU   5 -17.216  -2.417   3.374
   34   2HD1  LEU   5          2HD1      LEU   5 -17.004  -3.514   4.738
   35   3HD1  LEU   5          3HD1      LEU   5 -16.789  -4.103   3.091
   36   1HD2  LEU   5          1HD2      LEU   5 -19.268  -5.238   5.190
   37   2HD2  LEU   5          2HD2      LEU   5 -19.826  -5.699   3.583
   38   3HD2  LEU   5          3HD2      LEU   5 -18.113  -5.790   3.982
   39    H    ARG   6           H        ARG   6 -22.465  -2.287   1.790
   40    HA   ARG   6           HA       ARG   6 -22.458  -1.302  -0.280
   41   1HB   ARG   6          1HB       ARG   6 -22.265   0.908  -0.051
   42   2HB   ARG   6          2HB       ARG   6 -21.766   0.582   1.596
   43   1HG   ARG   6          1HG       ARG   6 -19.363   0.389   0.497
   44   2HG   ARG   6          2HG       ARG   6 -20.109   1.331  -0.792
   45   1HD   ARG   6          1HD       ARG   6 -20.933   2.872   1.179
   46   2HD   ARG   6          2HD       ARG   6 -19.598   2.112   2.067
   47    HE   ARG   6           HE       ARG   6 -18.370   2.777  -0.281
   48   1HH1  ARG   6          1HH1      ARG   6 -20.519   4.861  -0.657
   49   2HH1  ARG   6          2HH1      ARG   6 -19.801   6.250   0.080
   50   1HH2  ARG   6          1HH2      ARG   6 -17.377   4.390   1.777
   51   2HH2  ARG   6          2HH2      ARG   6 -17.991   5.980   1.483
   52    H    SER   7           H        SER   7 -19.948  -3.106   0.634
   53    HA   SER   7           HA       SER   7 -18.247  -4.178  -0.448
   54   1HB   SER   7          1HB       SER   7 -19.786  -2.945  -2.685
   55   2HB   SER   7          2HB       SER   7 -18.193  -3.585  -3.049
   56    HG   SER   7           HG       SER   7 -20.461  -4.889  -1.964
   57    HA   PRO   8           HA       PRO   8 -14.967  -1.251  -0.383
   58   1HB   PRO   8          1HB       PRO   8 -12.877  -2.948  -0.840
   59   2HB   PRO   8          2HB       PRO   8 -13.759  -2.861   0.695
   60   1HG   PRO   8          1HG       PRO   8 -13.837  -4.927  -1.379
   61   2HG   PRO   8          2HG       PRO   8 -14.235  -5.026   0.340
   62   1HD   PRO   8          1HD       PRO   8 -16.038  -4.848  -1.829
   63   2HD   PRO   8          2HD       PRO   8 -16.416  -4.807  -0.094
   64    H    GLY   9           H        GLY   9 -13.769  -3.467  -2.968
   65   1HA   GLY   9          1HA       GLY   9 -13.322  -3.064  -5.225
   66   2HA   GLY   9          2HA       GLY   9 -14.431  -1.696  -5.147
   67    H    ILE  10           H        ILE  10 -13.604   0.369  -4.480
   68    HA   ILE  10           HA       ILE  10 -10.956   0.963  -5.387
   69    HB   ILE  10           HB       ILE  10 -12.965   2.469  -5.395
   70   1HG1  ILE  10          1HG1      ILE  10 -10.453   3.483  -4.043
   71   2HG1  ILE  10          2HG1      ILE  10 -10.706   3.316  -5.777
   72   1HG2  ILE  10          1HG2      ILE  10 -13.622   1.930  -2.992
   73   2HG2  ILE  10          2HG2      ILE  10 -12.308   2.995  -2.489
   74   3HG2  ILE  10          3HG2      ILE  10 -13.654   3.637  -3.430
   75   1HD1  ILE  10          1HD1      ILE  10 -12.845   4.860  -5.154
   76   2HD1  ILE  10          2HD1      ILE  10 -11.715   5.393  -3.910
   77   3HD1  ILE  10          3HD1      ILE  10 -11.279   5.527  -5.613
   78    H    SER  11           H        SER  11 -12.301   0.434  -2.122
   79    HA   SER  11           HA       SER  11  -9.832   1.165  -0.768
   80   1HB   SER  11          1HB       SER  11 -12.443   0.952  -0.022
   81   2HB   SER  11          2HB       SER  11 -11.811  -0.566   0.604
   82    HG   SER  11           HG       SER  11 -11.464   0.958   2.168
   83    H    ARG  12           H        ARG  12 -11.048  -1.811  -2.188
   84    HA   ARG  12           HA       ARG  12  -9.143  -3.488  -0.714
   85   1HB   ARG  12          1HB       ARG  12 -10.343  -5.242  -1.594
   86   2HB   ARG  12          2HB       ARG  12 -11.551  -3.983  -1.772
   87   1HG   ARG  12          1HG       ARG  12 -10.705  -3.641  -4.135
   88   2HG   ARG  12          2HG       ARG  12  -9.699  -5.069  -3.912
   89   1HD   ARG  12          1HD       ARG  12 -12.654  -5.223  -3.331
   90   2HD   ARG  12          2HD       ARG  12 -12.062  -5.380  -4.996
   91    HE   ARG  12           HE       ARG  12 -11.237  -7.176  -2.748
   92   1HH1  ARG  12          1HH2      ARG  12 -13.005  -8.285  -4.846
   93   2HH1  ARG  12          2HH2      ARG  12 -11.889  -9.019  -5.944
   94   1HH2  ARG  12          1HH1      ARG  12  -9.131  -7.283  -4.686
   95   2HH2  ARG  12          2HH1      ARG  12  -9.665  -8.445  -5.851
   96    H    PHE  13           H        PHE  13  -9.192  -1.639  -3.671
   97    HA   PHE  13           HA       PHE  13  -6.765  -2.952  -4.730
   98   1HB   PHE  13          1HB       PHE  13  -7.809  -2.487  -6.663
   99   2HB   PHE  13          2HB       PHE  13  -9.110  -1.731  -5.773
  100    HD1  PHE  13           HD1      PHE  13  -6.001  -1.165  -7.684
  101    HD2  PHE  13           HD2      PHE  13  -9.233   0.690  -5.556
  102    HE1  PHE  13           HE1      PHE  13  -5.392   1.028  -8.668
  103    HE2  PHE  13           HE2      PHE  13  -8.627   2.885  -6.539
  104    HZ   PHE  13           HZ       PHE  13  -6.708   3.054  -8.093
  105    H    ARG  14           H        ARG  14  -7.777   0.128  -3.218
  106    HA   ARG  14           HA       ARG  14  -5.455   1.657  -3.801
  107   1HB   ARG  14          1HB       ARG  14  -6.198   3.105  -2.067
  108   2HB   ARG  14          2HB       ARG  14  -7.649   2.417  -2.777
  109   1HG   ARG  14          1HG       ARG  14  -7.783   0.788  -0.929
  110   2HG   ARG  14          2HG       ARG  14  -6.314   1.457  -0.223
  111   1HD   ARG  14          1HD       ARG  14  -8.743   3.177  -0.770
  112   2HD   ARG  14          2HD       ARG  14  -8.517   2.322   0.767
  113    HE   ARG  14           HE       ARG  14  -6.142   3.840  -0.012
  114   1HH1  ARG  14          1HH2      ARG  14  -8.202   5.940  -0.052
  115   2HH1  ARG  14          2HH2      ARG  14  -8.287   6.436   1.602
  116   1HH2  ARG  14          1HH1      ARG  14  -6.678   3.564   2.788
  117   2HH2  ARG  14          2HH1      ARG  14  -7.409   5.066   3.240
  118    H    ARG  15           H        ARG  15  -5.907  -0.935  -1.460
  119    HA   ARG  15           HA       ARG  15  -3.649  -0.430   0.244
  120   1HB   ARG  15          1HB       ARG  15  -5.091  -2.957  -0.628
  121   2HB   ARG  15          2HB       ARG  15  -3.842  -2.941   0.617
  122   1HG   ARG  15          1HG       ARG  15  -5.156  -1.788   2.130
  123   2HG   ARG  15          2HG       ARG  15  -6.104  -0.996   0.871
  124   1HD   ARG  15          1HD       ARG  15  -7.205  -3.159   0.346
  125   2HD   ARG  15          2HD       ARG  15  -6.303  -3.923   1.673
  126    HE   ARG  15           HE       ARG  15  -8.387  -1.828   2.005
  127   1HH1  ARG  15          1HH2      ARG  15  -8.509  -4.581   3.292
  128   2HH1  ARG  15          2HH2      ARG  15  -8.019  -4.232   4.911
  129   1HH2  ARG  15          1HH1      ARG  15  -6.675  -1.117   4.114
  130   2HH2  ARG  15          2HH1      ARG  15  -6.970  -2.255   5.383
  131    H    LYS  16           H        LYS  16  -4.028  -2.286  -2.795
  132    HA   LYS  16           HA       LYS  16  -1.294  -3.187  -2.967
  133   1HB   LYS  16          1HB       LYS  16  -3.613  -3.738  -4.299
  134   2HB   LYS  16          2HB       LYS  16  -2.822  -2.689  -5.474
  135   1HG   LYS  16          1HG       LYS  16  -1.350  -4.990  -4.187
  136   2HG   LYS  16          2HG       LYS  16  -2.343  -5.224  -5.624
  137   1HD   LYS  16          1HD       LYS  16  -1.022  -3.411  -6.758
  138   2HD   LYS  16          2HD       LYS  16   0.038  -3.370  -5.351
  139   1HE   LYS  16          1HE       LYS  16   0.486  -5.832  -5.702
  140   2HE   LYS  16          2HE       LYS  16  -0.403  -5.715  -7.231
  141   1HZ   LYS  16          1HZ       LYS  16   1.925  -4.011  -6.493
  142   2HZ   LYS  16          2HZ       LYS  16   1.988  -5.347  -7.533
  143   3HZ   LYS  16          3HZ       LYS  16   1.076  -3.980  -7.966
  144    H    ILE  17           H        ILE  17  -3.001  -0.283  -4.152
  145    HA   ILE  17           HA       ILE  17  -0.910   0.823  -5.730
  146    HB   ILE  17           HB       ILE  17  -3.512   1.506  -4.779
  147   1HG1  ILE  17          1HG1      ILE  17  -1.740   2.978  -6.734
  148   2HG1  ILE  17          2HG1      ILE  17  -2.606   1.488  -7.102
  149   1HG2  ILE  17          1HG2      ILE  17  -1.534   3.760  -4.350
  150   2HG2  ILE  17          2HG2      ILE  17  -3.285   3.951  -4.429
  151   3HG2  ILE  17          3HG2      ILE  17  -2.560   3.021  -3.121
  152   1HD1  ILE  17          1HD1      ILE  17  -4.712   2.796  -6.271
  153   2HD1  ILE  17          2HD1      ILE  17  -3.720   4.227  -6.553
  154   3HD1  ILE  17          3HD1      ILE  17  -4.079   3.129  -7.884
  155    H    ALA  18           H        ALA  18  -1.534   0.940  -2.245
  156    HA   ALA  18           HA       ALA  18   0.590   2.766  -1.536
  157   1HB   ALA  18          1HB       ALA  18  -1.549   1.947  -0.248
  158   2HB   ALA  18          2HB       ALA  18  -0.519   0.607   0.254
  159   3HB   ALA  18          3HB       ALA  18  -0.075   2.261   0.669
  160    H    LYS  19           H        LYS  19   0.355  -0.819  -1.693
  161    HA   LYS  19           HA       LYS  19   2.907  -1.478  -0.624
  162   1HB   LYS  19          1HB       LYS  19   0.955  -2.995  -1.283
  163   2HB   LYS  19          2HB       LYS  19   1.533  -2.864  -2.944
  164   1HG   LYS  19          1HG       LYS  19   3.855  -3.536  -1.801
  165   2HG   LYS  19          2HG       LYS  19   2.774  -4.262  -0.612
  166   1HD   LYS  19          1HD       LYS  19   1.771  -5.683  -2.207
  167   2HD   LYS  19          2HD       LYS  19   2.398  -4.754  -3.566
  168   1HE   LYS  19          1HE       LYS  19   4.375  -5.981  -1.672
  169   2HE   LYS  19          2HE       LYS  19   3.562  -7.036  -2.838
  170   1HZ   LYS  19          1HZ       LYS  19   4.195  -5.506  -4.614
  171   2HZ   LYS  19          2HZ       LYS  19   5.027  -4.529  -3.499
  172   3HZ   LYS  19          3HZ       LYS  19   5.562  -6.104  -3.812
  173    H    ARG  20           H        ARG  20   1.956  -0.484  -3.899
  174    HA   ARG  20           HA       ARG  20   4.582  -0.840  -5.114
  175   1HB   ARG  20          1HB       ARG  20   2.026  -0.644  -6.014
  176   2HB   ARG  20          2HB       ARG  20   2.573   1.007  -6.286
  177   1HG   ARG  20          1HG       ARG  20   4.110  -1.426  -7.229
  178   2HG   ARG  20          2HG       ARG  20   2.939  -0.565  -8.228
  179   1HD   ARG  20          1HD       ARG  20   4.511   1.507  -7.314
  180   2HD   ARG  20          2HD       ARG  20   5.694   0.202  -7.512
  181    HE   ARG  20           HE       ARG  20   4.430  -0.093  -9.830
  182   1HH1  ARG  20          1HH2      ARG  20   6.847   1.605  -9.886
  183   2HH1  ARG  20          2HH2      ARG  20   6.265   3.094 -10.544
  184   1HH2  ARG  20          1HH1      ARG  20   2.912   2.341  -9.918
  185   2HH2  ARG  20          2HH1      ARG  20   4.005   3.516 -10.565
  186    H    SER  21           H        SER  21   2.817   1.864  -3.597
  187    HA   SER  21           HA       SER  21   4.894   3.816  -4.369
  188   1HB   SER  21          1HB       SER  21   2.238   3.921  -2.948
  189   2HB   SER  21          2HB       SER  21   3.295   5.326  -3.058
  190    HG   SER  21           HG       SER  21   1.598   4.542  -4.848
  191    H    ILE  22           H        ILE  22   4.473   1.663  -1.700
  192    HA   ILE  22           HA       ILE  22   6.079   3.443   0.085
  193    HB   ILE  22           HB       ILE  22   4.236   1.093   0.618
  194   1HG1  ILE  22          1HG1      ILE  22   4.095   3.971   1.570
  195   2HG1  ILE  22          2HG1      ILE  22   3.262   3.386   0.130
  196   1HG2  ILE  22          1HG2      ILE  22   6.098   2.598   2.468
  197   2HG2  ILE  22          2HG2      ILE  22   4.671   1.751   3.065
  198   3HG2  ILE  22          3HG2      ILE  22   5.950   0.855   2.252
  199   1HD1  ILE  22          1HD1      ILE  22   2.285   1.568   1.738
  200   2HD1  ILE  22          2HD1      ILE  22   2.762   2.691   3.013
  201   3HD1  ILE  22          3HD1      ILE  22   1.610   3.196   1.777
  202    H    LYS  23           H        LYS  23   5.849  -0.036  -0.897
  203    HA   LYS  23           HA       LYS  23   8.296  -0.887   0.263
  204   1HB   LYS  23          1HB       LYS  23   6.341  -2.188  -0.847
  205   2HB   LYS  23          2HB       LYS  23   7.215  -1.932  -2.355
  206   1HG   LYS  23          1HG       LYS  23   7.903  -4.069  -1.509
  207   2HG   LYS  23          2HG       LYS  23   9.243  -2.958  -1.243
  208   1HD   LYS  23          1HD       LYS  23   9.197  -3.435   0.948
  209   2HD   LYS  23          2HD       LYS  23   7.566  -2.792   1.051
  210   1HE   LYS  23          1HE       LYS  23   6.936  -4.897   1.619
  211   2HE   LYS  23          2HE       LYS  23   7.177  -5.312  -0.085
  212   1HZ   LYS  23          1HZ       LYS  23   9.415  -5.301   1.871
  213   2HZ   LYS  23          2HZ       LYS  23   8.476  -6.680   1.578
  214   3HZ   LYS  23          3HZ       LYS  23   9.374  -5.997   0.319
  215    H    THR  24           H        THR  24   7.698   0.410  -3.013
  216    HA   THR  24           HA       THR  24  10.367   0.211  -4.019
  217    HB   THR  24           HB       THR  24   8.310   2.338  -4.690
  218    HG1  THR  24           HG1      THR  24   7.057   0.799  -5.333
  219   1HG2  THR  24          1HG2      THR  24  10.537   0.979  -6.207
  220   2HG2  THR  24          2HG2      THR  24   9.241   1.863  -7.016
  221   3HG2  THR  24          3HG2      THR  24  10.317   2.702  -5.898
  222    H    LEU  25           H        LEU  25   8.743   2.675  -2.051
  223    HA   LEU  25           HA       LEU  25  10.883   4.649  -2.156
  224   1HB   LEU  25          1HB       LEU  25   8.222   4.647  -1.624
  225   2HB   LEU  25          2HB       LEU  25   8.875   4.697   0.008
  226    HG   LEU  25           HG       LEU  25  10.408   6.528  -1.527
  227   1HD1  LEU  25          1HD1      LEU  25   7.451   6.586  -2.107
  228   2HD1  LEU  25          2HD1      LEU  25   8.395   8.075  -2.104
  229   3HD1  LEU  25          3HD1      LEU  25   8.800   6.776  -3.225
  230   1HD2  LEU  25          1HD2      LEU  25   8.243   6.820   0.576
  231   2HD2  LEU  25          2HD2      LEU  25   9.989   6.832   0.821
  232   3HD2  LEU  25          3HD2      LEU  25   9.207   8.178  -0.005
  233    H    GLU  26           H        GLU  26  10.894   1.681  -0.543
  234    HA   GLU  26           HA       GLU  26  12.297   2.778   1.859
  235   1HB   GLU  26          1HB       GLU  26  10.586   0.415   1.260
  236   2HB   GLU  26          2HB       GLU  26  11.882   0.182   2.429
  237   1HG   GLU  26          1HG       GLU  26  10.270   2.647   2.785
  238   2HG   GLU  26          2HG       GLU  26   9.421   1.133   3.080
  239    H    HIS  27           H        HIS  27  12.513  -0.162  -0.189
  240    HA   HIS  27           HA       HIS  27  15.053  -1.054   0.383
  241   1HB   HIS  27          1HB       HIS  27  13.579  -1.008  -2.248
  242   2HB   HIS  27          2HB       HIS  27  15.052  -1.932  -1.985
  243    HD1  HIS  27           HD1      HIS  27  11.629  -2.487  -2.091
  244    HD2  HIS  27           HD2      HIS  27  14.518  -3.543   0.718
  245    HE1  HIS  27           HE1      HIS  27  10.669  -4.420  -0.765
  246    H    LYS  28           H        LYS  28  14.687   0.788  -2.682
  247    HA   LYS  28           HA       LYS  28  17.458   1.392  -2.962
  248   1HB   LYS  28          1HB       LYS  28  14.929   2.634  -4.051
  249   2HB   LYS  28          2HB       LYS  28  16.531   3.177  -4.537
  250   1HG   LYS  28          1HG       LYS  28  16.914   0.579  -4.963
  251   2HG   LYS  28          2HG       LYS  28  15.156   0.582  -5.112
  252   1HD   LYS  28          1HD       LYS  28  15.642   2.702  -6.650
  253   2HD   LYS  28          2HD       LYS  28  17.205   1.913  -6.839
  254   1HE   LYS  28          1HE       LYS  28  15.016  -0.005  -7.114
  255   2HE   LYS  28          2HE       LYS  28  14.879   1.321  -8.280
  256   1HZ   LYS  28          1HZ       LYS  28  17.354  -0.250  -7.775
  257   2HZ   LYS  28          2HZ       LYS  28  16.320  -0.455  -9.105
  258   3HZ   LYS  28          3HZ       LYS  28  17.174   0.995  -8.920
  259    H    ARG  29           H        ARG  29  14.818   3.342  -1.591
  260    HA   ARG  29           HA       ARG  29  16.164   5.781  -1.124
  261   1HB   ARG  29          1HB       ARG  29  13.750   5.396  -1.044
  262   2HB   ARG  29          2HB       ARG  29  13.945   4.399   0.391
  263   1HG   ARG  29          1HG       ARG  29  13.197   6.596   1.060
  264   2HG   ARG  29          2HG       ARG  29  14.863   6.390   1.593
  265   1HD   ARG  29          1HD       ARG  29  14.623   7.543  -1.116
  266   2HD   ARG  29          2HD       ARG  29  13.954   8.571   0.170
  267    HE   ARG  29           HE       ARG  29  16.752   7.502   0.176
  268   1HH1  ARG  29          1HH2      ARG  29  16.522  10.370  -0.347
  269   2HH1  ARG  29          2HH2      ARG  29  16.628  11.086   1.223
  270   1HH2  ARG  29          1HH1      ARG  29  15.920   8.083   2.879
  271   2HH2  ARG  29          2HH1      ARG  29  16.282   9.762   3.091
  272    H    GLU  30           H        GLU  30  16.087   2.852   0.948
  273    HA   GLU  30           HA       GLU  30  17.518   4.210   3.124
  274   1HB   GLU  30          1HB       GLU  30  16.595   1.375   2.608
  275   2HB   GLU  30          2HB       GLU  30  17.483   1.837   4.062
  276   1HG   GLU  30          1HG       GLU  30  15.760   3.481   4.634
  277   2HG   GLU  30          2HG       GLU  30  14.888   3.119   3.149
  278    H    ASN  31           H        ASN  31  18.367   1.528   0.849
  279    HA   ASN  31           HA       ASN  31  21.222   1.874   1.601
  280   1HB   ASN  31          1HB       ASN  31  19.988  -0.359   1.488
  281   2HB   ASN  31          2HB       ASN  31  20.003  -0.171  -0.267
  282   1HD2  ASN  31          2HD2      ASN  31  21.855  -1.018  -1.296
  283   2HD2  ASN  31          1HD2      ASN  31  23.338  -1.297  -0.519
  284    H    ALA  32           H        ALA  32  20.160   4.056   0.138
  285    HA   ALA  32           HA       ALA  32  20.544   3.924  -2.698
  286   1HB   ALA  32          1HB       ALA  32  20.765   6.214  -0.717
  287   2HB   ALA  32          2HB       ALA  32  20.681   6.414  -2.468
  288   3HB   ALA  32          3HB       ALA  32  19.319   5.717  -1.592
  289    H    LYS  33           H        LYS  33  22.776   5.029  -0.110
  290    HA   LYS  33           HA       LYS  33  25.117   3.997  -1.475
  291   1HB   LYS  33          1HB       LYS  33  24.273   6.306  -2.560
  292   2HB   LYS  33          2HB       LYS  33  25.214   6.974  -1.228
  293   1HG   LYS  33          1HG       LYS  33  26.793   4.904  -2.322
  294   2HG   LYS  33          2HG       LYS  33  26.144   5.793  -3.697
  295   1HD   LYS  33          1HD       LYS  33  27.745   7.334  -3.352
  296   2HD   LYS  33          2HD       LYS  33  26.905   7.782  -1.868
  297   1HE   LYS  33          1HE       LYS  33  28.247   6.289  -0.547
  298   2HE   LYS  33          2HE       LYS  33  28.933   5.524  -1.992
  299   1HZ   LYS  33          1HZ       LYS  33  29.255   8.387  -1.246
  300   2HZ   LYS  33          2HZ       LYS  33  30.440   7.191  -1.082
  301   3HZ   LYS  33          3HZ       LYS  33  29.907   7.640  -2.629
  302    H    GLU  34           H        GLU  34  24.279   6.688   0.718
  303    HA   GLU  34           HA       GLU  34  25.142   7.404   2.716
  304   1HB   GLU  34          1HB       GLU  34  24.537   5.907   4.452
  305   2HB   GLU  34          2HB       GLU  34  23.441   5.616   3.114
  306   1HG   GLU  34          1HG       GLU  34  24.242   3.495   2.757
  307   2HG   GLU  34          2HG       GLU  34  25.888   3.916   3.223
  Start of MODEL   10
    1   1H    CYS   1          1H        CYS   1 -14.852   3.607   8.524
    2   2H    CYS   1          2H        CYS   1 -15.956   4.856   8.204
    3   3H    CYS   1          3H        CYS   1 -16.322   3.681   9.369
    4    HA   CYS   1           HA       CYS   1 -16.459   1.962   7.700
    5   1HB   CYS   1          1HB       CYS   1 -18.035   4.504   7.477
    6   2HB   CYS   1          2HB       CYS   1 -18.333   3.224   6.305
    7    HG   CYS   1           HG       CYS   1 -19.274   1.744   8.111
    8    H    ALA   2           H        ALA   2 -16.277   5.096   5.933
    9    HA   ALA   2           HA       ALA   2 -15.369   5.671   3.879
   10   1HB   ALA   2          1HB       ALA   2 -13.341   5.269   5.210
   11   2HB   ALA   2          2HB       ALA   2 -13.366   3.565   4.756
   12   3HB   ALA   2          3HB       ALA   2 -13.083   4.800   3.531
   13    H    VAL   3           H        VAL   3 -17.492   3.985   3.568
   14    HA   VAL   3           HA       VAL   3 -16.709   1.955   1.506
   15    HB   VAL   3           HB       VAL   3 -18.898   1.002   1.959
   16   1HG1  VAL   3          1HG1      VAL   3 -16.916   0.473   3.449
   17   2HG1  VAL   3          2HG1      VAL   3 -17.593   1.604   4.622
   18   3HG1  VAL   3          3HG1      VAL   3 -18.497   0.162   4.162
   19   1HG2  VAL   3          1HG2      VAL   3 -19.440   3.616   2.989
   20   2HG2  VAL   3          2HG2      VAL   3 -20.564   2.285   2.757
   21   3HG2  VAL   3          3HG2      VAL   3 -19.705   2.458   4.291
   22    H    GLU   4           H        GLU   4 -17.048   4.966   1.102
   23    HA   GLU   4           HA       GLU   4 -17.939   6.446  -0.439
   24   1HB   GLU   4          1HB       GLU   4 -17.256   4.098  -1.663
   25   2HB   GLU   4          2HB       GLU   4 -18.925   4.290  -2.189
   26   1HG   GLU   4          1HG       GLU   4 -17.201   6.711  -2.320
   27   2HG   GLU   4          2HG       GLU   4 -16.856   5.428  -3.477
   28    H    LEU   5           H        LEU   5 -19.852   5.123   1.620
   29    HA   LEU   5           HA       LEU   5 -22.095   5.149   2.204
   30   1HB   LEU   5          1HB       LEU   5 -21.916   7.422   0.207
   31   2HB   LEU   5          2HB       LEU   5 -23.311   7.140   1.230
   32    HG   LEU   5           HG       LEU   5 -22.046   8.795   2.336
   33   1HD1  LEU   5          1HD1      LEU   5 -22.768   6.899   3.807
   34   2HD1  LEU   5          2HD1      LEU   5 -21.138   6.241   3.671
   35   3HD1  LEU   5          3HD1      LEU   5 -21.394   7.814   4.426
   36   1HD2  LEU   5          1HD2      LEU   5 -19.902   7.999   0.929
   37   2HD2  LEU   5          2HD2      LEU   5 -19.762   8.990   2.379
   38   3HD2  LEU   5          3HD2      LEU   5 -19.500   7.251   2.474
   39    H    ARG   6           H        ARG   6 -21.248   3.457  -0.167
   40    HA   ARG   6           HA       ARG   6 -23.933   2.739  -1.158
   41   1HB   ARG   6          1HB       ARG   6 -22.141   4.451  -2.536
   42   2HB   ARG   6          2HB       ARG   6 -22.039   2.896  -3.341
   43   1HG   ARG   6          1HG       ARG   6 -23.862   3.643  -4.485
   44   2HG   ARG   6          2HG       ARG   6 -24.744   3.131  -3.049
   45   1HD   ARG   6          1HD       ARG   6 -25.488   5.285  -2.981
   46   2HD   ARG   6          2HD       ARG   6 -23.888   5.661  -2.321
   47    HE   ARG   6           HE       ARG   6 -24.519   5.804  -5.251
   48   1HH1  ARG   6          1HH1      ARG   6 -21.654   5.787  -3.972
   49   2HH1  ARG   6          2HH1      ARG   6 -21.273   7.466  -4.069
   50   1HH2  ARG   6          1HH2      ARG   6 -24.569   8.432  -4.723
   51   2HH2  ARG   6          2HH2      ARG   6 -22.946   8.987  -4.508
   52    H    SER   7           H        SER   7 -20.436   2.168  -1.814
   53    HA   SER   7           HA       SER   7 -20.561  -0.614  -0.889
   54   1HB   SER   7          1HB       SER   7 -19.894  -1.489  -3.130
   55   2HB   SER   7          2HB       SER   7 -21.500  -0.785  -3.129
   56    HG   SER   7           HG       SER   7 -20.783   0.791  -4.403
   57    HA   PRO   8           HA       PRO   8 -16.349   0.548  -0.072
   58   1HB   PRO   8          1HB       PRO   8 -15.291  -1.910   0.462
   59   2HB   PRO   8          2HB       PRO   8 -16.361  -1.047   1.586
   60   1HG   PRO   8          1HG       PRO   8 -16.970  -3.296  -0.242
   61   2HG   PRO   8          2HG       PRO   8 -17.592  -2.951   1.380
   62   1HD   PRO   8          1HD       PRO   8 -18.972  -2.473  -0.928
   63   2HD   PRO   8          2HD       PRO   8 -19.251  -1.616   0.603
   64    H    GLY   9           H        GLY   9 -16.413   1.024  -2.549
   65   1HA   GLY   9          1HA       GLY   9 -14.704  -0.845  -4.117
   66   2HA   GLY   9          2HA       GLY   9 -15.752   0.401  -4.800
   67    H    ILE  10           H        ILE  10 -12.937   0.089  -5.319
   68    HA   ILE  10           HA       ILE  10 -11.149   1.428  -5.791
   69    HB   ILE  10           HB       ILE  10 -13.183   3.238  -5.316
   70   1HG1  ILE  10          1HG1      ILE  10 -10.333   3.525  -6.254
   71   2HG1  ILE  10          2HG1      ILE  10 -11.790   3.325  -7.225
   72   1HG2  ILE  10          1HG2      ILE  10 -12.285   3.670  -2.999
   73   2HG2  ILE  10          2HG2      ILE  10 -10.789   4.229  -3.745
   74   3HG2  ILE  10          3HG2      ILE  10 -12.300   5.087  -4.040
   75   1HD1  ILE  10          1HD1      ILE  10 -12.559   5.562  -6.178
   76   2HD1  ILE  10          2HD1      ILE  10 -10.871   5.763  -5.708
   77   3HD1  ILE  10          3HD1      ILE  10 -11.299   5.629  -7.415
   78    H    SER  11           H        SER  11 -12.217   1.700  -2.416
   79    HA   SER  11           HA       SER  11  -9.583   2.048  -1.305
   80   1HB   SER  11          1HB       SER  11 -11.889   2.646  -0.382
   81   2HB   SER  11          2HB       SER  11 -12.047   0.947   0.057
   82    HG   SER  11           HG       SER  11 -11.095   2.534   1.652
   83    H    ARG  12           H        ARG  12 -11.592  -0.821  -1.973
   84    HA   ARG  12           HA       ARG  12 -10.055  -2.761  -0.538
   85   1HB   ARG  12          1HB       ARG  12 -12.140  -2.681  -2.593
   86   2HB   ARG  12          2HB       ARG  12 -11.030  -4.025  -2.841
   87   1HG   ARG  12          1HG       ARG  12 -12.026  -3.538  -0.063
   88   2HG   ARG  12          2HG       ARG  12 -13.140  -4.244  -1.229
   89   1HD   ARG  12          1HD       ARG  12 -11.868  -6.183  -1.491
   90   2HD   ARG  12          2HD       ARG  12 -10.366  -5.394  -0.971
   91    HE   ARG  12           HE       ARG  12 -12.602  -6.113   0.882
   92   1HH1  ARG  12          1HH1      ARG  12 -10.947  -3.954   1.984
   93   2HH1  ARG  12          2HH1      ARG  12  -9.690  -4.799   2.821
   94   1HH2  ARG  12          1HH2      ARG  12 -10.291  -7.817   1.157
   95   2HH2  ARG  12          2HH2      ARG  12  -9.308  -7.027   2.338
   96    H    PHE  13           H        PHE  13  -9.725  -1.448  -3.825
   97    HA   PHE  13           HA       PHE  13  -7.429  -3.105  -4.518
   98   1HB   PHE  13          1HB       PHE  13  -8.371  -2.590  -6.489
   99   2HB   PHE  13          2HB       PHE  13  -9.358  -1.344  -5.759
  100    HD1  PHE  13           HD1      PHE  13  -6.122  -2.067  -7.422
  101    HD2  PHE  13           HD2      PHE  13  -8.757   0.985  -5.940
  102    HE1  PHE  13           HE1      PHE  13  -4.797  -0.341  -8.609
  103    HE2  PHE  13           HE2      PHE  13  -7.433   2.708  -7.127
  104    HZ   PHE  13           HZ       PHE  13  -5.455   2.048  -8.460
  105    H    ARG  14           H        ARG  14  -7.895   0.094  -3.090
  106    HA   ARG  14           HA       ARG  14  -5.404   1.313  -3.570
  107   1HB   ARG  14          1HB       ARG  14  -7.496   1.450  -1.443
  108   2HB   ARG  14          2HB       ARG  14  -5.961   2.264  -1.142
  109   1HG   ARG  14          1HG       ARG  14  -6.173   3.541  -3.200
  110   2HG   ARG  14          2HG       ARG  14  -7.630   2.659  -3.639
  111   1HD   ARG  14          1HD       ARG  14  -8.622   4.524  -2.695
  112   2HD   ARG  14          2HD       ARG  14  -8.419   3.571  -1.217
  113    HE   ARG  14           HE       ARG  14  -5.992   4.961  -1.584
  114   1HH1  ARG  14          1HH1      ARG  14  -7.712   7.156  -2.599
  115   2HH1  ARG  14          2HH1      ARG  14  -8.133   8.009  -1.155
  116   1HH2  ARG  14          1HH2      ARG  14  -7.222   5.369   0.950
  117   2HH2  ARG  14          2HH2      ARG  14  -7.849   6.980   0.890
  118    H    ARG  15           H        ARG  15  -6.119  -1.335  -1.321
  119    HA   ARG  15           HA       ARG  15  -3.855  -1.192   0.391
  120   1HB   ARG  15          1HB       ARG  15  -5.764  -3.265  -0.568
  121   2HB   ARG  15          2HB       ARG  15  -4.252  -3.865   0.107
  122   1HG   ARG  15          1HG       ARG  15  -5.630  -1.719   1.644
  123   2HG   ARG  15          2HG       ARG  15  -6.405  -3.302   1.627
  124   1HD   ARG  15          1HD       ARG  15  -4.714  -4.305   2.831
  125   2HD   ARG  15          2HD       ARG  15  -3.458  -3.264   2.134
  126    HE   ARG  15           HE       ARG  15  -4.094  -1.503   3.671
  127   1HH1  ARG  15          1HH2      ARG  15  -3.876  -3.951   5.467
  128   2HH1  ARG  15          2HH2      ARG  15  -5.305  -3.803   6.426
  129   1HH2  ARG  15          1HH1      ARG  15  -6.803  -1.494   4.274
  130   2HH2  ARG  15          2HH1      ARG  15  -6.988  -2.387   5.742
  131    H    LYS  16           H        LYS  16  -4.215  -2.731  -2.822
  132    HA   LYS  16           HA       LYS  16  -1.523  -3.776  -2.965
  133   1HB   LYS  16          1HB       LYS  16  -3.562  -4.522  -4.282
  134   2HB   LYS  16          2HB       LYS  16  -3.402  -3.049  -5.233
  135   1HG   LYS  16          1HG       LYS  16  -2.247  -4.642  -6.517
  136   2HG   LYS  16          2HG       LYS  16  -0.961  -3.817  -5.642
  137   1HD   LYS  16          1HD       LYS  16  -1.617  -5.815  -3.877
  138   2HD   LYS  16          2HD       LYS  16  -1.895  -6.606  -5.430
  139   1HE   LYS  16          1HE       LYS  16   0.408  -5.775  -6.145
  140   2HE   LYS  16          2HE       LYS  16   0.675  -5.325  -4.450
  141   1HZ   LYS  16          1HZ       LYS  16  -0.109  -8.031  -5.402
  142   2HZ   LYS  16          2HZ       LYS  16   1.449  -7.579  -4.905
  143   3HZ   LYS  16          3HZ       LYS  16   0.166  -7.590  -3.789
  144    H    ILE  17           H        ILE  17  -3.024  -0.684  -3.913
  145    HA   ILE  17           HA       ILE  17  -0.849   0.365  -5.457
  146    HB   ILE  17           HB       ILE  17  -2.950   1.717  -3.724
  147   1HG1  ILE  17          1HG1      ILE  17  -3.962   0.415  -5.515
  148   2HG1  ILE  17          2HG1      ILE  17  -4.085   2.125  -5.911
  149   1HG2  ILE  17          1HG2      ILE  17  -0.954   2.855  -5.667
  150   2HG2  ILE  17          2HG2      ILE  17  -2.498   3.658  -5.380
  151   3HG2  ILE  17          3HG2      ILE  17  -1.370   3.414  -4.047
  152   1HD1  ILE  17          1HD1      ILE  17  -1.692   1.496  -7.083
  153   2HD1  ILE  17          2HD1      ILE  17  -2.574  -0.020  -7.270
  154   3HD1  ILE  17          3HD1      ILE  17  -3.244   1.475  -7.920
  155    H    ALA  18           H        ALA  18  -1.567   0.421  -1.958
  156    HA   ALA  18           HA       ALA  18   0.694   2.025  -1.163
  157   1HB   ALA  18          1HB       ALA  18  -1.284   0.171   0.117
  158   2HB   ALA  18          2HB       ALA  18   0.175   0.558   1.031
  159   3HB   ALA  18          3HB       ALA  18  -0.908   1.848   0.511
  160    H    LYS  19           H        LYS  19   0.227  -1.484  -1.642
  161    HA   LYS  19           HA       LYS  19   2.788  -2.319  -0.628
  162   1HB   LYS  19          1HB       LYS  19   0.521  -3.572  -1.332
  163   2HB   LYS  19          2HB       LYS  19   1.422  -3.815  -2.828
  164   1HG   LYS  19          1HG       LYS  19   3.104  -5.059  -1.769
  165   2HG   LYS  19          2HG       LYS  19   2.715  -4.413  -0.175
  166   1HD   LYS  19          1HD       LYS  19   0.364  -5.619  -0.749
  167   2HD   LYS  19          2HD       LYS  19   1.455  -6.651  -1.673
  168   1HE   LYS  19          1HE       LYS  19   2.884  -6.580   0.581
  169   2HE   LYS  19          2HE       LYS  19   1.295  -6.246   1.291
  170   1HZ   LYS  19          1HZ       LYS  19   1.907  -8.513  -0.541
  171   2HZ   LYS  19          2HZ       LYS  19   1.711  -8.628   1.140
  172   3HZ   LYS  19          3HZ       LYS  19   0.399  -8.184   0.162
  173    H    ARG  20           H        ARG  20   1.963  -0.613  -3.518
  174    HA   ARG  20           HA       ARG  20   4.363  -1.493  -5.022
  175   1HB   ARG  20          1HB       ARG  20   1.885   0.153  -5.553
  176   2HB   ARG  20          2HB       ARG  20   3.270   0.265  -6.638
  177   1HG   ARG  20          1HG       ARG  20   2.886  -2.489  -6.203
  178   2HG   ARG  20          2HG       ARG  20   1.272  -1.823  -6.439
  179   1HD   ARG  20          1HD       ARG  20   3.083  -0.650  -8.373
  180   2HD   ARG  20          2HD       ARG  20   3.170  -2.419  -8.453
  181    HE   ARG  20           HE       ARG  20   0.690  -2.447  -8.677
  182   1HH1  ARG  20          1HH1      ARG  20   0.387   0.484  -7.804
  183   2HH1  ARG  20          2HH1      ARG  20   0.001   1.239  -9.312
  184   1HH2  ARG  20          1HH2      ARG  20   1.061  -1.485 -11.223
  185   2HH2  ARG  20          2HH2      ARG  20   0.389   0.106 -11.277
  186    H    SER  21           H        SER  21   2.940   1.386  -3.426
  187    HA   SER  21           HA       SER  21   5.116   3.181  -4.058
  188   1HB   SER  21          1HB       SER  21   2.640   3.593  -3.238
  189   2HB   SER  21          2HB       SER  21   3.377   3.504  -1.638
  190    HG   SER  21           HG       SER  21   3.723   5.582  -2.144
  191    H    ILE  22           H        ILE  22   4.676   0.769  -1.511
  192    HA   ILE  22           HA       ILE  22   6.495   1.798   0.417
  193    HB   ILE  22           HB       ILE  22   4.824  -0.120   0.615
  194   1HG1  ILE  22          1HG1      ILE  22   7.592  -0.828   1.607
  195   2HG1  ILE  22          2HG1      ILE  22   6.677   0.530   2.264
  196   1HG2  ILE  22          1HG2      ILE  22   5.603  -1.396  -1.375
  197   2HG2  ILE  22          2HG2      ILE  22   7.100  -1.764  -0.520
  198   3HG2  ILE  22          3HG2      ILE  22   5.560  -2.367   0.095
  199   1HD1  ILE  22          1HD1      ILE  22   4.781  -1.081   2.722
  200   2HD1  ILE  22          2HD1      ILE  22   5.879  -2.390   2.284
  201   3HD1  ILE  22          3HD1      ILE  22   6.238  -1.368   3.675
  202    H    LYS  23           H        LYS  23   7.116  -0.206  -2.472
  203    HA   LYS  23           HA       LYS  23   9.916  -0.678  -2.041
  204   1HB   LYS  23          1HB       LYS  23   8.345  -1.775  -3.706
  205   2HB   LYS  23          2HB       LYS  23   8.419  -0.294  -4.661
  206   1HG   LYS  23          1HG       LYS  23  11.047  -0.715  -4.417
  207   2HG   LYS  23          2HG       LYS  23  10.512  -2.382  -4.220
  208   1HD   LYS  23          1HD       LYS  23   9.421  -0.735  -6.488
  209   2HD   LYS  23          2HD       LYS  23  11.021  -1.450  -6.624
  210   1HE   LYS  23          1HE       LYS  23   9.796  -3.213  -7.472
  211   2HE   LYS  23          2HE       LYS  23   9.672  -3.629  -5.755
  212   1HZ   LYS  23          1HZ       LYS  23   7.734  -1.838  -7.125
  213   2HZ   LYS  23          2HZ       LYS  23   7.497  -3.514  -6.966
  214   3HZ   LYS  23          3HZ       LYS  23   7.597  -2.542  -5.584
  215    H    THR  24           H        THR  24   8.101   2.014  -3.516
  216    HA   THR  24           HA       THR  24  10.387   3.512  -4.457
  217    HB   THR  24           HB       THR  24   7.669   4.556  -3.561
  218    HG1  THR  24           HG1      THR  24   6.977   3.197  -5.023
  219   1HG2  THR  24          1HG2      THR  24   9.653   6.094  -4.304
  220   2HG2  THR  24          2HG2      THR  24   9.247   5.522  -5.923
  221   3HG2  THR  24          3HG2      THR  24   8.042   6.374  -4.960
  222    H    LEU  25           H        LEU  25   8.459   3.485  -1.468
  223    HA   LEU  25           HA       LEU  25   9.748   5.609  -0.053
  224   1HB   LEU  25          1HB       LEU  25   7.704   3.651   0.339
  225   2HB   LEU  25          2HB       LEU  25   8.812   3.522   1.698
  226    HG   LEU  25           HG       LEU  25   8.644   6.139   1.749
  227   1HD1  LEU  25          1HD1      LEU  25   6.171   5.317   0.195
  228   2HD1  LEU  25          2HD1      LEU  25   6.325   6.856   1.041
  229   3HD1  LEU  25          3HD1      LEU  25   7.406   6.476  -0.297
  230   1HD2  LEU  25          1HD2      LEU  25   7.754   4.429   3.424
  231   2HD2  LEU  25          2HD2      LEU  25   6.878   5.957   3.362
  232   3HD2  LEU  25          3HD2      LEU  25   6.212   4.528   2.573
  233    H    GLU  26           H        GLU  26  10.190   2.054   0.358
  234    HA   GLU  26           HA       GLU  26  12.461   2.202   2.054
  235   1HB   GLU  26          1HB       GLU  26  12.781  -0.180   1.434
  236   2HB   GLU  26          2HB       GLU  26  11.118   0.200   1.845
  237   1HG   GLU  26          1HG       GLU  26  10.622  -0.886  -0.067
  238   2HG   GLU  26          2HG       GLU  26  11.107   0.601  -0.856
  239    H    HIS  27           H        HIS  27  12.308   2.214  -1.508
  240    HA   HIS  27           HA       HIS  27  15.091   1.816  -2.023
  241   1HB   HIS  27          1HB       HIS  27  13.205   1.735  -3.665
  242   2HB   HIS  27          2HB       HIS  27  13.056   3.480  -3.541
  243    HD1  HIS  27           HD1      HIS  27  16.596   2.613  -3.458
  244    HD2  HIS  27           HD2      HIS  27  13.727   3.096  -6.446
  245    HE1  HIS  27           HE1      HIS  27  17.862   2.931  -5.617
  246    H    LYS  28           H        LYS  28  13.232   4.706  -1.112
  247    HA   LYS  28           HA       LYS  28  15.471   6.562  -1.472
  248   1HB   LYS  28          1HB       LYS  28  12.612   6.634  -0.795
  249   2HB   LYS  28          2HB       LYS  28  13.563   7.754   0.174
  250   1HG   LYS  28          1HG       LYS  28  13.290   9.130  -1.617
  251   2HG   LYS  28          2HG       LYS  28  14.652   8.223  -2.268
  252   1HD   LYS  28          1HD       LYS  28  11.875   7.165  -2.685
  253   2HD   LYS  28          2HD       LYS  28  12.440   8.504  -3.681
  254   1HE   LYS  28          1HE       LYS  28  14.117   7.231  -4.697
  255   2HE   LYS  28          2HE       LYS  28  14.186   6.066  -3.363
  256   1HZ   LYS  28          1HZ       LYS  28  11.821   6.423  -5.129
  257   2HZ   LYS  28          2HZ       LYS  28  13.000   5.226  -5.349
  258   3HZ   LYS  28          3HZ       LYS  28  12.042   5.227  -3.936
  259    H    ARG  29           H        ARG  29  13.908   4.828   1.218
  260    HA   ARG  29           HA       ARG  29  15.344   6.042   3.377
  261   1HB   ARG  29          1HB       ARG  29  13.240   4.448   3.218
  262   2HB   ARG  29          2HB       ARG  29  14.451   3.194   3.486
  263   1HG   ARG  29          1HG       ARG  29  15.121   5.173   5.335
  264   2HG   ARG  29          2HG       ARG  29  13.361   5.147   5.362
  265   1HD   ARG  29          1HD       ARG  29  13.320   3.161   6.450
  266   2HD   ARG  29          2HD       ARG  29  14.492   2.441   5.330
  267    HE   ARG  29           HE       ARG  29  15.436   4.335   7.443
  268   1HH1  ARG  29          1HH2      ARG  29  14.922   1.322   8.086
  269   2HH1  ARG  29          2HH2      ARG  29  16.532   0.707   7.956
  270   1HH2  ARG  29          1HH1      ARG  29  17.734   3.552   6.300
  271   2HH2  ARG  29          2HH1      ARG  29  18.157   1.995   6.927
  272    H    GLU  30           H        GLU  30  16.506   3.752   1.003
  273    HA   GLU  30           HA       GLU  30  18.566   2.614   2.761
  274   1HB   GLU  30          1HB       GLU  30  17.272   1.606   0.695
  275   2HB   GLU  30          2HB       GLU  30  18.560   2.383  -0.229
  276   1HG   GLU  30          1HG       GLU  30  19.764   1.056   2.001
  277   2HG   GLU  30          2HG       GLU  30  18.668  -0.080   1.222
  278    H    ASN  31           H        ASN  31  18.446   5.076   0.155
  279    HA   ASN  31           HA       ASN  31  21.352   5.647   0.584
  280   1HB   ASN  31          1HB       ASN  31  20.101   5.112  -1.681
  281   2HB   ASN  31          2HB       ASN  31  19.652   6.812  -1.600
  282   1HD2  ASN  31          2HD2      ASN  31  21.667   8.356  -1.199
  283   2HD2  ASN  31          1HD2      ASN  31  23.093   7.922  -2.014
  284    H    ALA  32           H        ALA  32  19.653   6.550   2.650
  285    HA   ALA  32           HA       ALA  32  19.151   9.441   2.127
  286   1HB   ALA  32          1HB       ALA  32  17.571   7.614   3.201
  287   2HB   ALA  32          2HB       ALA  32  18.476   7.994   4.666
  288   3HB   ALA  32          3HB       ALA  32  17.581   9.262   3.828
  289    H    LYS  33           H        LYS  33  19.420  10.250   4.881
  290    HA   LYS  33           HA       LYS  33  22.395  10.256   5.149
  291   1HB   LYS  33          1HB       LYS  33  22.106  12.430   6.198
  292   2HB   LYS  33          2HB       LYS  33  21.247  12.412   4.666
  293   1HG   LYS  33          1HG       LYS  33  19.140  11.863   6.001
  294   2HG   LYS  33          2HG       LYS  33  20.077  12.207   7.452
  295   1HD   LYS  33          1HD       LYS  33  20.415  14.475   6.834
  296   2HD   LYS  33          2HD       LYS  33  19.882  14.188   5.178
  297   1HE   LYS  33          1HE       LYS  33  17.981  13.667   7.458
  298   2HE   LYS  33          2HE       LYS  33  18.215  15.317   6.862
  299   1HZ   LYS  33          1HZ       LYS  33  17.792  13.157   4.902
  300   2HZ   LYS  33          2HZ       LYS  33  16.457  13.773   5.746
  301   3HZ   LYS  33          3HZ       LYS  33  17.401  14.809   4.800
  302    H    GLU  34           H        GLU  34  21.062   8.014   6.151
  303    HA   GLU  34           HA       GLU  34  20.793   8.397   9.087
  304   1HB   GLU  34          1HB       GLU  34  19.854   6.483   7.014
  305   2HB   GLU  34          2HB       GLU  34  20.216   5.786   8.587
  306   1HG   GLU  34          1HG       GLU  34  18.414   6.739   9.559
  307   2HG   GLU  34          2HG       GLU  34  18.682   8.284   8.763
  Start of MODEL   11
    1   1H    CYS   1          1H        CYS   1 -22.186   7.818  -6.464
    2   2H    CYS   1          2H        CYS   1 -22.644   9.284  -5.750
    3   3H    CYS   1          3H        CYS   1 -23.064   8.958  -7.357
    4    HA   CYS   1           HA       CYS   1 -20.893   9.212  -8.150
    5   1HB   CYS   1          1HB       CYS   1 -21.595  11.193  -5.984
    6   2HB   CYS   1          2HB       CYS   1 -20.226  11.424  -7.068
    7    HG   CYS   1           HG       CYS   1 -21.796  11.759  -9.030
    8    H    ALA   2           H        ALA   2 -20.813   9.145  -4.552
    9    HA   ALA   2           HA       ALA   2 -17.903   8.797  -4.530
   10   1HB   ALA   2          1HB       ALA   2 -20.019   8.755  -2.362
   11   2HB   ALA   2          2HB       ALA   2 -18.282   8.711  -2.063
   12   3HB   ALA   2          3HB       ALA   2 -19.010  10.128  -2.819
   13    H    VAL   3           H        VAL   3 -17.038   6.970  -3.077
   14    HA   VAL   3           HA       VAL   3 -16.466   4.742  -2.933
   15    HB   VAL   3           HB       VAL   3 -18.026   3.426  -1.803
   16   1HG1  VAL   3          1HG1      VAL   3 -17.348   5.490  -0.597
   17   2HG1  VAL   3          2HG1      VAL   3 -18.816   6.280  -1.176
   18   3HG1  VAL   3          3HG1      VAL   3 -18.929   4.891  -0.094
   19   1HG2  VAL   3          1HG2      VAL   3 -19.867   3.817  -3.583
   20   2HG2  VAL   3          2HG2      VAL   3 -20.374   3.554  -1.919
   21   3HG2  VAL   3          3HG2      VAL   3 -20.342   5.188  -2.584
   22    H    GLU   4           H        GLU   4 -17.601   5.607  -5.724
   23    HA   GLU   4           HA       GLU   4 -17.907   4.630  -7.784
   24   1HB   GLU   4          1HB       GLU   4 -16.098   3.028  -6.324
   25   2HB   GLU   4          2HB       GLU   4 -17.185   1.907  -7.143
   26   1HG   GLU   4          1HG       GLU   4 -15.633   2.237  -8.817
   27   2HG   GLU   4          2HG       GLU   4 -16.761   3.536  -9.200
   28    H    LEU   5           H        LEU   5 -20.048   4.365  -5.562
   29    HA   LEU   5           HA       LEU   5 -22.164   3.506  -5.290
   30   1HB   LEU   5          1HB       LEU   5 -21.692   3.134  -8.247
   31   2HB   LEU   5          2HB       LEU   5 -23.244   2.819  -7.495
   32    HG   LEU   5           HG       LEU   5 -23.384   5.027  -8.323
   33   1HD1  LEU   5          1HD1      LEU   5 -23.982   4.643  -5.818
   34   2HD1  LEU   5          2HD1      LEU   5 -22.569   5.648  -5.502
   35   3HD1  LEU   5          3HD1      LEU   5 -23.916   6.289  -6.442
   36   1HD2  LEU   5          1HD2      LEU   5 -20.740   5.155  -8.410
   37   2HD2  LEU   5          2HD2      LEU   5 -21.704   6.628  -8.330
   38   3HD2  LEU   5          3HD2      LEU   5 -20.943   5.992  -6.874
   39    H    ARG   6           H        ARG   6 -19.669   1.456  -5.457
   40    HA   ARG   6           HA       ARG   6 -21.051  -0.847  -4.469
   41   1HB   ARG   6          1HB       ARG   6 -21.452  -0.659  -7.091
   42   2HB   ARG   6          2HB       ARG   6 -19.832  -1.340  -7.160
   43   1HG   ARG   6          1HG       ARG   6 -20.822  -3.355  -6.950
   44   2HG   ARG   6          2HG       ARG   6 -21.079  -2.931  -5.261
   45   1HD   ARG   6          1HD       ARG   6 -23.115  -1.766  -7.033
   46   2HD   ARG   6          2HD       ARG   6 -23.091  -3.537  -7.071
   47    HE   ARG   6           HE       ARG   6 -23.472  -3.569  -4.672
   48   1HH1  ARG   6          1HH2      ARG   6 -25.333  -1.375  -6.002
   49   2HH1  ARG   6          2HH2      ARG   6 -25.313  -0.189  -4.745
   50   1HH2  ARG   6          1HH1      ARG   6 -22.625  -1.660  -3.070
   51   2HH2  ARG   6          2HH1      ARG   6 -23.754  -0.352  -3.061
   52    H    SER   7           H        SER   7 -18.690   0.773  -3.757
   53    HA   SER   7           HA       SER   7 -16.613  -1.369  -3.693
   54   1HB   SER   7          1HB       SER   7 -16.574   0.897  -5.366
   55   2HB   SER   7          2HB       SER   7 -15.478   1.277  -4.048
   56    HG   SER   7           HG       SER   7 -15.074  -0.322  -6.123
   57    HA   PRO   8           HA       PRO   8 -16.189   0.058   0.481
   58   1HB   PRO   8          1HB       PRO   8 -13.674  -0.809   1.053
   59   2HB   PRO   8          2HB       PRO   8 -15.064  -1.893   0.861
   60   1HG   PRO   8          1HG       PRO   8 -12.802  -1.410  -0.939
   61   2HG   PRO   8          2HG       PRO   8 -13.833  -2.836  -0.768
   62   1HD   PRO   8          1HD       PRO   8 -13.978  -0.878  -2.775
   63   2HD   PRO   8          2HD       PRO   8 -15.143  -2.179  -2.460
   64    H    GLY   9           H        GLY   9 -15.844   2.265  -1.224
   65   1HA   GLY   9          1HA       GLY   9 -14.924   4.390  -1.367
   66   2HA   GLY   9          2HA       GLY   9 -14.448   4.156   0.312
   67    H    ILE  10           H        ILE  10 -13.286   2.218  -2.421
   68    HA   ILE  10           HA       ILE  10 -11.198   1.789  -3.246
   69    HB   ILE  10           HB       ILE  10 -11.229   4.753  -2.761
   70   1HG1  ILE  10          1HG1      ILE  10 -11.190   4.881  -5.096
   71   2HG1  ILE  10          2HG1      ILE  10 -10.363   3.340  -5.268
   72   1HG2  ILE  10          1HG2      ILE  10  -8.761   3.108  -3.242
   73   2HG2  ILE  10          2HG2      ILE  10  -8.899   4.715  -3.961
   74   3HG2  ILE  10          3HG2      ILE  10  -8.971   4.519  -2.206
   75   1HD1  ILE  10          1HD1      ILE  10 -13.210   3.585  -4.274
   76   2HD1  ILE  10          2HD1      ILE  10 -12.791   3.334  -5.970
   77   3HD1  ILE  10          3HD1      ILE  10 -12.367   2.117  -4.767
   78    H    SER  11           H        SER  11 -10.729   0.305  -1.815
   79    HA   SER  11           HA       SER  11  -8.641   0.940   0.142
   80   1HB   SER  11          1HB       SER  11 -11.264   0.737   0.953
   81   2HB   SER  11          2HB       SER  11 -10.686  -0.903   1.212
   82    HG   SER  11           HG       SER  11 -10.383   0.786   2.943
   83    H    ARG  12           H        ARG  12 -10.674  -1.760  -1.065
   84    HA   ARG  12           HA       ARG  12  -8.648  -3.798  -0.787
   85   1HB   ARG  12          1HB       ARG  12 -11.281  -3.862  -1.171
   86   2HB   ARG  12          2HB       ARG  12 -10.814  -3.907  -2.870
   87   1HG   ARG  12          1HG       ARG  12  -9.129  -5.783  -1.890
   88   2HG   ARG  12          2HG       ARG  12 -10.466  -5.960  -0.754
   89   1HD   ARG  12          1HD       ARG  12 -12.036  -6.379  -2.546
   90   2HD   ARG  12          2HD       ARG  12 -10.816  -5.988  -3.773
   91    HE   ARG  12           HE       ARG  12  -9.533  -7.962  -2.447
   92   1HH1  ARG  12          1HH1      ARG  12 -11.975  -9.036  -1.232
   93   2HH1  ARG  12          2HH1      ARG  12 -12.572 -10.136  -2.424
   94   1HH2  ARG  12          1HH2      ARG  12 -10.635  -8.775  -4.995
   95   2HH2  ARG  12          2HH2      ARG  12 -11.801  -9.986  -4.591
   96    H    PHE  13           H        PHE  13  -9.246  -1.304  -3.163
   97    HA   PHE  13           HA       PHE  13  -7.479  -2.513  -5.203
   98   1HB   PHE  13          1HB       PHE  13  -9.262  -1.673  -6.333
   99   2HB   PHE  13          2HB       PHE  13  -9.720  -0.613  -5.020
  100    HD1  PHE  13           HD1      PHE  13  -7.492  -0.959  -7.987
  101    HD2  PHE  13           HD2      PHE  13  -9.121   1.693  -5.025
  102    HE1  PHE  13           HE1      PHE  13  -6.642   0.991  -9.261
  103    HE2  PHE  13           HE2      PHE  13  -8.270   3.640  -6.298
  104    HZ   PHE  13           HZ       PHE  13  -7.032   3.292  -8.414
  105    H    ARG  14           H        ARG  14  -7.656   0.429  -3.088
  106    HA   ARG  14           HA       ARG  14  -5.218   1.554  -4.093
  107   1HB   ARG  14          1HB       ARG  14  -5.223   2.886  -1.967
  108   2HB   ARG  14          2HB       ARG  14  -6.700   2.986  -2.907
  109   1HG   ARG  14          1HG       ARG  14  -7.540   2.697  -0.768
  110   2HG   ARG  14          2HG       ARG  14  -7.495   1.036  -1.327
  111   1HD   ARG  14          1HD       ARG  14  -6.371   0.654   0.617
  112   2HD   ARG  14          2HD       ARG  14  -4.970   1.335  -0.231
  113    HE   ARG  14           HE       ARG  14  -6.736   2.833   1.638
  114   1HH1  ARG  14          1HH2      ARG  14  -3.876   2.596   2.279
  115   2HH1  ARG  14          2HH2      ARG  14  -3.199   4.066   1.668
  116   1HH2  ARG  14          1HH1      ARG  14  -5.979   4.740  -0.358
  117   2HH2  ARG  14          2HH1      ARG  14  -4.420   5.312   0.133
  118    H    ARG  15           H        ARG  15  -5.720  -0.966  -1.674
  119    HA   ARG  15           HA       ARG  15  -3.190  -0.843  -0.361
  120   1HB   ARG  15          1HB       ARG  15  -5.314  -2.215   0.159
  121   2HB   ARG  15          2HB       ARG  15  -4.686  -3.385  -1.004
  122   1HG   ARG  15          1HG       ARG  15  -2.949  -4.021   0.347
  123   2HG   ARG  15          2HG       ARG  15  -2.767  -2.416   1.052
  124   1HD   ARG  15          1HD       ARG  15  -5.245  -3.139   2.003
  125   2HD   ARG  15          2HD       ARG  15  -4.390  -4.694   1.993
  126    HE   ARG  15           HE       ARG  15  -3.598  -2.312   3.560
  127   1HH1  ARG  15          1HH1      ARG  15  -1.142  -3.469   2.375
  128   2HH1  ARG  15          2HH1      ARG  15  -0.675  -4.667   3.532
  129   1HH2  ARG  15          1HH2      ARG  15  -3.807  -4.724   5.086
  130   2HH2  ARG  15          2HH2      ARG  15  -2.211  -5.387   5.094
  131    H    LYS  16           H        LYS  16  -4.152  -2.514  -3.382
  132    HA   LYS  16           HA       LYS  16  -1.594  -3.796  -3.806
  133   1HB   LYS  16          1HB       LYS  16  -3.914  -4.344  -4.788
  134   2HB   LYS  16          2HB       LYS  16  -3.625  -3.025  -5.921
  135   1HG   LYS  16          1HG       LYS  16  -1.412  -4.979  -5.657
  136   2HG   LYS  16          2HG       LYS  16  -2.890  -5.607  -6.381
  137   1HD   LYS  16          1HD       LYS  16  -2.381  -4.600  -8.322
  138   2HD   LYS  16          2HD       LYS  16  -2.408  -3.034  -7.521
  139   1HE   LYS  16          1HE       LYS  16  -0.223  -3.212  -8.462
  140   2HE   LYS  16          2HE       LYS  16  -0.004  -3.571  -6.743
  141   1HZ   LYS  16          1HZ       LYS  16  -0.585  -5.738  -8.675
  142   2HZ   LYS  16          2HZ       LYS  16   0.996  -5.178  -8.443
  143   3HZ   LYS  16          3HZ       LYS  16   0.131  -5.844  -7.142
  144    H    ILE  17           H        ILE  17  -3.059  -0.818  -5.154
  145    HA   ILE  17           HA       ILE  17  -0.797  -0.021  -6.726
  146    HB   ILE  17           HB       ILE  17  -3.245   1.291  -5.547
  147   1HG1  ILE  17          1HG1      ILE  17  -3.279   1.842  -8.172
  148   2HG1  ILE  17          2HG1      ILE  17  -2.222   0.432  -8.216
  149   1HG2  ILE  17          1HG2      ILE  17  -0.999   2.754  -6.963
  150   2HG2  ILE  17          2HG2      ILE  17  -2.628   3.399  -6.761
  151   3HG2  ILE  17          3HG2      ILE  17  -1.623   3.080  -5.347
  152   1HD1  ILE  17          1HD1      ILE  17  -4.934   0.494  -6.864
  153   2HD1  ILE  17          2HD1      ILE  17  -4.645  -0.130  -8.487
  154   3HD1  ILE  17          3HD1      ILE  17  -3.906  -0.920  -7.096
  155    H    ALA  18           H        ALA  18  -1.630   0.417  -3.308
  156    HA   ALA  18           HA       ALA  18   0.536   2.249  -2.690
  157   1HB   ALA  18          1HB       ALA  18  -1.588   2.044  -1.400
  158   2HB   ALA  18          2HB       ALA  18  -1.108   0.421  -0.906
  159   3HB   ALA  18          3HB       ALA  18  -0.171   1.819  -0.376
  160    H    LYS  19           H        LYS  19   0.123  -1.343  -2.356
  161    HA   LYS  19           HA       LYS  19   2.629  -1.751  -1.051
  162   1HB   LYS  19          1HB       LYS  19   2.233  -4.035  -1.389
  163   2HB   LYS  19          2HB       LYS  19   0.632  -3.330  -1.331
  164   1HG   LYS  19          1HG       LYS  19   0.161  -4.054  -3.412
  165   2HG   LYS  19          2HG       LYS  19   1.655  -3.400  -4.066
  166   1HD   LYS  19          1HD       LYS  19   2.106  -5.623  -4.396
  167   2HD   LYS  19          2HD       LYS  19   2.682  -5.500  -2.736
  168   1HE   LYS  19          1HE       LYS  19   0.644  -6.423  -1.862
  169   2HE   LYS  19          2HE       LYS  19  -0.171  -6.279  -3.428
  170   1HZ   LYS  19          1HZ       LYS  19   2.270  -7.928  -2.985
  171   2HZ   LYS  19          2HZ       LYS  19   0.695  -8.543  -2.957
  172   3HZ   LYS  19          3HZ       LYS  19   1.306  -7.867  -4.386
  173    H    ARG  20           H        ARG  20   1.967  -1.003  -4.374
  174    HA   ARG  20           HA       ARG  20   4.531  -1.975  -5.427
  175   1HB   ARG  20          1HB       ARG  20   2.083  -1.555  -6.495
  176   2HB   ARG  20          2HB       ARG  20   2.824  -0.004  -6.873
  177   1HG   ARG  20          1HG       ARG  20   4.783  -1.329  -7.845
  178   2HG   ARG  20          2HG       ARG  20   3.754  -2.755  -7.716
  179   1HD   ARG  20          1HD       ARG  20   2.674  -2.194  -9.616
  180   2HD   ARG  20          2HD       ARG  20   2.250  -0.609  -8.945
  181    HE   ARG  20           HE       ARG  20   4.590  -1.194 -10.642
  182   1HH1  ARG  20          1HH2      ARG  20   2.490   1.174 -10.527
  183   2HH1  ARG  20          2HH2      ARG  20   3.562   2.478 -10.153
  184   1HH2  ARG  20          1HH1      ARG  20   6.200   0.371  -9.264
  185   2HH2  ARG  20          2HH1      ARG  20   5.696   2.017  -9.423
  186    H    SER  21           H        SER  21   3.197   1.095  -4.191
  187    HA   SER  21           HA       SER  21   5.653   2.547  -5.030
  188   1HB   SER  21          1HB       SER  21   2.864   3.198  -4.452
  189   2HB   SER  21          2HB       SER  21   3.981   4.274  -3.617
  190    HG   SER  21           HG       SER  21   3.418   4.029  -6.286
  191    H    ILE  22           H        ILE  22   3.980   1.454  -2.085
  192    HA   ILE  22           HA       ILE  22   5.458   2.825  -0.110
  193    HB   ILE  22           HB       ILE  22   4.051   0.158  -0.234
  194   1HG1  ILE  22          1HG1      ILE  22   3.457   2.630   1.408
  195   2HG1  ILE  22          2HG1      ILE  22   2.860   2.419  -0.237
  196   1HG2  ILE  22          1HG2      ILE  22   5.607   1.310   2.084
  197   2HG2  ILE  22          2HG2      ILE  22   4.221   0.252   2.344
  198   3HG2  ILE  22          3HG2      ILE  22   5.625  -0.338   1.458
  199   1HD1  ILE  22          1HD1      ILE  22   2.317   0.544   2.084
  200   2HD1  ILE  22          2HD1      ILE  22   1.172   1.704   1.413
  201   3HD1  ILE  22          3HD1      ILE  22   1.719   0.339   0.438
  202    H    LYS  23           H        LYS  23   6.391  -0.074  -1.972
  203    HA   LYS  23           HA       LYS  23   8.645  -0.879  -0.428
  204   1HB   LYS  23          1HB       LYS  23   7.789  -1.128  -3.301
  205   2HB   LYS  23          2HB       LYS  23   9.406  -1.657  -2.840
  206   1HG   LYS  23          1HG       LYS  23   8.456  -3.130  -1.116
  207   2HG   LYS  23          2HG       LYS  23   6.829  -2.600  -1.548
  208   1HD   LYS  23          1HD       LYS  23   7.420  -3.385  -3.943
  209   2HD   LYS  23          2HD       LYS  23   8.755  -4.251  -3.186
  210   1HE   LYS  23          1HE       LYS  23   6.036  -4.590  -1.975
  211   2HE   LYS  23          2HE       LYS  23   6.369  -5.416  -3.508
  212   1HZ   LYS  23          1HZ       LYS  23   8.439  -6.277  -2.511
  213   2HZ   LYS  23          2HZ       LYS  23   7.991  -5.598  -1.019
  214   3HZ   LYS  23          3HZ       LYS  23   7.053  -6.828  -1.705
  215    H    THR  24           H        THR  24   8.618   1.290  -3.338
  216    HA   THR  24           HA       THR  24  11.388   2.046  -3.021
  217    HB   THR  24           HB       THR  24   9.063   3.433  -4.409
  218    HG1  THR  24           HG1      THR  24  11.163   1.869  -5.524
  219   1HG2  THR  24          1HG2      THR  24  12.048   3.911  -4.606
  220   2HG2  THR  24          2HG2      THR  24  10.861   4.559  -5.738
  221   3HG2  THR  24          3HG2      THR  24  10.826   5.054  -4.047
  222    H    LEU  25           H        LEU  25   8.395   3.185  -1.572
  223    HA   LEU  25           HA       LEU  25   9.405   5.667  -0.458
  224   1HB   LEU  25          1HB       LEU  25   6.937   4.153  -0.615
  225   2HB   LEU  25          2HB       LEU  25   7.196   4.738   1.025
  226    HG   LEU  25           HG       LEU  25   7.752   7.012  -0.076
  227   1HD1  LEU  25          1HD1      LEU  25   6.347   5.583  -2.352
  228   2HD1  LEU  25          2HD1      LEU  25   6.556   7.332  -2.261
  229   3HD1  LEU  25          3HD1      LEU  25   7.967   6.280  -2.376
  230   1HD2  LEU  25          1HD2      LEU  25   5.683   6.529   1.215
  231   2HD2  LEU  25          2HD2      LEU  25   5.366   7.615  -0.136
  232   3HD2  LEU  25          3HD2      LEU  25   4.924   5.912  -0.252
  233    H    GLU  26           H        GLU  26   9.930   2.382   0.385
  234    HA   GLU  26           HA       GLU  26  10.549   3.007   3.243
  235   1HB   GLU  26          1HB       GLU  26   9.723   0.543   1.694
  236   2HB   GLU  26          2HB       GLU  26  10.530   0.392   3.249
  237   1HG   GLU  26          1HG       GLU  26   8.736   1.821   4.255
  238   2HG   GLU  26          2HG       GLU  26   7.906   1.808   2.701
  239    H    HIS  27           H        HIS  27  11.639   0.969   0.499
  240    HA   HIS  27           HA       HIS  27  14.277   0.460   1.454
  241   1HB   HIS  27          1HB       HIS  27  13.083  -0.885  -0.215
  242   2HB   HIS  27          2HB       HIS  27  13.125   0.454  -1.354
  243    HD1  HIS  27           HD1      HIS  27  15.499  -1.882   0.492
  244    HD2  HIS  27           HD2      HIS  27  15.465   0.609  -2.853
  245    HE1  HIS  27           HE1      HIS  27  17.684  -2.278  -0.719
  246    H    LYS  28           H        LYS  28  13.523   2.615  -1.378
  247    HA   LYS  28           HA       LYS  28  16.077   4.026  -0.823
  248   1HB   LYS  28          1HB       LYS  28  15.117   3.245  -3.129
  249   2HB   LYS  28          2HB       LYS  28  14.107   4.685  -3.021
  250   1HG   LYS  28          1HG       LYS  28  15.944   5.582  -4.109
  251   2HG   LYS  28          2HG       LYS  28  16.418   5.857  -2.439
  252   1HD   LYS  28          1HD       LYS  28  18.307   4.736  -2.944
  253   2HD   LYS  28          2HD       LYS  28  17.320   3.281  -2.888
  254   1HE   LYS  28          1HE       LYS  28  17.864   4.941  -5.378
  255   2HE   LYS  28          2HE       LYS  28  18.608   3.380  -4.997
  256   1HZ   LYS  28          1HZ       LYS  28  16.232   2.525  -4.776
  257   2HZ   LYS  28          2HZ       LYS  28  15.758   3.953  -5.574
  258   3HZ   LYS  28          3HZ       LYS  28  16.787   2.856  -6.343
  259    H    ARG  29           H        ARG  29  14.723   4.544   1.297
  260    HA   ARG  29           HA       ARG  29  13.923   7.371   1.110
  261   1HB   ARG  29          1HB       ARG  29  12.007   5.480   0.761
  262   2HB   ARG  29          2HB       ARG  29  11.965   5.635   2.510
  263   1HG   ARG  29          1HG       ARG  29  10.358   7.162   1.461
  264   2HG   ARG  29          2HG       ARG  29  11.616   8.057   2.301
  265   1HD   ARG  29          1HD       ARG  29  11.221   9.129   0.164
  266   2HD   ARG  29          2HD       ARG  29  12.796   8.336   0.079
  267    HE   ARG  29           HE       ARG  29  11.160   6.378  -0.922
  268   1HH1  ARG  29          1HH1      ARG  29   9.129   8.495  -1.578
  269   2HH1  ARG  29          2HH1      ARG  29   9.618   9.006  -3.160
  270   1HH2  ARG  29          1HH2      ARG  29  12.789   7.574  -2.931
  271   2HH2  ARG  29          2HH2      ARG  29  11.702   8.475  -3.927
  272    H    GLU  30           H        GLU  30  14.045   4.522   3.323
  273    HA   GLU  30           HA       GLU  30  14.311   5.943   5.771
  274   1HB   GLU  30          1HB       GLU  30  15.425   3.268   4.863
  275   2HB   GLU  30          2HB       GLU  30  15.381   3.798   6.542
  276   1HG   GLU  30          1HG       GLU  30  12.897   3.647   4.818
  277   2HG   GLU  30          2HG       GLU  30  13.459   2.298   5.797
  278    H    ASN  31           H        ASN  31  16.735   5.000   3.359
  279    HA   ASN  31           HA       ASN  31  18.799   6.659   4.766
  280   1HB   ASN  31          1HB       ASN  31  18.737   3.905   4.081
  281   2HB   ASN  31          2HB       ASN  31  19.890   4.669   2.991
  282   1HD2  ASN  31          2HD2      ASN  31  21.609   6.093   4.091
  283   2HD2  ASN  31          1HD2      ASN  31  22.129   5.634   5.640
  284    H    ALA  32           H        ALA  32  16.764   7.169   2.349
  285    HA   ALA  32           HA       ALA  32  18.789   8.500   0.630
  286   1HB   ALA  32          1HB       ALA  32  16.854   6.336  -0.166
  287   2HB   ALA  32          2HB       ALA  32  17.482   7.485  -1.348
  288   3HB   ALA  32          3HB       ALA  32  18.590   6.431  -0.468
  289    H    LYS  33           H        LYS  33  18.011  10.386  -0.319
  290    HA   LYS  33           HA       LYS  33  15.210  11.195   0.350
  291   1HB   LYS  33          1HB       LYS  33  16.066  13.450   0.390
  292   2HB   LYS  33          2HB       LYS  33  17.121  12.434   1.358
  293   1HG   LYS  33          1HG       LYS  33  18.225  12.334  -1.222
  294   2HG   LYS  33          2HG       LYS  33  17.731  14.012  -1.014
  295   1HD   LYS  33          1HD       LYS  33  18.966  13.088   1.418
  296   2HD   LYS  33          2HD       LYS  33  20.029  12.733   0.062
  297   1HE   LYS  33          1HE       LYS  33  18.780  15.443   0.075
  298   2HE   LYS  33          2HE       LYS  33  20.026  15.136   1.295
  299   1HZ   LYS  33          1HZ       LYS  33  21.497  14.319  -0.447
  300   2HZ   LYS  33          2HZ       LYS  33  20.315  14.624  -1.622
  301   3HZ   LYS  33          3HZ       LYS  33  21.015  15.914  -0.768
  302    H    GLU  34           H        GLU  34  14.664  13.195  -1.331
  303    HA   GLU  34           HA       GLU  34  14.941  12.058  -4.090
  304   1HB   GLU  34          1HB       GLU  34  12.662  12.476  -2.474
  305   2HB   GLU  34          2HB       GLU  34  12.625  13.756  -3.683
  306   1HG   GLU  34          1HG       GLU  34  12.829  12.116  -5.481
  307   2HG   GLU  34          2HG       GLU  34  12.970  10.811  -4.308
  Start of MODEL   12
    1   1H    CYS   1          1H        CYS   1 -25.344  -1.116   9.625
    2   2H    CYS   1          2H        CYS   1 -26.225   0.011   8.713
    3   3H    CYS   1          3H        CYS   1 -26.882  -1.520   9.049
    4    HA   CYS   1           HA       CYS   1 -25.296  -2.616   7.656
    5   1HB   CYS   1          1HB       CYS   1 -27.382  -1.343   6.780
    6   2HB   CYS   1          2HB       CYS   1 -26.225  -0.174   6.146
    7    HG   CYS   1           HG       CYS   1 -26.859  -2.758   4.828
    8    H    ALA   2           H        ALA   2 -23.209  -2.652   6.846
    9    HA   ALA   2           HA       ALA   2 -21.579  -0.153   7.093
   10   1HB   ALA   2          1HB       ALA   2 -21.029  -2.099   8.518
   11   2HB   ALA   2          2HB       ALA   2 -20.777  -3.072   7.068
   12   3HB   ALA   2          3HB       ALA   2 -19.718  -1.704   7.407
   13    H    VAL   3           H        VAL   3 -23.230  -1.064   4.631
   14    HA   VAL   3           HA       VAL   3 -21.525  -1.996   2.566
   15    HB   VAL   3           HB       VAL   3 -23.968  -1.928   2.414
   16   1HG1  VAL   3          1HG1      VAL   3 -24.160   0.405   3.524
   17   2HG1  VAL   3          2HG1      VAL   3 -23.837   1.044   1.914
   18   3HG1  VAL   3          3HG1      VAL   3 -25.256   0.039   2.193
   19   1HG2  VAL   3          1HG2      VAL   3 -22.482  -1.873   0.367
   20   2HG2  VAL   3          2HG2      VAL   3 -24.131  -1.293   0.118
   21   3HG2  VAL   3          3HG2      VAL   3 -22.805  -0.141   0.277
   22    H    GLU   4           H        GLU   4 -22.172   1.352   3.611
   23    HA   GLU   4           HA       GLU   4 -20.060   2.340   1.758
   24   1HB   GLU   4          1HB       GLU   4 -22.329   3.615   3.301
   25   2HB   GLU   4          2HB       GLU   4 -21.087   4.575   2.498
   26   1HG   GLU   4          1HG       GLU   4 -21.759   3.952   0.379
   27   2HG   GLU   4          2HG       GLU   4 -22.419   2.412   0.920
   28    H    LEU   5           H        LEU   5 -19.884   0.994   4.656
   29    HA   LEU   5           HA       LEU   5 -18.307   3.081   6.065
   30   1HB   LEU   5          1HB       LEU   5 -20.066   1.879   7.271
   31   2HB   LEU   5          2HB       LEU   5 -19.346   0.336   6.829
   32    HG   LEU   5           HG       LEU   5 -17.281   1.002   8.091
   33   1HD1  LEU   5          1HD1      LEU   5 -19.044   3.330   8.913
   34   2HD1  LEU   5          2HD1      LEU   5 -17.542   2.886   9.725
   35   3HD1  LEU   5          3HD1      LEU   5 -17.511   3.420   8.045
   36   1HD2  LEU   5          1HD2      LEU   5 -19.943   0.898   9.536
   37   2HD2  LEU   5          2HD2      LEU   5 -18.840  -0.441   9.213
   38   3HD2  LEU   5          3HD2      LEU   5 -18.395   0.810  10.374
   39    H    ARG   6           H        ARG   6 -17.987  -0.166   4.595
   40    HA   ARG   6           HA       ARG   6 -15.089   0.221   4.286
   41   1HB   ARG   6          1HB       ARG   6 -15.870  -0.706   6.663
   42   2HB   ARG   6          2HB       ARG   6 -15.913  -2.232   5.783
   43   1HG   ARG   6          1HG       ARG   6 -13.539  -1.547   4.947
   44   2HG   ARG   6          2HG       ARG   6 -13.564  -0.426   6.310
   45   1HD   ARG   6          1HD       ARG   6 -14.089  -2.346   7.830
   46   2HD   ARG   6          2HD       ARG   6 -13.880  -3.447   6.457
   47    HE   ARG   6           HE       ARG   6 -11.732  -2.115   7.886
   48   1HH1  ARG   6          1HH2      ARG   6 -11.688  -4.776   6.325
   49   2HH1  ARG   6          2HH2      ARG   6 -10.584  -4.385   5.052
   50   1HH2  ARG   6          1HH1      ARG   6 -10.768  -0.947   5.602
   51   2HH2  ARG   6          2HH1      ARG   6 -10.051  -2.192   4.639
   52    H    SER   7           H        SER   7 -16.616   0.045   2.122
   53    HA   SER   7           HA       SER   7 -17.300  -2.649   1.282
   54   1HB   SER   7          1HB       SER   7 -17.520  -1.475  -0.978
   55   2HB   SER   7          2HB       SER   7 -18.517  -0.854   0.322
   56    HG   SER   7           HG       SER   7 -17.534   0.989   0.025
   57    HA   PRO   8           HA       PRO   8 -13.145  -3.720   0.072
   58   1HB   PRO   8          1HB       PRO   8 -13.684  -6.181  -0.978
   59   2HB   PRO   8          2HB       PRO   8 -13.634  -5.844   0.763
   60   1HG   PRO   8          1HG       PRO   8 -15.945  -6.289  -0.997
   61   2HG   PRO   8          2HG       PRO   8 -15.761  -6.590   0.736
   62   1HD   PRO   8          1HD       PRO   8 -17.099  -4.437  -0.446
   63   2HD   PRO   8          2HD       PRO   8 -16.653  -4.601   1.266
   64    H    GLY   9           H        GLY   9 -13.984  -1.847  -1.654
   65   1HA   GLY   9          1HA       GLY   9 -13.531  -2.992  -4.380
   66   2HA   GLY   9          2HA       GLY   9 -14.657  -1.660  -4.099
   67    H    ILE  10           H        ILE  10 -13.722   0.332  -3.101
   68    HA   ILE  10           HA       ILE  10 -11.401   1.222  -4.529
   69    HB   ILE  10           HB       ILE  10 -13.466   2.459  -3.666
   70   1HG1  ILE  10          1HG1      ILE  10 -11.448   3.485  -4.751
   71   2HG1  ILE  10          2HG1      ILE  10 -12.359   4.546  -3.688
   72   1HG2  ILE  10          1HG2      ILE  10 -13.222   1.753  -1.280
   73   2HG2  ILE  10          2HG2      ILE  10 -11.836   2.835  -1.157
   74   3HG2  ILE  10          3HG2      ILE  10 -13.434   3.486  -1.517
   75   1HD1  ILE  10          1HD1      ILE  10 -10.549   3.595  -1.914
   76   2HD1  ILE  10          2HD1      ILE  10  -9.602   3.473  -3.396
   77   3HD1  ILE  10          3HD1      ILE  10 -10.261   5.028  -2.894
   78    H    SER  11           H        SER  11 -11.838   0.126  -1.152
   79    HA   SER  11           HA       SER  11  -9.155   0.750  -0.305
   80   1HB   SER  11          1HB       SER  11 -11.444  -0.906   0.708
   81   2HB   SER  11          2HB       SER  11  -9.858  -1.128   1.436
   82    HG   SER  11           HG       SER  11 -11.495   0.675   2.134
   83    H    ARG  12           H        ARG  12 -10.668  -2.170  -1.661
   84    HA   ARG  12           HA       ARG  12  -8.445  -3.956  -1.424
   85   1HB   ARG  12          1HB       ARG  12 -10.947  -4.317  -2.022
   86   2HB   ARG  12          2HB       ARG  12 -10.456  -3.956  -3.675
   87   1HG   ARG  12          1HG       ARG  12  -9.073  -5.855  -3.813
   88   2HG   ARG  12          2HG       ARG  12  -8.970  -6.024  -2.063
   89   1HD   ARG  12          1HD       ARG  12 -10.480  -7.727  -2.616
   90   2HD   ARG  12          2HD       ARG  12 -11.582  -6.397  -2.229
   91    HE   ARG  12           HE       ARG  12 -10.888  -6.246  -5.011
   92   1HH1  ARG  12          1HH1      ARG  12 -13.668  -6.086  -3.812
   93   2HH1  ARG  12          2HH1      ARG  12 -14.419  -7.497  -4.481
   94   1HH2  ARG  12          1HH2      ARG  12 -11.381  -8.960  -5.420
   95   2HH2  ARG  12          2HH2      ARG  12 -13.098  -9.154  -5.409
   96    H    PHE  13           H        PHE  13  -9.108  -1.337  -3.676
   97    HA   PHE  13           HA       PHE  13  -6.937  -2.169  -5.506
   98   1HB   PHE  13          1HB       PHE  13  -8.507  -1.471  -6.942
   99   2HB   PHE  13          2HB       PHE  13  -9.490  -0.844  -5.643
  100    HD1  PHE  13           HD1      PHE  13  -9.360   1.545  -5.024
  101    HD2  PHE  13           HD2      PHE  13  -7.048  -0.058  -8.264
  102    HE1  PHE  13           HE1      PHE  13  -8.928   3.840  -5.843
  103    HE2  PHE  13           HE2      PHE  13  -6.612   2.240  -9.087
  104    HZ   PHE  13           HZ       PHE  13  -7.552   4.190  -7.876
  105    H    ARG  14           H        ARG  14  -7.762   0.495  -3.238
  106    HA   ARG  14           HA       ARG  14  -5.441   2.079  -3.870
  107   1HB   ARG  14          1HB       ARG  14  -6.137   3.443  -2.075
  108   2HB   ARG  14          2HB       ARG  14  -7.626   2.765  -2.716
  109   1HG   ARG  14          1HG       ARG  14  -7.524   1.012  -0.925
  110   2HG   ARG  14          2HG       ARG  14  -6.125   1.837  -0.247
  111   1HD   ARG  14          1HD       ARG  14  -8.417   3.631  -0.750
  112   2HD   ARG  14          2HD       ARG  14  -8.725   2.388   0.474
  113    HE   ARG  14           HE       ARG  14  -7.095   3.388   1.861
  114   1HH1  ARG  14          1HH2      ARG  14  -7.818   5.935   0.359
  115   2HH1  ARG  14          2HH2      ARG  14  -6.254   6.554  -0.045
  116   1HH2  ARG  14          1HH1      ARG  14  -4.637   3.517   0.595
  117   2HH2  ARG  14          2HH1      ARG  14  -4.421   5.158   0.092
  118    H    ARG  15           H        ARG  15  -5.944  -0.616  -1.614
  119    HA   ARG  15           HA       ARG  15  -3.530  -0.272  -0.082
  120   1HB   ARG  15          1HB       ARG  15  -5.639  -1.766   0.301
  121   2HB   ARG  15          2HB       ARG  15  -4.808  -2.931  -0.729
  122   1HG   ARG  15          1HG       ARG  15  -4.080  -3.573   1.389
  123   2HG   ARG  15          2HG       ARG  15  -2.778  -2.505   0.873
  124   1HD   ARG  15          1HD       ARG  15  -3.548  -0.715   2.228
  125   2HD   ARG  15          2HD       ARG  15  -5.141  -1.463   2.465
  126    HE   ARG  15           HE       ARG  15  -2.599  -2.447   3.691
  127   1HH1  ARG  15          1HH2      ARG  15  -4.708  -1.321   5.447
  128   2HH1  ARG  15          2HH2      ARG  15  -5.564  -2.725   5.975
  129   1HH2  ARG  15          1HH1      ARG  15  -4.259  -4.768   3.463
  130   2HH2  ARG  15          2HH1      ARG  15  -5.308  -4.705   4.835
  131    H    LYS  16           H        LYS  16  -4.275  -2.015  -3.100
  132    HA   LYS  16           HA       LYS  16  -1.699  -3.252  -3.458
  133   1HB   LYS  16          1HB       LYS  16  -3.745  -3.996  -4.592
  134   2HB   LYS  16          2HB       LYS  16  -3.910  -2.432  -5.380
  135   1HG   LYS  16          1HG       LYS  16  -1.304  -3.695  -5.877
  136   2HG   LYS  16          2HG       LYS  16  -2.659  -4.658  -6.457
  137   1HD   LYS  16          1HD       LYS  16  -3.156  -3.192  -8.110
  138   2HD   LYS  16          2HD       LYS  16  -2.939  -1.796  -7.062
  139   1HE   LYS  16          1HE       LYS  16  -1.093  -1.419  -8.362
  140   2HE   LYS  16          2HE       LYS  16  -0.341  -2.642  -7.325
  141   1HZ   LYS  16          1HZ       LYS  16  -1.165  -4.358  -8.888
  142   2HZ   LYS  16          2HZ       LYS  16  -1.721  -3.130  -9.917
  143   3HZ   LYS  16          3HZ       LYS  16  -0.061  -3.286  -9.601
  144    H    ILE  17           H        ILE  17  -3.058  -0.115  -4.502
  145    HA   ILE  17           HA       ILE  17  -0.783   0.742  -6.066
  146    HB   ILE  17           HB       ILE  17  -2.897   2.325  -4.541
  147   1HG1  ILE  17          1HG1      ILE  17  -2.808   1.704  -7.508
  148   2HG1  ILE  17          2HG1      ILE  17  -3.700   0.709  -6.359
  149   1HG2  ILE  17          1HG2      ILE  17  -0.849   3.639  -5.179
  150   2HG2  ILE  17          2HG2      ILE  17  -1.169   3.230  -6.865
  151   3HG2  ILE  17          3HG2      ILE  17  -2.326   4.202  -5.957
  152   1HD1  ILE  17          1HD1      ILE  17  -4.249   3.590  -6.097
  153   2HD1  ILE  17          2HD1      ILE  17  -4.715   2.913  -7.654
  154   3HD1  ILE  17          3HD1      ILE  17  -5.368   2.229  -6.168
  155    H    ALA  18           H        ALA  18  -1.790   1.246  -2.677
  156    HA   ALA  18           HA       ALA  18   0.454   2.811  -1.831
  157   1HB   ALA  18          1HB       ALA  18  -1.686   1.157  -0.525
  158   2HB   ALA  18          2HB       ALA  18  -0.343   1.738   0.458
  159   3HB   ALA  18          3HB       ALA  18  -1.373   2.889  -0.391
  160    H    LYS  19           H        LYS  19  -0.076  -0.735  -1.951
  161    HA   LYS  19           HA       LYS  19   2.240  -1.527  -0.474
  162   1HB   LYS  19          1HB       LYS  19   0.311  -2.956  -1.150
  163   2HB   LYS  19          2HB       LYS  19   0.866  -2.886  -2.820
  164   1HG   LYS  19          1HG       LYS  19   3.013  -3.684  -1.010
  165   2HG   LYS  19          2HG       LYS  19   1.625  -4.769  -0.899
  166   1HD   LYS  19          1HD       LYS  19   1.631  -4.968  -3.388
  167   2HD   LYS  19          2HD       LYS  19   3.103  -3.995  -3.429
  168   1HE   LYS  19          1HE       LYS  19   4.212  -5.690  -1.946
  169   2HE   LYS  19          2HE       LYS  19   2.763  -6.703  -2.092
  170   1HZ   LYS  19          1HZ       LYS  19   3.002  -6.609  -4.515
  171   2HZ   LYS  19          2HZ       LYS  19   4.437  -5.716  -4.343
  172   3HZ   LYS  19          3HZ       LYS  19   4.354  -7.317  -3.783
  173    H    ARG  20           H        ARG  20   1.820  -0.749  -3.938
  174    HA   ARG  20           HA       ARG  20   4.605  -1.349  -4.609
  175   1HB   ARG  20          1HB       ARG  20   2.651  -1.612  -6.140
  176   2HB   ARG  20          2HB       ARG  20   2.459   0.139  -6.149
  177   1HG   ARG  20          1HG       ARG  20   5.198  -0.767  -6.763
  178   2HG   ARG  20          2HG       ARG  20   3.992  -1.278  -7.942
  179   1HD   ARG  20          1HD       ARG  20   3.353   0.946  -8.440
  180   2HD   ARG  20          2HD       ARG  20   4.127   1.590  -6.981
  181    HE   ARG  20           HE       ARG  20   6.327   0.750  -8.079
  182   1HH1  ARG  20          1HH2      ARG  20   5.385   3.404  -9.078
  183   2HH1  ARG  20          2HH2      ARG  20   5.414   3.197 -10.794
  184   1HH2  ARG  20          1HH1      ARG  20   5.565  -0.292 -10.599
  185   2HH2  ARG  20          2HH1      ARG  20   5.517   1.064 -11.672
  186    H    SER  21           H        SER  21   2.894   1.490  -3.410
  187    HA   SER  21           HA       SER  21   5.072   3.306  -4.263
  188   1HB   SER  21          1HB       SER  21   3.550   5.049  -3.646
  189   2HB   SER  21          2HB       SER  21   2.622   3.823  -4.494
  190    HG   SER  21           HG       SER  21   2.754   4.411  -1.721
  191    H    ILE  22           H        ILE  22   4.727   1.233  -1.654
  192    HA   ILE  22           HA       ILE  22   6.013   3.146   0.251
  193    HB   ILE  22           HB       ILE  22   4.291   0.673   0.563
  194   1HG1  ILE  22          1HG1      ILE  22   4.100   3.389   1.885
  195   2HG1  ILE  22          2HG1      ILE  22   3.359   3.041   0.323
  196   1HG2  ILE  22          1HG2      ILE  22   6.119   1.955   2.605
  197   2HG2  ILE  22          2HG2      ILE  22   4.671   1.068   3.087
  198   3HG2  ILE  22          3HG2      ILE  22   5.958   0.246   2.206
  199   1HD1  ILE  22          1HD1      ILE  22   2.391   0.950   1.686
  200   2HD1  ILE  22          2HD1      ILE  22   2.618   2.058   3.038
  201   3HD1  ILE  22          3HD1      ILE  22   1.581   2.516   1.687
  202    H    LYS  23           H        LYS  23   6.125  -0.365  -0.519
  203    HA   LYS  23           HA       LYS  23   8.631  -1.025   0.542
  204   1HB   LYS  23          1HB       LYS  23   6.834  -2.483  -0.500
  205   2HB   LYS  23          2HB       LYS  23   7.501  -2.056  -2.073
  206   1HG   LYS  23          1HG       LYS  23   9.699  -2.848  -0.472
  207   2HG   LYS  23          2HG       LYS  23   8.424  -4.029  -0.178
  208   1HD   LYS  23          1HD       LYS  23   8.280  -4.621  -2.464
  209   2HD   LYS  23          2HD       LYS  23   9.158  -3.182  -2.982
  210   1HE   LYS  23          1HE       LYS  23  11.185  -4.159  -2.656
  211   2HE   LYS  23          2HE       LYS  23  10.691  -4.878  -1.115
  212   1HZ   LYS  23          1HZ       LYS  23   9.695  -5.896  -3.726
  213   2HZ   LYS  23          2HZ       LYS  23  11.106  -6.481  -2.997
  214   3HZ   LYS  23          3HZ       LYS  23   9.615  -6.645  -2.202
  215    H    THR  24           H        THR  24   8.060  -0.113  -2.882
  216    HA   THR  24           HA       THR  24  10.777   0.041  -3.692
  217    HB   THR  24           HB       THR  24   8.542   1.777  -4.755
  218    HG1  THR  24           HG1      THR  24   7.506   0.056  -5.350
  219   1HG2  THR  24          1HG2      THR  24  10.905   1.876  -5.689
  220   2HG2  THR  24          2HG2      THR  24  10.659   0.218  -6.239
  221   3HG2  THR  24          3HG2      THR  24   9.632   1.513  -6.853
  222    H    LEU  25           H        LEU  25   8.663   2.508  -2.219
  223    HA   LEU  25           HA       LEU  25  10.440   4.746  -2.511
  224   1HB   LEU  25          1HB       LEU  25   7.863   4.379  -1.690
  225   2HB   LEU  25          2HB       LEU  25   8.663   4.618  -0.135
  226    HG   LEU  25           HG       LEU  25   9.830   6.621  -1.405
  227   1HD1  LEU  25          1HD1      LEU  25   8.757   6.012  -3.587
  228   2HD1  LEU  25          2HD1      LEU  25   7.187   6.390  -2.875
  229   3HD1  LEU  25          3HD1      LEU  25   8.398   7.659  -3.070
  230   1HD2  LEU  25          1HD2      LEU  25   7.348   6.342   0.131
  231   2HD2  LEU  25          2HD2      LEU  25   8.642   7.526   0.299
  232   3HD2  LEU  25          3HD2      LEU  25   7.356   7.788  -0.877
  233    H    GLU  26           H        GLU  26   9.897   2.459   0.187
  234    HA   GLU  26           HA       GLU  26  11.746   3.507   2.071
  235   1HB   GLU  26          1HB       GLU  26  10.667   0.754   1.453
  236   2HB   GLU  26          2HB       GLU  26  11.755   1.023   2.814
  237   1HG   GLU  26          1HG       GLU  26  10.226   2.472   3.899
  238   2HG   GLU  26          2HG       GLU  26   9.267   2.695   2.437
  239    H    HIS  27           H        HIS  27  12.232   1.203  -0.599
  240    HA   HIS  27           HA       HIS  27  14.919   0.446  -0.106
  241   1HB   HIS  27          1HB       HIS  27  13.036  -0.246  -1.870
  242   2HB   HIS  27          2HB       HIS  27  13.937   0.860  -2.902
  243    HD1  HIS  27           HD1      HIS  27  14.239  -1.709  -4.053
  244    HD2  HIS  27           HD2      HIS  27  16.520  -0.767  -0.693
  245    HE1  HIS  27           HE1      HIS  27  16.183  -3.330  -4.030
  246    H    LYS  28           H        LYS  28  13.650   3.229  -1.990
  247    HA   LYS  28           HA       LYS  28  16.396   4.213  -2.460
  248   1HB   LYS  28          1HB       LYS  28  15.323   5.822  -3.908
  249   2HB   LYS  28          2HB       LYS  28  14.666   4.224  -4.221
  250   1HG   LYS  28          1HG       LYS  28  12.588   4.757  -3.349
  251   2HG   LYS  28          2HG       LYS  28  13.243   5.945  -2.227
  252   1HD   LYS  28          1HD       LYS  28  12.134   7.255  -3.836
  253   2HD   LYS  28          2HD       LYS  28  13.824   7.333  -4.333
  254   1HE   LYS  28          1HE       LYS  28  13.480   5.695  -6.068
  255   2HE   LYS  28          2HE       LYS  28  11.853   5.320  -5.471
  256   1HZ   LYS  28          1HZ       LYS  28  11.223   7.640  -5.882
  257   2HZ   LYS  28          2HZ       LYS  28  12.761   7.946  -6.533
  258   3HZ   LYS  28          3HZ       LYS  28  11.713   6.853  -7.306
  259    H    ARG  29           H        ARG  29  14.447   4.456   0.211
  260    HA   ARG  29           HA       ARG  29  15.252   7.275   0.817
  261   1HB   ARG  29          1HB       ARG  29  12.826   5.732   1.124
  262   2HB   ARG  29          2HB       ARG  29  13.376   6.303   2.693
  263   1HG   ARG  29          1HG       ARG  29  12.900   8.458   2.216
  264   2HG   ARG  29          2HG       ARG  29  13.569   8.347   0.591
  265   1HD   ARG  29          1HD       ARG  29  11.539   7.905  -0.352
  266   2HD   ARG  29          2HD       ARG  29  11.031   6.861   0.987
  267    HE   ARG  29           HE       ARG  29  10.233   8.780   2.167
  268   1HH1  ARG  29          1HH1      ARG  29  12.499  10.647   1.576
  269   2HH1  ARG  29          2HH1      ARG  29  11.745  11.840   0.578
  270   1HH2  ARG  29          1HH2      ARG  29   8.968   9.848  -0.129
  271   2HH2  ARG  29          2HH2      ARG  29   9.719  11.381  -0.401
  272    H    GLU  30           H        GLU  30  15.010   4.009   2.267
  273    HA   GLU  30           HA       GLU  30  16.146   4.445   4.792
  274   1HB   GLU  30          1HB       GLU  30  15.031   2.419   4.103
  275   2HB   GLU  30          2HB       GLU  30  16.272   2.092   2.901
  276   1HG   GLU  30          1HG       GLU  30  17.786   2.278   5.178
  277   2HG   GLU  30          2HG       GLU  30  16.285   1.609   5.817
  278    H    ASN  31           H        ASN  31  17.988   3.356   1.878
  279    HA   ASN  31           HA       ASN  31  20.533   3.789   3.273
  280   1HB   ASN  31          1HB       ASN  31  19.557   2.419   0.914
  281   2HB   ASN  31          2HB       ASN  31  20.972   3.390   0.510
  282   1HD2  ASN  31          2HD2      ASN  31  19.864   0.878   2.870
  283   2HD2  ASN  31          1HD2      ASN  31  21.427   0.279   3.151
  284    H    ALA  32           H        ALA  32  19.235   5.142   0.209
  285    HA   ALA  32           HA       ALA  32  19.538   7.194  -0.843
  286   1HB   ALA  32          1HB       ALA  32  18.356   7.627   1.429
  287   2HB   ALA  32          2HB       ALA  32  19.899   8.325   1.925
  288   3HB   ALA  32          3HB       ALA  32  19.020   9.007   0.557
  289    H    LYS  33           H        LYS  33  21.172   9.434   0.047
  290    HA   LYS  33           HA       LYS  33  23.336  10.259  -0.182
  291   1HB   LYS  33          1HB       LYS  33  24.117   7.579   1.011
  292   2HB   LYS  33          2HB       LYS  33  25.054   9.062   1.060
  293   1HG   LYS  33          1HG       LYS  33  22.314   8.772   2.330
  294   2HG   LYS  33          2HG       LYS  33  23.826   8.518   3.197
  295   1HD   LYS  33          1HD       LYS  33  24.493  10.869   2.398
  296   2HD   LYS  33          2HD       LYS  33  22.793  11.078   1.973
  297   1HE   LYS  33          1HE       LYS  33  22.076  10.896   4.218
  298   2HE   LYS  33          2HE       LYS  33  23.596  10.143   4.737
  299   1HZ   LYS  33          1HZ       LYS  33  24.767  12.192   4.198
  300   2HZ   LYS  33          2HZ       LYS  33  23.310  12.926   3.719
  301   3HZ   LYS  33          3HZ       LYS  33  23.552  12.484   5.340
  302    H    GLU  34           H        GLU  34  22.735   9.865  -2.537
  303    HA   GLU  34           HA       GLU  34  23.351   9.319  -4.698
  304   1HB   GLU  34          1HB       GLU  34  25.721   9.398  -3.053
  305   2HB   GLU  34          2HB       GLU  34  25.937   8.219  -4.343
  306   1HG   GLU  34          1HG       GLU  34  25.797   9.797  -6.008
  307   2HG   GLU  34          2HG       GLU  34  24.716  10.839  -5.083
  Start of MODEL   13
    1   1H    CYS   1          1H        CYS   1 -13.683  12.895  -2.005
    2   2H    CYS   1          2H        CYS   1 -14.817  13.830  -1.150
    3   3H    CYS   1          3H        CYS   1 -14.659  12.179  -0.819
    4    HA   CYS   1           HA       CYS   1 -16.636  12.541  -2.136
    5   1HB   CYS   1          1HB       CYS   1 -16.451  13.631  -4.308
    6   2HB   CYS   1          2HB       CYS   1 -15.786  14.680  -3.064
    7    HG   CYS   1           HG       CYS   1 -14.206  14.348  -5.293
    8    H    ALA   2           H        ALA   2 -16.807  11.553  -4.630
    9    HA   ALA   2           HA       ALA   2 -16.564   9.738  -6.021
   10   1HB   ALA   2          1HB       ALA   2 -14.055  10.525  -5.630
   11   2HB   ALA   2          2HB       ALA   2 -13.949   8.962  -4.819
   12   3HB   ALA   2          3HB       ALA   2 -14.429   9.045  -6.513
   13    H    VAL   3           H        VAL   3 -17.003   7.541  -6.029
   14    HA   VAL   3           HA       VAL   3 -18.064   5.642  -5.231
   15    HB   VAL   3           HB       VAL   3 -16.605   4.243  -3.963
   16   1HG1  VAL   3          1HG1      VAL   3 -15.980   4.723  -6.300
   17   2HG1  VAL   3          2HG1      VAL   3 -14.966   6.057  -5.751
   18   3HG1  VAL   3          3HG1      VAL   3 -14.566   4.400  -5.302
   19   1HG2  VAL   3          1HG2      VAL   3 -16.046   6.147  -2.299
   20   2HG2  VAL   3          2HG2      VAL   3 -14.779   4.980  -2.660
   21   3HG2  VAL   3          3HG2      VAL   3 -14.761   6.571  -3.427
   22    H    GLU   4           H        GLU   4 -18.763   8.138  -3.676
   23    HA   GLU   4           HA       GLU   4 -20.021   8.787  -1.869
   24   1HB   GLU   4          1HB       GLU   4 -20.741   5.852  -1.761
   25   2HB   GLU   4          2HB       GLU   4 -21.698   7.190  -1.147
   26   1HG   GLU   4          1HG       GLU   4 -22.758   7.014  -3.154
   27   2HG   GLU   4          2HG       GLU   4 -21.395   7.963  -3.741
   28    H    LEU   5           H        LEU   5 -17.204   7.550  -1.336
   29    HA   LEU   5           HA       LEU   5 -15.861   6.928   0.467
   30   1HB   LEU   5          1HB       LEU   5 -17.891   8.839   1.676
   31   2HB   LEU   5          2HB       LEU   5 -16.418   8.349   2.490
   32    HG   LEU   5           HG       LEU   5 -15.893  10.423   1.514
   33   1HD1  LEU   5          1HD1      LEU   5 -14.285   8.496   0.964
   34   2HD1  LEU   5          2HD1      LEU   5 -14.936   8.586  -0.672
   35   3HD1  LEU   5          3HD1      LEU   5 -14.122   9.981   0.030
   36   1HD2  LEU   5          1HD2      LEU   5 -17.981  10.055  -0.167
   37   2HD2  LEU   5          2HD2      LEU   5 -16.745  11.284  -0.427
   38   3HD2  LEU   5          3HD2      LEU   5 -16.651   9.746  -1.280
   39    H    ARG   6           H        ARG   6 -17.850   5.042  -0.149
   40    HA   ARG   6           HA       ARG   6 -18.177   3.616   2.425
   41   1HB   ARG   6          1HB       ARG   6 -20.080   5.184   2.182
   42   2HB   ARG   6          2HB       ARG   6 -20.484   4.430   0.645
   43   1HG   ARG   6          1HG       ARG   6 -21.120   2.403   1.662
   44   2HG   ARG   6          2HG       ARG   6 -20.282   2.783   3.168
   45   1HD   ARG   6          1HD       ARG   6 -22.610   4.436   2.154
   46   2HD   ARG   6          2HD       ARG   6 -22.827   3.055   3.251
   47    HE   ARG   6           HE       ARG   6 -21.442   5.588   3.929
   48   1HH1  ARG   6          1HH2      ARG   6 -23.616   4.529   5.643
   49   2HH1  ARG   6          2HH2      ARG   6 -22.757   3.759   6.931
   50   1HH2  ARG   6          1HH1      ARG   6 -19.737   3.652   5.175
   51   2HH2  ARG   6          2HH1      ARG   6 -20.524   3.253   6.660
   52    H    SER   7           H        SER   7 -19.097   3.609  -1.058
   53    HA   SER   7           HA       SER   7 -19.548   0.861  -1.419
   54   1HB   SER   7          1HB       SER   7 -18.730   3.146  -3.166
   55   2HB   SER   7          2HB       SER   7 -18.738   1.522  -3.838
   56    HG   SER   7           HG       SER   7 -20.795   3.112  -3.473
   57    HA   PRO   8           HA       PRO   8 -15.371  -0.692  -0.959
   58   1HB   PRO   8          1HB       PRO   8 -15.973  -3.331  -1.300
   59   2HB   PRO   8          2HB       PRO   8 -16.277  -2.453   0.214
   60   1HG   PRO   8          1HG       PRO   8 -18.168  -3.255  -1.910
   61   2HG   PRO   8          2HG       PRO   8 -18.410  -3.128  -0.162
   62   1HD   PRO   8          1HD       PRO   8 -19.271  -1.277  -2.007
   63   2HD   PRO   8          2HD       PRO   8 -19.019  -0.956  -0.279
   64    H    GLY   9           H        GLY   9 -14.015  -2.362  -2.360
   65   1HA   GLY   9          1HA       GLY   9 -13.748  -3.390  -4.599
   66   2HA   GLY   9          2HA       GLY   9 -14.686  -2.053  -5.259
   67    H    ILE  10           H        ILE  10 -13.701   0.165  -4.925
   68    HA   ILE  10           HA       ILE  10 -11.026   0.221  -5.949
   69    HB   ILE  10           HB       ILE  10 -13.071   1.813  -6.147
   70   1HG1  ILE  10          1HG1      ILE  10 -10.797   2.021  -7.221
   71   2HG1  ILE  10          2HG1      ILE  10 -11.683   3.522  -6.993
   72   1HG2  ILE  10          1HG2      ILE  10 -11.763   2.933  -3.676
   73   2HG2  ILE  10          2HG2      ILE  10 -12.777   3.893  -4.750
   74   3HG2  ILE  10          3HG2      ILE  10 -13.456   2.494  -3.918
   75   1HD1  ILE  10          1HD1      ILE  10 -10.323   3.673  -4.753
   76   2HD1  ILE  10          2HD1      ILE  10  -9.250   2.518  -5.543
   77   3HD1  ILE  10          3HD1      ILE  10  -9.535   4.097  -6.271
   78    H    SER  11           H        SER  11 -12.286   0.803  -2.649
   79    HA   SER  11           HA       SER  11  -9.784   1.595  -1.468
   80   1HB   SER  11          1HB       SER  11 -12.344   0.399  -0.386
   81   2HB   SER  11          2HB       SER  11 -10.996   0.841   0.654
   82    HG   SER  11           HG       SER  11 -12.794   2.416  -0.751
   83    H    ARG  12           H        ARG  12 -11.277  -1.578  -2.026
   84    HA   ARG  12           HA       ARG  12  -9.518  -3.183  -0.432
   85   1HB   ARG  12          1HB       ARG  12 -11.313  -3.629  -2.811
   86   2HB   ARG  12          2HB       ARG  12 -10.266  -4.931  -2.256
   87   1HG   ARG  12          1HG       ARG  12 -11.236  -4.468   0.091
   88   2HG   ARG  12          2HG       ARG  12 -12.491  -3.558  -0.750
   89   1HD   ARG  12          1HD       ARG  12 -13.299  -5.476  -1.881
   90   2HD   ARG  12          2HD       ARG  12 -11.820  -6.400  -1.550
   91    HE   ARG  12           HE       ARG  12 -12.503  -6.149   0.934
   92   1HH1  ARG  12          1HH1      ARG  12 -15.013  -4.694   0.611
   93   2HH1  ARG  12          2HH1      ARG  12 -16.206  -5.942   0.547
   94   1HH2  ARG  12          1HH2      ARG  12 -13.879  -8.456  -0.155
   95   2HH2  ARG  12          2HH2      ARG  12 -15.553  -8.111   0.104
   96    H    PHE  13           H        PHE  13  -9.231  -1.868  -3.707
   97    HA   PHE  13           HA       PHE  13  -6.671  -3.268  -4.185
   98   1HB   PHE  13          1HB       PHE  13  -7.627  -3.310  -6.218
   99   2HB   PHE  13          2HB       PHE  13  -8.912  -2.253  -5.684
  100    HD1  PHE  13           HD1      PHE  13  -5.495  -2.348  -7.169
  101    HD2  PHE  13           HD2      PHE  13  -8.971   0.039  -6.338
  102    HE1  PHE  13           HE1      PHE  13  -4.625  -0.558  -8.649
  103    HE2  PHE  13           HE2      PHE  13  -8.100   1.824  -7.815
  104    HZ   PHE  13           HZ       PHE  13  -5.926   1.527  -8.972
  105    H    ARG  14           H        ARG  14  -7.853  -0.161  -3.120
  106    HA   ARG  14           HA       ARG  14  -5.758   1.600  -3.837
  107   1HB   ARG  14          1HB       ARG  14  -7.916   1.450  -1.827
  108   2HB   ARG  14          2HB       ARG  14  -6.544   2.442  -1.340
  109   1HG   ARG  14          1HG       ARG  14  -6.741   3.841  -3.261
  110   2HG   ARG  14          2HG       ARG  14  -7.878   2.737  -4.037
  111   1HD   ARG  14          1HD       ARG  14  -9.625   3.289  -2.511
  112   2HD   ARG  14          2HD       ARG  14  -8.502   4.088  -1.394
  113    HE   ARG  14           HE       ARG  14  -8.836   5.179  -4.155
  114   1HH1  ARG  14          1HH2      ARG  14 -10.967   5.853  -2.044
  115   2HH1  ARG  14          2HH2      ARG  14 -10.389   7.377  -1.472
  116   1HH2  ARG  14          1HH1      ARG  14  -7.206   6.955  -2.865
  117   2HH2  ARG  14          2HH1      ARG  14  -8.217   8.011  -1.944
  118    H    ARG  15           H        ARG  15  -6.023  -0.655  -1.064
  119    HA   ARG  15           HA       ARG  15  -3.621   0.170   0.257
  120   1HB   ARG  15          1HB       ARG  15  -3.831  -1.891   1.500
  121   2HB   ARG  15          2HB       ARG  15  -5.446  -1.258   1.227
  122   1HG   ARG  15          1HG       ARG  15  -5.761  -2.852  -0.629
  123   2HG   ARG  15          2HG       ARG  15  -4.124  -3.461  -0.390
  124   1HD   ARG  15          1HD       ARG  15  -4.964  -4.941   1.097
  125   2HD   ARG  15          2HD       ARG  15  -5.356  -3.580   2.162
  126    HE   ARG  15           HE       ARG  15  -7.232  -4.696   0.111
  127   1HH1  ARG  15          1HH1      ARG  15  -7.693  -1.843   0.945
  128   2HH1  ARG  15          2HH1      ARG  15  -8.840  -2.024   2.225
  129   1HH2  ARG  15          1HH2      ARG  15  -8.187  -5.433   2.649
  130   2HH2  ARG  15          2HH2      ARG  15  -9.117  -4.092   3.220
  131    H    LYS  16           H        LYS  16  -4.161  -2.006  -2.486
  132    HA   LYS  16           HA       LYS  16  -1.490  -3.127  -2.551
  133   1HB   LYS  16          1HB       LYS  16  -3.921  -3.513  -3.888
  134   2HB   LYS  16          2HB       LYS  16  -2.862  -2.860  -5.134
  135   1HG   LYS  16          1HG       LYS  16  -2.401  -5.121  -5.316
  136   2HG   LYS  16          2HG       LYS  16  -1.139  -4.618  -4.196
  137   1HD   LYS  16          1HD       LYS  16  -3.739  -5.430  -2.990
  138   2HD   LYS  16          2HD       LYS  16  -2.778  -6.710  -3.720
  139   1HE   LYS  16          1HE       LYS  16  -1.069  -4.984  -2.133
  140   2HE   LYS  16          2HE       LYS  16  -2.413  -5.590  -1.155
  141   1HZ   LYS  16          1HZ       LYS  16  -0.833  -7.364  -2.942
  142   2HZ   LYS  16          2HZ       LYS  16  -0.418  -7.096  -1.318
  143   3HZ   LYS  16          3HZ       LYS  16  -1.906  -7.808  -1.708
  144    H    ILE  17           H        ILE  17  -3.013  -0.236  -3.954
  145    HA   ILE  17           HA       ILE  17  -0.837   0.591  -5.648
  146    HB   ILE  17           HB       ILE  17  -2.893   2.271  -4.148
  147   1HG1  ILE  17          1HG1      ILE  17  -3.117   1.393  -7.031
  148   2HG1  ILE  17          2HG1      ILE  17  -3.747   0.380  -5.732
  149   1HG2  ILE  17          1HG2      ILE  17  -1.202   2.845  -6.597
  150   2HG2  ILE  17          2HG2      ILE  17  -2.552   3.851  -6.072
  151   3HG2  ILE  17          3HG2      ILE  17  -1.135   3.670  -5.040
  152   1HD1  ILE  17          1HD1      ILE  17  -4.702   2.921  -5.102
  153   2HD1  ILE  17          2HD1      ILE  17  -4.844   2.839  -6.856
  154   3HD1  ILE  17          3HD1      ILE  17  -5.626   1.620  -5.851
  155    H    ALA  18           H        ALA  18  -1.681   1.195  -2.232
  156    HA   ALA  18           HA       ALA  18   0.522   2.946  -1.616
  157   1HB   ALA  18          1HB       ALA  18  -1.432   1.241  -0.086
  158   2HB   ALA  18          2HB       ALA  18  -0.069   1.962   0.771
  159   3HB   ALA  18          3HB       ALA  18  -1.229   2.994  -0.064
  160    H    LYS  19           H        LYS  19   0.119  -0.613  -1.441
  161    HA   LYS  19           HA       LYS  19   2.593  -1.258  -0.177
  162   1HB   LYS  19          1HB       LYS  19   0.694  -2.648  -2.057
  163   2HB   LYS  19          2HB       LYS  19   2.223  -3.423  -1.637
  164   1HG   LYS  19          1HG       LYS  19   1.272  -2.553   0.823
  165   2HG   LYS  19          2HG       LYS  19  -0.192  -3.057  -0.015
  166   1HD   LYS  19          1HD       LYS  19   0.488  -5.050   0.969
  167   2HD   LYS  19          2HD       LYS  19   1.212  -5.188  -0.632
  168   1HE   LYS  19          1HE       LYS  19   3.322  -4.130   0.395
  169   2HE   LYS  19          2HE       LYS  19   2.575  -4.451   1.972
  170   1HZ   LYS  19          1HZ       LYS  19   2.828  -6.544  -0.121
  171   2HZ   LYS  19          2HZ       LYS  19   4.015  -6.289   1.060
  172   3HZ   LYS  19          3HZ       LYS  19   2.445  -6.746   1.518
  173    H    ARG  20           H        ARG  20   1.817  -0.532  -3.567
  174    HA   ARG  20           HA       ARG  20   4.389  -1.228  -4.690
  175   1HB   ARG  20          1HB       ARG  20   1.900  -0.530  -5.636
  176   2HB   ARG  20          2HB       ARG  20   2.798   0.955  -5.924
  177   1HG   ARG  20          1HG       ARG  20   3.849   0.054  -7.687
  178   2HG   ARG  20          2HG       ARG  20   4.402  -1.315  -6.727
  179   1HD   ARG  20          1HD       ARG  20   1.530  -1.434  -7.398
  180   2HD   ARG  20          2HD       ARG  20   2.604  -1.501  -8.809
  181    HE   ARG  20           HE       ARG  20   2.875  -3.345  -6.463
  182   1HH1  ARG  20          1HH1      ARG  20   5.143  -3.049  -8.482
  183   2HH1  ARG  20          2HH1      ARG  20   4.843  -4.386  -9.536
  184   1HH2  ARG  20          1HH2      ARG  20   1.584  -4.876  -8.377
  185   2HH2  ARG  20          2HH2      ARG  20   2.797  -5.440  -9.472
  186    H    SER  21           H        SER  21   2.942   1.770  -3.403
  187    HA   SER  21           HA       SER  21   5.099   3.579  -3.944
  188   1HB   SER  21          1HB       SER  21   2.662   4.010  -3.180
  189   2HB   SER  21          2HB       SER  21   3.243   3.669  -1.555
  190    HG   SER  21           HG       SER  21   3.732   5.748  -1.637
  191    H    ILE  22           H        ILE  22   4.387   1.469  -1.157
  192    HA   ILE  22           HA       ILE  22   6.526   2.292   0.563
  193    HB   ILE  22           HB       ILE  22   4.935  -0.273   0.276
  194   1HG1  ILE  22          1HG1      ILE  22   4.733   1.746   2.502
  195   2HG1  ILE  22          2HG1      ILE  22   3.912   2.038   0.971
  196   1HG2  ILE  22          1HG2      ILE  22   7.146   0.431   2.153
  197   2HG2  ILE  22          2HG2      ILE  22   5.732  -0.368   2.841
  198   3HG2  ILE  22          3HG2      ILE  22   6.639  -1.146   1.547
  199   1HD1  ILE  22          1HD1      ILE  22   3.584  -0.501   2.592
  200   2HD1  ILE  22          2HD1      ILE  22   2.484   0.875   2.687
  201   3HD1  ILE  22          3HD1      ILE  22   2.655  -0.013   1.175
  202    H    LYS  23           H        LYS  23   6.371  -0.229  -1.979
  203    HA   LYS  23           HA       LYS  23   8.955  -1.390  -1.532
  204   1HB   LYS  23          1HB       LYS  23   7.149  -1.086  -3.949
  205   2HB   LYS  23          2HB       LYS  23   8.673  -1.966  -4.032
  206   1HG   LYS  23          1HG       LYS  23   7.946  -3.630  -2.535
  207   2HG   LYS  23          2HG       LYS  23   6.649  -2.619  -1.894
  208   1HD   LYS  23          1HD       LYS  23   5.460  -4.052  -3.292
  209   2HD   LYS  23          2HD       LYS  23   5.742  -2.674  -4.348
  210   1HE   LYS  23          1HE       LYS  23   6.765  -4.059  -5.815
  211   2HE   LYS  23          2HE       LYS  23   8.031  -4.349  -4.611
  212   1HZ   LYS  23          1HZ       LYS  23   5.427  -5.795  -4.685
  213   2HZ   LYS  23          2HZ       LYS  23   6.893  -6.399  -5.295
  214   3HZ   LYS  23          3HZ       LYS  23   6.727  -6.096  -3.637
  215    H    THR  24           H        THR  24   7.908   1.372  -3.552
  216    HA   THR  24           HA       THR  24  10.571   1.950  -4.579
  217    HB   THR  24           HB       THR  24   8.091   3.700  -4.398
  218    HG1  THR  24           HG1      THR  24   8.853   1.654  -6.190
  219   1HG2  THR  24          1HG2      THR  24  10.534   4.527  -5.148
  220   2HG2  THR  24          2HG2      THR  24   9.983   3.852  -6.682
  221   3HG2  THR  24          3HG2      THR  24   9.054   5.127  -5.894
  222    H    LEU  25           H        LEU  25   8.584   3.115  -1.866
  223    HA   LEU  25           HA       LEU  25  10.378   5.215  -0.990
  224   1HB   LEU  25          1HB       LEU  25   7.849   3.988  -0.210
  225   2HB   LEU  25          2HB       LEU  25   8.835   4.354   1.186
  226    HG   LEU  25           HG       LEU  25   7.514   6.271   0.834
  227   1HD1  LEU  25          1HD1      LEU  25  10.136   6.584   0.930
  228   2HD1  LEU  25          2HD1      LEU  25   9.898   7.218  -0.700
  229   3HD1  LEU  25          3HD1      LEU  25   9.068   7.961   0.666
  230   1HD2  LEU  25          1HD2      LEU  25   8.175   5.899  -2.087
  231   2HD2  LEU  25          2HD2      LEU  25   6.590   5.912  -1.316
  232   3HD2  LEU  25          3HD2      LEU  25   7.508   7.410  -1.466
  233    H    GLU  26           H        GLU  26  10.461   1.752  -0.619
  234    HA   GLU  26           HA       GLU  26  12.246   1.903   1.762
  235   1HB   GLU  26          1HB       GLU  26  10.141   0.489   1.624
  236   2HB   GLU  26          2HB       GLU  26  10.972  -0.485   0.411
  237   1HG   GLU  26          1HG       GLU  26  12.836  -0.363   2.432
  238   2HG   GLU  26          2HG       GLU  26  11.317  -0.421   3.332
  239    H    HIS  27           H        HIS  27  12.126   0.640  -1.593
  240    HA   HIS  27           HA       HIS  27  14.665  -0.637  -1.669
  241   1HB   HIS  27          1HB       HIS  27  12.942  -0.952  -3.350
  242   2HB   HIS  27          2HB       HIS  27  13.011   0.747  -3.801
  243    HD1  HIS  27           HD1      HIS  27  14.112   0.879  -6.039
  244    HD2  HIS  27           HD2      HIS  27  15.982  -1.926  -3.580
  245    HE1  HIS  27           HE1      HIS  27  16.104   0.008  -7.331
  246    H    LYS  28           H        LYS  28  13.802   2.729  -2.558
  247    HA   LYS  28           HA       LYS  28  16.422   3.586  -3.311
  248   1HB   LYS  28          1HB       LYS  28  15.481   5.822  -3.129
  249   2HB   LYS  28          2HB       LYS  28  14.289   4.739  -3.834
  250   1HG   LYS  28          1HG       LYS  28  13.290   4.488  -1.514
  251   2HG   LYS  28          2HG       LYS  28  14.372   5.773  -0.983
  252   1HD   LYS  28          1HD       LYS  28  12.848   6.401  -3.433
  253   2HD   LYS  28          2HD       LYS  28  11.859   6.181  -1.992
  254   1HE   LYS  28          1HE       LYS  28  12.569   8.129  -1.073
  255   2HE   LYS  28          2HE       LYS  28  14.262   7.799  -1.476
  256   1HZ   LYS  28          1HZ       LYS  28  12.194   8.712  -3.414
  257   2HZ   LYS  28          2HZ       LYS  28  13.402   9.689  -2.729
  258   3HZ   LYS  28          3HZ       LYS  28  13.827   8.414  -3.765
  259    H    ARG  29           H        ARG  29  14.860   3.397  -0.154
  260    HA   ARG  29           HA       ARG  29  16.823   4.915   1.333
  261   1HB   ARG  29          1HB       ARG  29  14.394   4.431   1.882
  262   2HB   ARG  29          2HB       ARG  29  14.903   2.805   2.326
  263   1HG   ARG  29          1HG       ARG  29  16.569   4.887   3.542
  264   2HG   ARG  29          2HG       ARG  29  14.875   5.008   4.011
  265   1HD   ARG  29          1HD       ARG  29  16.523   2.462   4.188
  266   2HD   ARG  29          2HD       ARG  29  16.190   3.539   5.552
  267    HE   ARG  29           HE       ARG  29  14.358   1.600   4.527
  268   1HH1  ARG  29          1HH2      ARG  29  14.406   3.578   7.051
  269   2HH1  ARG  29          2HH2      ARG  29  12.807   4.217   6.909
  270   1HH2  ARG  29          1HH1      ARG  29  12.325   2.989   3.674
  271   2HH2  ARG  29          2HH1      ARG  29  11.614   3.880   4.977
  272    H    GLU  30           H        GLU  30  16.643   1.492   0.371
  273    HA   GLU  30           HA       GLU  30  18.566   0.556   2.337
  274   1HB   GLU  30          1HB       GLU  30  16.771  -0.731   0.901
  275   2HB   GLU  30          2HB       GLU  30  18.062  -0.807  -0.302
  276   1HG   GLU  30          1HG       GLU  30  19.553  -1.643   1.639
  277   2HG   GLU  30          2HG       GLU  30  18.043  -1.938   2.494
  278    H    ASN  31           H        ASN  31  18.828   1.120  -1.205
  279    HA   ASN  31           HA       ASN  31  21.730   0.888  -1.202
  280   1HB   ASN  31          1HB       ASN  31  19.910   0.546  -3.089
  281   2HB   ASN  31          2HB       ASN  31  20.138   2.273  -3.350
  282   1HD2  ASN  31          2HD2      ASN  31  21.454   2.368  -5.230
  283   2HD2  ASN  31          1HD2      ASN  31  22.919   1.527  -5.394
  284    H    ALA  32           H        ALA  32  19.429   3.608  -1.387
  285    HA   ALA  32           HA       ALA  32  19.626   5.888  -1.078
  286   1HB   ALA  32          1HB       ALA  32  20.129   4.831   1.156
  287   2HB   ALA  32          2HB       ALA  32  21.840   5.097   0.812
  288   3HB   ALA  32          3HB       ALA  32  20.741   6.471   0.940
  289    H    LYS  33           H        LYS  33  20.352   6.732  -3.008
  290    HA   LYS  33           HA       LYS  33  23.312   7.028  -3.396
  291   1HB   LYS  33          1HB       LYS  33  21.978   5.754  -5.097
  292   2HB   LYS  33          2HB       LYS  33  21.050   7.219  -5.407
  293   1HG   LYS  33          1HG       LYS  33  23.584   8.184  -5.677
  294   2HG   LYS  33          2HG       LYS  33  23.817   6.525  -6.216
  295   1HD   LYS  33          1HD       LYS  33  23.193   7.494  -8.215
  296   2HD   LYS  33          2HD       LYS  33  21.613   7.016  -7.609
  297   1HE   LYS  33          1HE       LYS  33  21.183   9.234  -8.157
  298   2HE   LYS  33          2HE       LYS  33  21.699   9.437  -6.476
  299   1HZ   LYS  33          1HZ       LYS  33  23.639   9.492  -8.725
  300   2HZ   LYS  33          2HZ       LYS  33  22.845  10.887  -8.182
  301   3HZ   LYS  33          3HZ       LYS  33  23.859  10.023  -7.129
  302    H    GLU  34           H        GLU  34  23.645   8.959  -2.226
  303    HA   GLU  34           HA       GLU  34  22.172  11.375  -3.203
  304   1HB   GLU  34          1HB       GLU  34  22.040  10.261  -0.734
  305   2HB   GLU  34          2HB       GLU  34  23.403  11.349  -0.493
  306   1HG   GLU  34          1HG       GLU  34  22.128  13.252  -0.859
  307   2HG   GLU  34          2HG       GLU  34  20.944  12.402  -1.849
  Start of MODEL   14
    1   1H    CYS   1          1H        CYS   1 -29.581  -3.474  -6.105
    2   2H    CYS   1          2H        CYS   1 -28.912  -1.941  -5.841
    3   3H    CYS   1          3H        CYS   1 -29.655  -2.298  -7.324
    4    HA   CYS   1           HA       CYS   1 -27.979  -3.808  -7.953
    5   1HB   CYS   1          1HB       CYS   1 -26.085  -2.276  -8.082
    6   2HB   CYS   1          2HB       CYS   1 -27.596  -1.412  -8.317
    7    HG   CYS   1           HG       CYS   1 -25.656  -1.047  -5.958
    8    H    ALA   2           H        ALA   2 -27.530  -2.872  -4.531
    9    HA   ALA   2           HA       ALA   2 -26.304  -3.837  -2.811
   10   1HB   ALA   2          1HB       ALA   2 -28.022  -5.537  -3.393
   11   2HB   ALA   2          2HB       ALA   2 -26.852  -6.317  -4.458
   12   3HB   ALA   2          3HB       ALA   2 -26.556  -6.251  -2.722
   13    H    VAL   3           H        VAL   3 -24.474  -2.621  -4.219
   14    HA   VAL   3           HA       VAL   3 -22.153  -4.411  -4.155
   15    HB   VAL   3           HB       VAL   3 -23.008  -4.736  -6.407
   16   1HG1  VAL   3          1HG1      VAL   3 -24.132  -2.435  -6.549
   17   2HG1  VAL   3          2HG1      VAL   3 -22.547  -1.819  -7.016
   18   3HG1  VAL   3          3HG1      VAL   3 -23.347  -3.036  -8.007
   19   1HG2  VAL   3          1HG2      VAL   3 -20.459  -3.158  -6.119
   20   2HG2  VAL   3          2HG2      VAL   3 -20.666  -4.894  -6.355
   21   3HG2  VAL   3          3HG2      VAL   3 -20.975  -3.780  -7.687
   22    H    GLU   4           H        GLU   4 -23.180  -1.055  -5.000
   23    HA   GLU   4           HA       GLU   4 -20.620  -0.078  -3.800
   24   1HB   GLU   4          1HB       GLU   4 -22.541   0.856  -5.892
   25   2HB   GLU   4          2HB       GLU   4 -21.627   2.078  -5.012
   26   1HG   GLU   4          1HG       GLU   4 -19.574   1.324  -5.807
   27   2HG   GLU   4          2HG       GLU   4 -20.176  -0.303  -6.123
   28    H    LEU   5           H        LEU   5 -22.484  -0.943  -1.920
   29    HA   LEU   5           HA       LEU   5 -23.016   1.526  -0.432
   30   1HB   LEU   5          1HB       LEU   5 -25.445   1.051  -0.221
   31   2HB   LEU   5          2HB       LEU   5 -24.951   1.432  -1.863
   32    HG   LEU   5           HG       LEU   5 -24.792  -1.437  -1.348
   33   1HD1  LEU   5          1HD1      LEU   5 -27.456  -0.047  -0.952
   34   2HD1  LEU   5          2HD1      LEU   5 -27.277  -1.771  -1.274
   35   3HD1  LEU   5          3HD1      LEU   5 -26.616  -1.078   0.207
   36   1HD2  LEU   5          1HD2      LEU   5 -24.821  -0.311  -3.578
   37   2HD2  LEU   5          2HD2      LEU   5 -26.101  -1.512  -3.414
   38   3HD2  LEU   5          3HD2      LEU   5 -26.479   0.203  -3.268
   39    H    ARG   6           H        ARG   6 -21.402  -0.918   0.069
   40    HA   ARG   6           HA       ARG   6 -22.403  -1.532   2.782
   41   1HB   ARG   6          1HB       ARG   6 -23.458  -3.106   1.038
   42   2HB   ARG   6          2HB       ARG   6 -21.848  -3.808   0.879
   43   1HG   ARG   6          1HG       ARG   6 -22.777  -3.454   3.663
   44   2HG   ARG   6          2HG       ARG   6 -23.703  -4.617   2.720
   45   1HD   ARG   6          1HD       ARG   6 -21.963  -6.106   2.594
   46   2HD   ARG   6          2HD       ARG   6 -20.737  -4.829   2.479
   47    HE   ARG   6           HE       ARG   6 -20.569  -4.852   4.830
   48   1HH1  ARG   6          1HH2      ARG   6 -21.581  -7.676   4.824
   49   2HH1  ARG   6          2HH2      ARG   6 -22.891  -7.594   5.947
   50   1HH2  ARG   6          1HH1      ARG   6 -23.095  -4.109   5.832
   51   2HH2  ARG   6          2HH1      ARG   6 -23.763  -5.542   6.529
   52    H    SER   7           H        SER   7 -19.975  -2.456   0.310
   53    HA   SER   7           HA       SER   7 -17.830  -2.239   2.376
   54   1HB   SER   7          1HB       SER   7 -16.897  -4.182   0.703
   55   2HB   SER   7          2HB       SER   7 -17.772  -4.508   2.186
   56    HG   SER   7           HG       SER   7 -18.797  -5.631   0.575
   57    HA   PRO   8           HA       PRO   8 -16.259   0.492  -0.770
   58   1HB   PRO   8          1HB       PRO   8 -13.754   0.884   0.235
   59   2HB   PRO   8          2HB       PRO   8 -15.207   1.656   0.904
   60   1HG   PRO   8          1HG       PRO   8 -13.703  -0.704   1.892
   61   2HG   PRO   8          2HG       PRO   8 -14.488   0.602   2.797
   62   1HD   PRO   8          1HD       PRO   8 -15.569  -1.871   2.496
   63   2HD   PRO   8          2HD       PRO   8 -16.531  -0.395   2.742
   64    H    GLY   9           H        GLY   9 -15.290   0.115  -2.736
   65   1HA   GLY   9          1HA       GLY   9 -13.777  -2.411  -3.121
   66   2HA   GLY   9          2HA       GLY   9 -14.527  -1.454  -4.397
   67    H    ILE  10           H        ILE  10 -13.508   1.069  -3.968
   68    HA   ILE  10           HA       ILE  10 -10.942   0.987  -5.147
   69    HB   ILE  10           HB       ILE  10 -12.580   2.855  -5.231
   70   1HG1  ILE  10          1HG1      ILE  10  -9.772   3.445  -4.281
   71   2HG1  ILE  10          2HG1      ILE  10 -10.319   3.250  -5.944
   72   1HG2  ILE  10          1HG2      ILE  10 -13.160   2.841  -2.782
   73   2HG2  ILE  10          2HG2      ILE  10 -11.584   3.565  -2.457
   74   3HG2  ILE  10          3HG2      ILE  10 -12.777   4.441  -3.415
   75   1HD1  ILE  10          1HD1      ILE  10 -11.792   5.273  -5.607
   76   2HD1  ILE  10          2HD1      ILE  10 -11.010   5.505  -4.043
   77   3HD1  ILE  10          3HD1      ILE  10 -10.063   5.614  -5.526
   78    H    SER  11           H        SER  11 -11.812   1.233  -1.690
   79    HA   SER  11           HA       SER  11  -9.198   1.828  -0.683
   80   1HB   SER  11          1HB       SER  11 -11.594   1.810   0.406
   81   2HB   SER  11          2HB       SER  11 -11.206   0.137   0.788
   82    HG   SER  11           HG       SER  11 -10.445   2.341   2.053
   83    H    ARG  12           H        ARG  12 -10.743  -1.257  -1.540
   84    HA   ARG  12           HA       ARG  12  -8.666  -2.962  -0.446
   85   1HB   ARG  12          1HB       ARG  12 -11.168  -3.203  -1.915
   86   2HB   ARG  12          2HB       ARG  12  -9.944  -4.242  -2.637
   87   1HG   ARG  12          1HG       ARG  12 -10.267  -4.221   0.346
   88   2HG   ARG  12          2HG       ARG  12 -11.413  -5.125  -0.636
   89   1HD   ARG  12          1HD       ARG  12  -8.532  -5.535  -1.289
   90   2HD   ARG  12          2HD       ARG  12  -9.103  -6.215   0.245
   91    HE   ARG  12           HE       ARG  12 -10.975  -6.806  -1.879
   92   1HH1  ARG  12          1HH1      ARG  12  -9.955  -8.641   0.350
   93   2HH1  ARG  12          2HH1      ARG  12  -9.124  -9.847  -0.567
   94   1HH2  ARG  12          1HH2      ARG  12  -9.032  -7.910  -3.474
   95   2HH2  ARG  12          2HH2      ARG  12  -8.591  -9.427  -2.771
   96    H    PHE  13           H        PHE  13  -9.310  -1.458  -3.611
   97    HA   PHE  13           HA       PHE  13  -7.058  -2.643  -4.991
   98   1HB   PHE  13          1HB       PHE  13  -8.472  -1.886  -6.596
   99   2HB   PHE  13          2HB       PHE  13  -9.282  -0.810  -5.477
  100    HD1  PHE  13           HD1      PHE  13  -6.231  -1.117  -7.632
  101    HD2  PHE  13           HD2      PHE  13  -8.962   1.517  -5.621
  102    HE1  PHE  13           HE1      PHE  13  -5.180   0.829  -8.750
  103    HE2  PHE  13           HE2      PHE  13  -7.913   3.461  -6.737
  104    HZ   PHE  13           HZ       PHE  13  -6.022   3.119  -8.302
  105    H    ARG  14           H        ARG  14  -7.581   0.364  -3.163
  106    HA   ARG  14           HA       ARG  14  -5.166   1.744  -3.719
  107   1HB   ARG  14          1HB       ARG  14  -7.150   1.637  -1.468
  108   2HB   ARG  14          2HB       ARG  14  -5.658   2.543  -1.230
  109   1HG   ARG  14          1HG       ARG  14  -6.126   4.001  -3.051
  110   2HG   ARG  14          2HG       ARG  14  -7.407   2.956  -3.658
  111   1HD   ARG  14          1HD       ARG  14  -8.957   3.878  -2.285
  112   2HD   ARG  14          2HD       ARG  14  -7.876   3.821  -0.881
  113    HE   ARG  14           HE       ARG  14  -7.721   5.960  -2.979
  114   1HH1  ARG  14          1HH1      ARG  14  -5.590   5.226  -0.753
  115   2HH1  ARG  14          2HH1      ARG  14  -5.855   6.546   0.332
  116   1HH2  ARG  14          1HH2      ARG  14  -8.864   7.495  -1.157
  117   2HH2  ARG  14          2HH2      ARG  14  -7.731   7.844   0.102
  118    H    ARG  15           H        ARG  15  -5.828  -0.950  -1.485
  119    HA   ARG  15           HA       ARG  15  -3.431  -0.887   0.066
  120   1HB   ARG  15          1HB       ARG  15  -5.044  -3.281  -0.884
  121   2HB   ARG  15          2HB       ARG  15  -3.916  -3.277   0.465
  122   1HG   ARG  15          1HG       ARG  15  -6.245  -1.367   0.417
  123   2HG   ARG  15          2HG       ARG  15  -6.467  -3.028   0.949
  124   1HD   ARG  15          1HD       ARG  15  -4.477  -2.574   2.555
  125   2HD   ARG  15          2HD       ARG  15  -4.782  -0.858   2.207
  126    HE   ARG  15           HE       ARG  15  -6.841  -2.713   3.332
  127   1HH1  ARG  15          1HH1      ARG  15  -7.883  -0.236   1.936
  128   2HH1  ARG  15          2HH1      ARG  15  -8.030   0.871   3.254
  129   1HH2  ARG  15          1HH2      ARG  15  -6.005  -1.001   5.383
  130   2HH2  ARG  15          2HH2      ARG  15  -6.951   0.437   5.230
  131    H    LYS  16           H        LYS  16  -4.171  -2.360  -3.098
  132    HA   LYS  16           HA       LYS  16  -1.610  -3.660  -3.451
  133   1HB   LYS  16          1HB       LYS  16  -3.745  -4.249  -4.616
  134   2HB   LYS  16          2HB       LYS  16  -3.667  -2.717  -5.484
  135   1HG   LYS  16          1HG       LYS  16  -1.708  -3.355  -6.661
  136   2HG   LYS  16          2HG       LYS  16  -1.408  -4.724  -5.596
  137   1HD   LYS  16          1HD       LYS  16  -3.768  -4.455  -7.482
  138   2HD   LYS  16          2HD       LYS  16  -2.332  -5.415  -7.797
  139   1HE   LYS  16          1HE       LYS  16  -4.447  -5.881  -5.675
  140   2HE   LYS  16          2HE       LYS  16  -4.000  -6.945  -7.013
  141   1HZ   LYS  16          1HZ       LYS  16  -1.644  -6.761  -5.858
  142   2HZ   LYS  16          2HZ       LYS  16  -2.606  -6.452  -4.486
  143   3HZ   LYS  16          3HZ       LYS  16  -2.801  -7.895  -5.346
  144    H    ILE  17           H        ILE  17  -2.948  -0.548  -4.663
  145    HA   ILE  17           HA       ILE  17  -0.573   0.261  -6.031
  146    HB   ILE  17           HB       ILE  17  -3.176   1.129  -5.774
  147   1HG1  ILE  17          1HG1      ILE  17  -0.971   2.868  -6.844
  148   2HG1  ILE  17          2HG1      ILE  17  -1.431   1.359  -7.627
  149   1HG2  ILE  17          1HG2      ILE  17  -1.434   3.246  -4.481
  150   2HG2  ILE  17          2HG2      ILE  17  -3.080   3.497  -5.061
  151   3HG2  ILE  17          3HG2      ILE  17  -2.778   2.398  -3.718
  152   1HD1  ILE  17          1HD1      ILE  17  -3.870   2.390  -7.421
  153   2HD1  ILE  17          2HD1      ILE  17  -2.979   3.909  -7.373
  154   3HD1  ILE  17          3HD1      ILE  17  -2.813   2.832  -8.760
  155    H    ALA  18           H        ALA  18  -1.628   0.617  -2.665
  156    HA   ALA  18           HA       ALA  18   0.502   2.341  -1.771
  157   1HB   ALA  18          1HB       ALA  18  -1.675   1.899  -0.594
  158   2HB   ALA  18          2HB       ALA  18  -1.108   0.266  -0.242
  159   3HB   ALA  18          3HB       ALA  18  -0.274   1.657   0.451
  160    H    LYS  19           H        LYS  19   0.141  -1.217  -2.016
  161    HA   LYS  19           HA       LYS  19   2.503  -2.031  -0.642
  162   1HB   LYS  19          1HB       LYS  19   0.559  -3.414  -1.560
  163   2HB   LYS  19          2HB       LYS  19   1.312  -3.268  -3.143
  164   1HG   LYS  19          1HG       LYS  19   2.704  -4.965  -2.673
  165   2HG   LYS  19          2HG       LYS  19   3.313  -4.105  -1.262
  166   1HD   LYS  19          1HD       LYS  19   2.265  -5.553   0.090
  167   2HD   LYS  19          2HD       LYS  19   0.714  -5.104  -0.609
  168   1HE   LYS  19          1HE       LYS  19   2.570  -7.132  -1.893
  169   2HE   LYS  19          2HE       LYS  19   1.280  -7.575  -0.767
  170   1HZ   LYS  19          1HZ       LYS  19  -0.065  -5.965  -2.406
  171   2HZ   LYS  19          2HZ       LYS  19   1.090  -6.583  -3.496
  172   3HZ   LYS  19          3HZ       LYS  19   0.073  -7.642  -2.654
  173    H    ARG  20           H        ARG  20   1.953  -0.947  -3.978
  174    HA   ARG  20           HA       ARG  20   4.653  -1.401  -4.950
  175   1HB   ARG  20          1HB       ARG  20   2.429   0.435  -5.922
  176   2HB   ARG  20          2HB       ARG  20   3.855  -0.009  -6.849
  177   1HG   ARG  20          1HG       ARG  20   1.963  -2.107  -5.774
  178   2HG   ARG  20          2HG       ARG  20   1.675  -1.308  -7.317
  179   1HD   ARG  20          1HD       ARG  20   4.282  -2.000  -7.641
  180   2HD   ARG  20          2HD       ARG  20   3.738  -3.318  -6.590
  181    HE   ARG  20           HE       ARG  20   1.764  -2.946  -8.627
  182   1HH1  ARG  20          1HH1      ARG  20   4.149  -2.651 -10.346
  183   2HH1  ARG  20          2HH1      ARG  20   4.537  -4.283 -10.760
  184   1HH2  ARG  20          1HH2      ARG  20   2.619  -5.643  -8.174
  185   2HH2  ARG  20          2HH2      ARG  20   3.660  -6.006  -9.504
  186    H    SER  21           H        SER  21   2.854   1.399  -3.661
  187    HA   SER  21           HA       SER  21   4.906   3.385  -3.950
  188   1HB   SER  21          1HB       SER  21   2.528   3.070  -2.098
  189   2HB   SER  21          2HB       SER  21   3.532   4.514  -2.133
  190    HG   SER  21           HG       SER  21   1.831   4.809  -3.555
  191    H    ILE  22           H        ILE  22   3.999   1.276  -1.209
  192    HA   ILE  22           HA       ILE  22   5.825   2.213   0.739
  193    HB   ILE  22           HB       ILE  22   4.476  -0.434   0.187
  194   1HG1  ILE  22          1HG1      ILE  22   4.088   1.355   2.575
  195   2HG1  ILE  22          2HG1      ILE  22   3.335   1.772   1.037
  196   1HG2  ILE  22          1HG2      ILE  22   6.316   0.263   2.492
  197   2HG2  ILE  22          2HG2      ILE  22   5.123  -1.034   2.574
  198   3HG2  ILE  22          3HG2      ILE  22   6.433  -1.115   1.398
  199   1HD1  ILE  22          1HD1      ILE  22   3.021  -0.944   2.339
  200   2HD1  ILE  22          2HD1      ILE  22   1.892   0.386   2.598
  201   3HD1  ILE  22          3HD1      ILE  22   2.104  -0.288   0.982
  202    H    LYS  23           H        LYS  23   6.288  -0.325  -1.756
  203    HA   LYS  23           HA       LYS  23   8.962  -1.054  -0.992
  204   1HB   LYS  23          1HB       LYS  23   7.180  -1.390  -3.373
  205   2HB   LYS  23          2HB       LYS  23   8.904  -1.703  -3.585
  206   1HG   LYS  23          1HG       LYS  23   8.669  -3.107  -1.394
  207   2HG   LYS  23          2HG       LYS  23   6.949  -3.104  -1.780
  208   1HD   LYS  23          1HD       LYS  23   9.014  -3.903  -3.835
  209   2HD   LYS  23          2HD       LYS  23   8.375  -5.064  -2.674
  210   1HE   LYS  23          1HE       LYS  23   6.029  -4.251  -3.455
  211   2HE   LYS  23          2HE       LYS  23   6.895  -3.582  -4.847
  212   1HZ   LYS  23          1HZ       LYS  23   7.497  -6.352  -4.046
  213   2HZ   LYS  23          2HZ       LYS  23   6.045  -6.042  -4.870
  214   3HZ   LYS  23          3HZ       LYS  23   7.528  -5.628  -5.580
  215    H    THR  24           H        THR  24   7.757   1.279  -3.454
  216    HA   THR  24           HA       THR  24  10.361   2.119  -4.352
  217    HB   THR  24           HB       THR  24   7.674   3.560  -4.311
  218    HG1  THR  24           HG1      THR  24   7.303   2.004  -5.694
  219   1HG2  THR  24          1HG2      THR  24  10.325   4.261  -5.471
  220   2HG2  THR  24          2HG2      THR  24   8.904   4.556  -6.474
  221   3HG2  THR  24          3HG2      THR  24   9.035   5.311  -4.886
  222    H    LEU  25           H        LEU  25   8.151   3.274  -1.799
  223    HA   LEU  25           HA       LEU  25   9.702   5.520  -0.922
  224   1HB   LEU  25          1HB       LEU  25   7.233   4.718  -0.432
  225   2HB   LEU  25          2HB       LEU  25   7.987   3.850   0.904
  226    HG   LEU  25           HG       LEU  25   9.119   6.118   1.449
  227   1HD1  LEU  25          1HD1      LEU  25   8.264   7.089  -0.782
  228   2HD1  LEU  25          2HD1      LEU  25   6.692   7.199   0.009
  229   3HD1  LEU  25          3HD1      LEU  25   8.070   8.093   0.653
  230   1HD2  LEU  25          1HD2      LEU  25   6.129   5.723   1.813
  231   2HD2  LEU  25          2HD2      LEU  25   7.390   5.061   2.851
  232   3HD2  LEU  25          3HD2      LEU  25   7.134   6.803   2.776
  233    H    GLU  26           H        GLU  26   9.607   2.092   0.146
  234    HA   GLU  26           HA       GLU  26  11.450   2.231   2.291
  235   1HB   GLU  26          1HB       GLU  26  10.563   0.117   0.348
  236   2HB   GLU  26          2HB       GLU  26  11.901  -0.233   1.445
  237   1HG   GLU  26          1HG       GLU  26   9.500   1.042   2.653
  238   2HG   GLU  26          2HG       GLU  26   9.326  -0.632   2.131
  239    H    HIS  27           H        HIS  27  12.059   1.858  -1.211
  240    HA   HIS  27           HA       HIS  27  14.901   1.471  -1.066
  241   1HB   HIS  27          1HB       HIS  27  13.301   1.107  -3.024
  242   2HB   HIS  27          2HB       HIS  27  13.305   2.854  -3.249
  243    HD1  HIS  27           HD1      HIS  27  16.049   0.234  -2.729
  244    HD2  HIS  27           HD2      HIS  27  15.167   3.500  -5.164
  245    HE1  HIS  27           HE1      HIS  27  18.006   0.495  -4.311
  246    H    LYS  28           H        LYS  28  12.879   4.384  -1.420
  247    HA   LYS  28           HA       LYS  28  15.023   6.316  -1.522
  248   1HB   LYS  28          1HB       LYS  28  12.061   6.415  -0.889
  249   2HB   LYS  28          2HB       LYS  28  13.059   7.865  -0.914
  250   1HG   LYS  28          1HG       LYS  28  13.713   7.355  -3.256
  251   2HG   LYS  28          2HG       LYS  28  12.660   5.942  -3.226
  252   1HD   LYS  28          1HD       LYS  28  10.884   7.801  -2.427
  253   2HD   LYS  28          2HD       LYS  28  11.951   8.834  -3.375
  254   1HE   LYS  28          1HE       LYS  28  11.339   6.319  -4.758
  255   2HE   LYS  28          2HE       LYS  28   9.889   7.266  -4.398
  256   1HZ   LYS  28          1HZ       LYS  28  12.344   8.377  -5.668
  257   2HZ   LYS  28          2HZ       LYS  28  10.939   7.918  -6.507
  258   3HZ   LYS  28          3HZ       LYS  28  10.878   9.198  -5.402
  259    H    ARG  29           H        ARG  29  12.983   5.034   1.109
  260    HA   ARG  29           HA       ARG  29  13.920   6.686   3.238
  261   1HB   ARG  29          1HB       ARG  29  12.245   4.364   2.844
  262   2HB   ARG  29          2HB       ARG  29  13.277   4.110   4.244
  263   1HG   ARG  29          1HG       ARG  29  11.376   5.192   5.119
  264   2HG   ARG  29          2HG       ARG  29  12.581   6.470   4.988
  265   1HD   ARG  29          1HD       ARG  29  11.402   7.591   3.379
  266   2HD   ARG  29          2HD       ARG  29  10.889   6.096   2.573
  267    HE   ARG  29           HE       ARG  29   9.051   5.914   4.102
  268   1HH1  ARG  29          1HH1      ARG  29  10.550   6.943   6.544
  269   2HH1  ARG  29          2HH1      ARG  29   9.713   8.420   6.870
  270   1HH2  ARG  29          1HH2      ARG  29   8.191   8.548   3.734
  271   2HH2  ARG  29          2HH2      ARG  29   8.364   9.338   5.261
  272    H    GLU  30           H        GLU  30  15.246   3.650   1.897
  273    HA   GLU  30           HA       GLU  30  17.153   3.084   3.943
  274   1HB   GLU  30          1HB       GLU  30  16.363   1.981   1.526
  275   2HB   GLU  30          2HB       GLU  30  18.023   2.474   1.206
  276   1HG   GLU  30          1HG       GLU  30  17.440   1.043   3.771
  277   2HG   GLU  30          2HG       GLU  30  17.475   0.107   2.282
  278    H    ASN  31           H        ASN  31  17.241   5.459   1.319
  279    HA   ASN  31           HA       ASN  31  19.729   6.605   2.439
  280   1HB   ASN  31          1HB       ASN  31  19.585   4.925   0.100
  281   2HB   ASN  31          2HB       ASN  31  20.027   6.557  -0.402
  282   1HD2  ASN  31          2HD2      ASN  31  21.874   7.589   0.991
  283   2HD2  ASN  31          1HD2      ASN  31  23.110   6.538   1.492
  284    H    ALA  32           H        ALA  32  17.803   8.061   3.013
  285    HA   ALA  32           HA       ALA  32  16.805   9.743   0.780
  286   1HB   ALA  32          1HB       ALA  32  16.128   9.628   3.728
  287   2HB   ALA  32          2HB       ALA  32  15.285  10.607   2.529
  288   3HB   ALA  32          3HB       ALA  32  15.233   8.847   2.426
  289    H    LYS  33           H        LYS  33  18.290  11.266   0.214
  290    HA   LYS  33           HA       LYS  33  19.626  13.143   0.266
  291   1HB   LYS  33          1HB       LYS  33  17.593  14.003   1.385
  292   2HB   LYS  33          2HB       LYS  33  18.266  13.548   2.948
  293   1HG   LYS  33          1HG       LYS  33  20.194  15.054   2.541
  294   2HG   LYS  33          2HG       LYS  33  19.474  15.539   1.005
  295   1HD   LYS  33          1HD       LYS  33  17.427  15.845   2.923
  296   2HD   LYS  33          2HD       LYS  33  18.882  16.489   3.677
  297   1HE   LYS  33          1HE       LYS  33  18.043  18.356   2.516
  298   2HE   LYS  33          2HE       LYS  33  19.230  17.709   1.372
  299   1HZ   LYS  33          1HZ       LYS  33  17.392  16.367   0.389
  300   2HZ   LYS  33          2HZ       LYS  33  16.296  17.225   1.368
  301   3HZ   LYS  33          3HZ       LYS  33  17.208  18.038   0.191
  302    H    GLU  34           H        GLU  34  19.837  12.647   3.807
  303    HA   GLU  34           HA       GLU  34  22.777  12.305   3.495
  304   1HB   GLU  34          1HB       GLU  34  20.939  13.089   5.770
  305   2HB   GLU  34          2HB       GLU  34  22.651  12.752   6.016
  306   1HG   GLU  34          1HG       GLU  34  23.051  14.460   4.104
  307   2HG   GLU  34          2HG       GLU  34  21.391  14.967   4.406
  Start of MODEL   15
    1   1H    CYS   1          1H        CYS   1 -21.281 -14.612   3.334
    2   2H    CYS   1          2H        CYS   1 -22.410 -15.586   2.517
    3   3H    CYS   1          3H        CYS   1 -20.880 -16.200   2.912
    4    HA   CYS   1           HA       CYS   1 -20.847 -15.678   0.585
    5   1HB   CYS   1          1HB       CYS   1 -22.084 -13.133   1.637
    6   2HB   CYS   1          2HB       CYS   1 -21.312 -13.182   0.056
    7    HG   CYS   1           HG       CYS   1 -23.398 -14.194  -0.794
    8    H    ALA   2           H        ALA   2 -18.998 -14.609  -0.433
    9    HA   ALA   2           HA       ALA   2 -16.910 -13.784   1.528
   10   1HB   ALA   2          1HB       ALA   2 -16.635 -15.670  -0.164
   11   2HB   ALA   2          2HB       ALA   2 -16.644 -14.434  -1.423
   12   3HB   ALA   2          3HB       ALA   2 -15.373 -14.440  -0.202
   13    H    VAL   3           H        VAL   3 -18.163 -11.717   1.707
   14    HA   VAL   3           HA       VAL   3 -17.785  -9.750  -0.512
   15    HB   VAL   3           HB       VAL   3 -19.302  -8.386   0.785
   16   1HG1  VAL   3          1HG1      VAL   3 -20.200 -10.365  -0.570
   17   2HG1  VAL   3          2HG1      VAL   3 -20.424 -11.183   0.976
   18   3HG1  VAL   3          3HG1      VAL   3 -21.283  -9.680   0.642
   19   1HG2  VAL   3          1HG2      VAL   3 -18.674 -10.369   2.946
   20   2HG2  VAL   3          2HG2      VAL   3 -18.787  -8.617   3.032
   21   3HG2  VAL   3          3HG2      VAL   3 -20.256  -9.589   2.954
   22    H    GLU   4           H        GLU   4 -15.593 -10.829   1.309
   23    HA   GLU   4           HA       GLU   4 -13.722 -10.109   2.405
   24   1HB   GLU   4          1HB       GLU   4 -14.577  -7.446   1.231
   25   2HB   GLU   4          2HB       GLU   4 -12.977  -7.805   1.872
   26   1HG   GLU   4          1HG       GLU   4 -14.188  -9.494  -0.319
   27   2HG   GLU   4          2HG       GLU   4 -13.311  -8.017  -0.686
   28    H    LEU   5           H        LEU   5 -16.519  -9.876   3.695
   29    HA   LEU   5           HA       LEU   5 -17.496  -9.211   5.664
   30   1HB   LEU   5          1HB       LEU   5 -14.599  -9.223   6.527
   31   2HB   LEU   5          2HB       LEU   5 -16.000  -9.452   7.569
   32    HG   LEU   5           HG       LEU   5 -15.295 -11.261   5.238
   33   1HD1  LEU   5          1HD1      LEU   5 -13.606 -11.384   7.033
   34   2HD1  LEU   5          2HD1      LEU   5 -14.887 -11.739   8.195
   35   3HD1  LEU   5          3HD1      LEU   5 -14.538 -12.873   6.891
   36   1HD2  LEU   5          1HD2      LEU   5 -17.393 -11.363   7.418
   37   2HD2  LEU   5          2HD2      LEU   5 -17.628 -11.460   5.673
   38   3HD2  LEU   5          3HD2      LEU   5 -16.890 -12.807   6.539
   39    H    ARG   6           H        ARG   6 -16.418  -6.932   3.838
   40    HA   ARG   6           HA       ARG   6 -17.140  -4.723   5.608
   41   1HB   ARG   6          1HB       ARG   6 -14.614  -5.569   5.849
   42   2HB   ARG   6          2HB       ARG   6 -14.407  -4.495   4.469
   43   1HG   ARG   6          1HG       ARG   6 -15.147  -2.602   5.679
   44   2HG   ARG   6          2HG       ARG   6 -15.887  -3.590   6.938
   45   1HD   ARG   6          1HD       ARG   6 -13.926  -2.967   8.026
   46   2HD   ARG   6          2HD       ARG   6 -13.367  -4.455   7.238
   47    HE   ARG   6           HE       ARG   6 -12.347  -3.101   5.481
   48   1HH1  ARG   6          1HH1      ARG   6 -14.117  -0.726   5.542
   49   2HH1  ARG   6          2HH1      ARG   6 -13.133   0.473   6.313
   50   1HH2  ARG   6          1HH2      ARG   6 -10.882  -1.868   7.606
   51   2HH2  ARG   6          2HH2      ARG   6 -11.268  -0.187   7.494
   52    H    SER   7           H        SER   7 -17.609  -5.921   2.678
   53    HA   SER   7           HA       SER   7 -18.204  -5.150   0.629
   54   1HB   SER   7          1HB       SER   7 -19.311  -3.110   0.585
   55   2HB   SER   7          2HB       SER   7 -19.303  -3.479   2.288
   56    HG   SER   7           HG       SER   7 -17.204  -2.113   2.127
   57    HA   PRO   8           HA       PRO   8 -14.014  -4.201  -0.705
   58   1HB   PRO   8          1HB       PRO   8 -13.971  -5.945  -2.786
   59   2HB   PRO   8          2HB       PRO   8 -13.673  -6.407  -1.100
   60   1HG   PRO   8          1HG       PRO   8 -15.998  -6.932  -2.792
   61   2HG   PRO   8          2HG       PRO   8 -15.428  -7.784  -1.352
   62   1HD   PRO   8          1HD       PRO   8 -17.549  -5.913  -1.527
   63   2HD   PRO   8          2HD       PRO   8 -16.906  -6.699  -0.074
   64    H    GLY   9           H        GLY   9 -13.105  -3.264  -2.654
   65   1HA   GLY   9          1HA       GLY   9 -14.197  -2.762  -5.115
   66   2HA   GLY   9          2HA       GLY   9 -14.983  -1.553  -4.101
   67    H    ILE  10           H        ILE  10 -13.984   0.362  -4.214
   68    HA   ILE  10           HA       ILE  10 -11.485   0.908  -5.376
   69    HB   ILE  10           HB       ILE  10 -13.393   2.460  -5.049
   70   1HG1  ILE  10          1HG1      ILE  10 -10.709   3.382  -3.995
   71   2HG1  ILE  10          2HG1      ILE  10 -11.175   3.275  -5.690
   72   1HG2  ILE  10          1HG2      ILE  10 -13.735   1.843  -2.591
   73   2HG2  ILE  10          2HG2      ILE  10 -12.354   2.884  -2.241
   74   3HG2  ILE  10          3HG2      ILE  10 -13.805   3.561  -2.977
   75   1HD1  ILE  10          1HD1      ILE  10 -12.992   4.933  -5.256
   76   2HD1  ILE  10          2HD1      ILE  10 -12.409   5.093  -3.599
   77   3HD1  ILE  10          3HD1      ILE  10 -11.383   5.587  -4.944
   78    H    SER  11           H        SER  11 -12.184   0.447  -1.882
   79    HA   SER  11           HA       SER  11  -9.572   1.189  -0.973
   80   1HB   SER  11          1HB       SER  11 -11.879   0.779   0.254
   81   2HB   SER  11          2HB       SER  11 -11.222  -0.841   0.476
   82    HG   SER  11           HG       SER  11 -10.243   1.662   1.360
   83    H    ARG  12           H        ARG  12 -10.844  -1.974  -2.085
   84    HA   ARG  12           HA       ARG  12  -8.615  -3.558  -1.226
   85   1HB   ARG  12          1HB       ARG  12 -10.971  -3.852  -2.873
   86   2HB   ARG  12          2HB       ARG  12  -9.592  -4.552  -3.722
   87   1HG   ARG  12          1HG       ARG  12  -9.090  -6.024  -1.915
   88   2HG   ARG  12          2HG       ARG  12 -10.157  -5.155  -0.816
   89   1HD   ARG  12          1HD       ARG  12 -11.586  -6.875  -1.350
   90   2HD   ARG  12          2HD       ARG  12 -11.956  -5.825  -2.729
   91    HE   ARG  12           HE       ARG  12  -9.780  -7.251  -3.636
   92   1HH1  ARG  12          1HH2      ARG  12 -12.508  -7.730  -4.743
   93   2HH1  ARG  12          2HH2      ARG  12 -12.758  -9.409  -4.413
   94   1HH2  ARG  12          1HH1      ARG  12 -10.196  -9.577  -2.049
   95   2HH2  ARG  12          2HH1      ARG  12 -11.433 -10.469  -2.860
   96    H    PHE  13           H        PHE  13  -9.191  -1.628  -4.154
   97    HA   PHE  13           HA       PHE  13  -6.648  -2.303  -5.409
   98   1HB   PHE  13          1HB       PHE  13  -7.944  -1.576  -7.120
   99   2HB   PHE  13          2HB       PHE  13  -9.131  -0.933  -6.009
  100    HD1  PHE  13           HD1      PHE  13  -5.871  -0.128  -7.678
  101    HD2  PHE  13           HD2      PHE  13  -9.423   1.398  -5.806
  102    HE1  PHE  13           HE1      PHE  13  -5.249   2.174  -8.360
  103    HE2  PHE  13           HE2      PHE  13  -8.799   3.693  -6.485
  104    HZ   PHE  13           HZ       PHE  13  -6.713   4.085  -7.761
  105    H    ARG  14           H        ARG  14  -7.939   0.476  -3.580
  106    HA   ARG  14           HA       ARG  14  -5.737   2.240  -3.593
  107   1HB   ARG  14          1HB       ARG  14  -8.016   2.694  -2.795
  108   2HB   ARG  14          2HB       ARG  14  -7.775   1.587  -1.451
  109   1HG   ARG  14          1HG       ARG  14  -5.805   3.124  -0.785
  110   2HG   ARG  14          2HG       ARG  14  -6.508   4.289  -1.911
  111   1HD   ARG  14          1HD       ARG  14  -8.642   4.227  -0.694
  112   2HD   ARG  14          2HD       ARG  14  -7.985   3.019   0.426
  113    HE   ARG  14           HE       ARG  14  -6.608   5.654   0.147
  114   1HH1  ARG  14          1HH1      ARG  14  -5.696   3.609   2.142
  115   2HH1  ARG  14          2HH1      ARG  14  -6.441   4.160   3.600
  116   1HH2  ARG  14          1HH2      ARG  14  -8.708   6.235   1.943
  117   2HH2  ARG  14          2HH2      ARG  14  -8.173   5.669   3.486
  118    H    ARG  15           H        ARG  15  -6.432  -0.460  -1.333
  119    HA   ARG  15           HA       ARG  15  -4.185  -0.113   0.403
  120   1HB   ARG  15          1HB       ARG  15  -6.341  -1.572   0.572
  121   2HB   ARG  15          2HB       ARG  15  -5.399  -2.783  -0.301
  122   1HG   ARG  15          1HG       ARG  15  -3.585  -2.441   1.464
  123   2HG   ARG  15          2HG       ARG  15  -4.789  -1.546   2.390
  124   1HD   ARG  15          1HD       ARG  15  -5.893  -3.439   3.008
  125   2HD   ARG  15          2HD       ARG  15  -5.747  -4.163   1.395
  126    HE   ARG  15           HE       ARG  15  -3.624  -5.065   2.001
  127   1HH1  ARG  15          1HH1      ARG  15  -2.421  -2.745   3.386
  128   2HH1  ARG  15          2HH1      ARG  15  -2.353  -3.264   5.034
  129   1HH2  ARG  15          1HH2      ARG  15  -4.644  -5.859   4.562
  130   2HH2  ARG  15          2HH2      ARG  15  -3.634  -5.054   5.711
  131    H    LYS  16           H        LYS  16  -4.547  -1.838  -2.686
  132    HA   LYS  16           HA       LYS  16  -1.935  -3.104  -2.632
  133   1HB   LYS  16          1HB       LYS  16  -4.114  -3.693  -3.950
  134   2HB   LYS  16          2HB       LYS  16  -3.546  -2.487  -5.106
  135   1HG   LYS  16          1HG       LYS  16  -1.334  -3.733  -5.158
  136   2HG   LYS  16          2HG       LYS  16  -2.123  -5.016  -4.242
  137   1HD   LYS  16          1HD       LYS  16  -3.092  -5.831  -6.099
  138   2HD   LYS  16          2HD       LYS  16  -3.791  -4.260  -6.476
  139   1HE   LYS  16          1HE       LYS  16  -2.402  -4.751  -8.342
  140   2HE   LYS  16          2HE       LYS  16  -1.433  -3.633  -7.367
  141   1HZ   LYS  16          1HZ       LYS  16  -1.276  -6.591  -7.072
  142   2HZ   LYS  16          2HZ       LYS  16  -0.237  -5.697  -8.075
  143   3HZ   LYS  16          3HZ       LYS  16  -0.243  -5.427  -6.400
  144    H    ILE  17           H        ILE  17  -3.217  -0.042  -3.968
  145    HA   ILE  17           HA       ILE  17  -0.987   0.741  -5.554
  146    HB   ILE  17           HB       ILE  17  -2.933   2.365  -3.879
  147   1HG1  ILE  17          1HG1      ILE  17  -4.125   1.124  -5.569
  148   2HG1  ILE  17          2HG1      ILE  17  -4.011   2.790  -6.116
  149   1HG2  ILE  17          1HG2      ILE  17  -0.972   3.256  -5.997
  150   2HG2  ILE  17          2HG2      ILE  17  -2.362   4.222  -5.504
  151   3HG2  ILE  17          3HG2      ILE  17  -1.106   3.824  -4.333
  152   1HD1  ILE  17          1HD1      ILE  17  -1.836   1.930  -7.337
  153   2HD1  ILE  17          2HD1      ILE  17  -2.606   0.353  -7.155
  154   3HD1  ILE  17          3HD1      ILE  17  -3.422   1.637  -8.045
  155    H    ALA  18           H        ALA  18  -1.663   1.282  -2.085
  156    HA   ALA  18           HA       ALA  18   0.800   2.670  -1.498
  157   1HB   ALA  18          1HB       ALA  18  -1.451   2.470  -0.174
  158   2HB   ALA  18          2HB       ALA  18  -0.747   0.987   0.474
  159   3HB   ALA  18          3HB       ALA  18   0.058   2.534   0.739
  160    H    LYS  19           H        LYS  19  -0.153  -0.774  -1.323
  161    HA   LYS  19           HA       LYS  19   2.192  -1.860  -0.131
  162   1HB   LYS  19          1HB       LYS  19  -0.137  -2.755  -1.646
  163   2HB   LYS  19          2HB       LYS  19   1.297  -3.689  -2.057
  164   1HG   LYS  19          1HG       LYS  19   1.691  -4.035   0.406
  165   2HG   LYS  19          2HG       LYS  19   0.130  -3.272   0.706
  166   1HD   LYS  19          1HD       LYS  19  -0.391  -5.566   0.655
  167   2HD   LYS  19          2HD       LYS  19  -0.820  -5.011  -0.962
  168   1HE   LYS  19          1HE       LYS  19   1.397  -5.787  -1.798
  169   2HE   LYS  19          2HE       LYS  19   1.763  -6.415  -0.182
  170   1HZ   LYS  19          1HZ       LYS  19  -0.717  -7.170  -1.627
  171   2HZ   LYS  19          2HZ       LYS  19   0.729  -8.034  -1.809
  172   3HZ   LYS  19          3HZ       LYS  19  -0.011  -7.922  -0.284
  173    H    ARG  20           H        ARG  20   1.554  -0.796  -3.440
  174    HA   ARG  20           HA       ARG  20   3.962  -1.978  -4.595
  175   1HB   ARG  20          1HB       ARG  20   1.536  -0.624  -5.429
  176   2HB   ARG  20          2HB       ARG  20   2.933   0.052  -6.257
  177   1HG   ARG  20          1HG       ARG  20   2.824  -2.916  -6.079
  178   2HG   ARG  20          2HG       ARG  20   1.632  -2.147  -7.123
  179   1HD   ARG  20          1HD       ARG  20   3.428  -2.437  -8.600
  180   2HD   ARG  20          2HD       ARG  20   3.723  -0.788  -8.021
  181    HE   ARG  20           HE       ARG  20   5.186  -1.971  -6.217
  182   1HH1  ARG  20          1HH1      ARG  20   4.687  -4.673  -7.588
  183   2HH1  ARG  20          2HH1      ARG  20   6.152  -4.860  -8.485
  184   1HH2  ARG  20          1HH2      ARG  20   7.059  -1.500  -8.161
  185   2HH2  ARG  20          2HH2      ARG  20   7.520  -3.033  -8.817
  186    H    SER  21           H        SER  21   2.981   1.285  -3.486
  187    HA   SER  21           HA       SER  21   5.414   2.596  -4.362
  188   1HB   SER  21          1HB       SER  21   3.001   3.495  -3.766
  189   2HB   SER  21          2HB       SER  21   3.692   3.645  -2.154
  190    HG   SER  21           HG       SER  21   5.280   4.989  -3.012
  191    H    ILE  22           H        ILE  22   4.551   0.891  -1.381
  192    HA   ILE  22           HA       ILE  22   6.394   1.996   0.445
  193    HB   ILE  22           HB       ILE  22   5.166  -0.735   0.043
  194   1HG1  ILE  22          1HG1      ILE  22   4.826   1.135   2.377
  195   2HG1  ILE  22          2HG1      ILE  22   3.958   1.427   0.869
  196   1HG2  ILE  22          1HG2      ILE  22   7.175   0.092   2.139
  197   2HG2  ILE  22          2HG2      ILE  22   5.945  -1.120   2.490
  198   3HG2  ILE  22          3HG2      ILE  22   7.112  -1.398   1.199
  199   1HD1  ILE  22          1HD1      ILE  22   3.357  -1.144   1.106
  200   2HD1  ILE  22          2HD1      ILE  22   3.675  -0.831   2.812
  201   3HD1  ILE  22          3HD1      ILE  22   2.424   0.081   1.966
  202    H    LYS  23           H        LYS  23   6.949  -0.731  -1.820
  203    HA   LYS  23           HA       LYS  23   9.666  -1.274  -1.220
  204   1HB   LYS  23          1HB       LYS  23   7.902  -2.399  -2.800
  205   2HB   LYS  23          2HB       LYS  23   8.590  -1.339  -4.031
  206   1HG   LYS  23          1HG       LYS  23  10.495  -2.890  -2.337
  207   2HG   LYS  23          2HG       LYS  23   9.572  -3.785  -3.541
  208   1HD   LYS  23          1HD       LYS  23  10.731  -1.266  -4.548
  209   2HD   LYS  23          2HD       LYS  23  11.924  -2.461  -4.040
  210   1HE   LYS  23          1HE       LYS  23  11.115  -4.094  -5.570
  211   2HE   LYS  23          2HE       LYS  23   9.619  -3.191  -5.868
  212   1HZ   LYS  23          1HZ       LYS  23  12.359  -2.229  -6.530
  213   2HZ   LYS  23          2HZ       LYS  23  11.233  -2.836  -7.643
  214   3HZ   LYS  23          3HZ       LYS  23  10.904  -1.395  -6.824
  215    H    THR  24           H        THR  24   8.278   1.157  -3.434
  216    HA   THR  24           HA       THR  24  10.831   2.132  -4.433
  217    HB   THR  24           HB       THR  24   8.181   3.601  -4.369
  218    HG1  THR  24           HG1      THR  24   8.997   1.629  -6.241
  219   1HG2  THR  24          1HG2      THR  24  10.559   3.597  -6.235
  220   2HG2  THR  24          2HG2      THR  24   9.015   4.353  -6.636
  221   3HG2  THR  24          3HG2      THR  24   9.948   4.933  -5.257
  222    H    LEU  25           H        LEU  25   8.560   3.099  -1.868
  223    HA   LEU  25           HA       LEU  25   9.819   5.540  -1.056
  224   1HB   LEU  25          1HB       LEU  25   7.620   3.907  -0.299
  225   2HB   LEU  25          2HB       LEU  25   8.615   4.076   1.140
  226    HG   LEU  25           HG       LEU  25   8.580   6.646   0.043
  227   1HD1  LEU  25          1HD1      LEU  25   5.871   5.316  -0.190
  228   2HD1  LEU  25          2HD1      LEU  25   6.096   7.064  -0.134
  229   3HD1  LEU  25          3HD1      LEU  25   6.778   6.129  -1.465
  230   1HD2  LEU  25          1HD2      LEU  25   6.955   5.357   2.259
  231   2HD2  LEU  25          2HD2      LEU  25   8.498   6.197   2.419
  232   3HD2  LEU  25          3HD2      LEU  25   7.042   7.100   2.002
  233    H    GLU  26           H        GLU  26  10.246   2.146  -0.027
  234    HA   GLU  26           HA       GLU  26  12.162   2.607   2.053
  235   1HB   GLU  26          1HB       GLU  26  11.462   0.278   0.258
  236   2HB   GLU  26          2HB       GLU  26  12.723   0.148   1.488
  237   1HG   GLU  26          1HG       GLU  26  11.208   0.546   3.259
  238   2HG   GLU  26          2HG       GLU  26   9.967   1.172   2.172
  239    H    HIS  27           H        HIS  27  12.644   1.751  -1.412
  240    HA   HIS  27           HA       HIS  27  15.460   1.660  -1.455
  241   1HB   HIS  27          1HB       HIS  27  13.270   2.116  -3.389
  242   2HB   HIS  27          2HB       HIS  27  14.853   2.693  -3.900
  243    HD1  HIS  27           HD1      HIS  27  12.894  -0.395  -3.359
  244    HD2  HIS  27           HD2      HIS  27  16.891   0.603  -3.994
  245    HE1  HIS  27           HE1      HIS  27  14.081  -2.547  -3.969
  246    H    LYS  28           H        LYS  28  13.424   4.525  -1.187
  247    HA   LYS  28           HA       LYS  28  15.742   6.317  -1.754
  248   1HB   LYS  28          1HB       LYS  28  12.758   6.767  -1.504
  249   2HB   LYS  28          2HB       LYS  28  13.926   8.047  -1.803
  250   1HG   LYS  28          1HG       LYS  28  13.977   5.666  -3.616
  251   2HG   LYS  28          2HG       LYS  28  12.657   6.814  -3.801
  252   1HD   LYS  28          1HD       LYS  28  14.083   7.986  -5.105
  253   2HD   LYS  28          2HD       LYS  28  14.845   8.484  -3.595
  254   1HE   LYS  28          1HE       LYS  28  16.519   6.782  -3.756
  255   2HE   LYS  28          2HE       LYS  28  15.642   5.942  -5.048
  256   1HZ   LYS  28          1HZ       LYS  28  16.723   8.710  -5.260
  257   2HZ   LYS  28          2HZ       LYS  28  17.445   7.329  -5.920
  258   3HZ   LYS  28          3HZ       LYS  28  15.930   7.838  -6.486
  259    H    ARG  29           H        ARG  29  13.223   5.709   0.738
  260    HA   ARG  29           HA       ARG  29  14.523   7.568   2.636
  261   1HB   ARG  29          1HB       ARG  29  12.046   7.412   2.183
  262   2HB   ARG  29          2HB       ARG  29  12.070   5.829   2.952
  263   1HG   ARG  29          1HG       ARG  29  11.566   7.073   4.806
  264   2HG   ARG  29          2HG       ARG  29  13.320   7.235   4.879
  265   1HD   ARG  29          1HD       ARG  29  12.970   9.337   3.372
  266   2HD   ARG  29          2HD       ARG  29  11.282   9.247   3.919
  267    HE   ARG  29           HE       ARG  29  13.626   9.747   5.664
  268   1HH1  ARG  29          1HH2      ARG  29  11.217  11.528   5.592
  269   2HH1  ARG  29          2HH2      ARG  29  10.365  11.054   7.019
  270   1HH2  ARG  29          1HH1      ARG  29  12.134   8.063   7.375
  271   2HH2  ARG  29          2HH1      ARG  29  10.893   9.061   8.045
  272    H    GLU  30           H        GLU  30  13.649   4.057   2.641
  273    HA   GLU  30           HA       GLU  30  14.834   3.442   5.159
  274   1HB   GLU  30          1HB       GLU  30  13.303   1.937   3.964
  275   2HB   GLU  30          2HB       GLU  30  14.469   1.742   2.664
  276   1HG   GLU  30          1HG       GLU  30  15.348   1.066   5.439
  277   2HG   GLU  30          2HG       GLU  30  14.255  -0.044   4.617
  278    H    ASN  31           H        ASN  31  16.241   3.119   1.866
  279    HA   ASN  31           HA       ASN  31  18.904   2.469   2.826
  280   1HB   ASN  31          1HB       ASN  31  18.051   1.856   0.584
  281   2HB   ASN  31          2HB       ASN  31  17.921   3.561   0.160
  282   1HD2  ASN  31          2HD2      ASN  31  19.996   4.794  -0.101
  283   2HD2  ASN  31          1HD2      ASN  31  21.445   3.954  -0.368
  284    H    ALA  32           H        ALA  32  17.565   5.411   1.302
  285    HA   ALA  32           HA       ALA  32  18.008   7.657   1.503
  286   1HB   ALA  32          1HB       ALA  32  17.815   6.789   3.964
  287   2HB   ALA  32          2HB       ALA  32  19.533   7.173   4.027
  288   3HB   ALA  32          3HB       ALA  32  18.358   8.432   3.638
  289    H    LYS  33           H        LYS  33  21.032   5.884   2.453
  290    HA   LYS  33           HA       LYS  33  22.488   7.474   0.399
  291   1HB   LYS  33          1HB       LYS  33  22.588   7.800   3.276
  292   2HB   LYS  33          2HB       LYS  33  24.161   7.313   2.662
  293   1HG   LYS  33          1HG       LYS  33  24.525   9.315   1.712
  294   2HG   LYS  33          2HG       LYS  33  22.938   9.330   0.947
  295   1HD   LYS  33          1HD       LYS  33  23.018   9.791   3.893
  296   2HD   LYS  33          2HD       LYS  33  23.630  11.081   2.866
  297   1HE   LYS  33          1HE       LYS  33  21.481  11.735   2.592
  298   2HE   LYS  33          2HE       LYS  33  21.249  10.284   1.605
  299   1HZ   LYS  33          1HZ       LYS  33  20.761   9.029   3.621
  300   2HZ   LYS  33          2HZ       LYS  33  20.946  10.427   4.565
  301   3HZ   LYS  33          3HZ       LYS  33  19.682  10.327   3.436
  302    H    GLU  34           H        GLU  34  24.747   6.574   0.122
  303    HA   GLU  34           HA       GLU  34  24.690   3.595   0.246
  304   1HB   GLU  34          1HB       GLU  34  26.350   5.564  -1.363
  305   2HB   GLU  34          2HB       GLU  34  26.447   3.810  -1.506
  306   1HG   GLU  34          1HG       GLU  34  23.722   4.328  -1.759
  307   2HG   GLU  34          2HG       GLU  34  24.477   5.658  -2.631
  Start of MODEL   16
    1   1H    CYS   1          1H        CYS   1 -27.579  -7.220   8.935
    2   2H    CYS   1          2H        CYS   1 -28.411  -6.301   7.780
    3   3H    CYS   1          3H        CYS   1 -28.406  -7.998   7.674
    4    HA   CYS   1           HA       CYS   1 -26.085  -8.055   7.143
    5   1HB   CYS   1          1HB       CYS   1 -27.985  -7.412   5.465
    6   2HB   CYS   1          2HB       CYS   1 -27.250  -5.810   5.503
    7    HG   CYS   1           HG       CYS   1 -25.006  -6.900   4.648
    8    H    ALA   2           H        ALA   2 -24.089  -7.158   7.606
    9    HA   ALA   2           HA       ALA   2 -24.000  -4.281   8.442
   10   1HB   ALA   2          1HB       ALA   2 -23.661  -6.042  10.194
   11   2HB   ALA   2          2HB       ALA   2 -22.242  -6.597   9.306
   12   3HB   ALA   2          3HB       ALA   2 -22.269  -4.977  10.001
   13    H    VAL   3           H        VAL   3 -23.753  -4.138   5.948
   14    HA   VAL   3           HA       VAL   3 -20.833  -4.130   5.249
   15    HB   VAL   3           HB       VAL   3 -21.398  -4.896   3.029
   16   1HG1  VAL   3          1HG1      VAL   3 -21.070  -6.559   4.947
   17   2HG1  VAL   3          2HG1      VAL   3 -22.819  -6.776   4.911
   18   3HG1  VAL   3          3HG1      VAL   3 -21.853  -7.173   3.492
   19   1HG2  VAL   3          1HG2      VAL   3 -24.233  -4.693   4.035
   20   2HG2  VAL   3          2HG2      VAL   3 -23.533  -4.049   2.552
   21   3HG2  VAL   3          3HG2      VAL   3 -23.828  -5.779   2.708
   22    H    GLU   4           H        GLU   4 -23.059  -2.029   5.998
   23    HA   GLU   4           HA       GLU   4 -23.551   0.160   5.473
   24   1HB   GLU   4          1HB       GLU   4 -20.978  -0.062   5.182
   25   2HB   GLU   4          2HB       GLU   4 -21.319   0.059   3.460
   26   1HG   GLU   4          1HG       GLU   4 -22.772   2.159   4.336
   27   2HG   GLU   4          2HG       GLU   4 -21.528   2.128   5.586
   28    H    LEU   5           H        LEU   5 -24.349  -2.248   3.514
   29    HA   LEU   5           HA       LEU   5 -25.551  -2.578   1.574
   30   1HB   LEU   5          1HB       LEU   5 -26.543   0.097   2.588
   31   2HB   LEU   5          2HB       LEU   5 -27.332  -0.789   1.299
   32    HG   LEU   5           HG       LEU   5 -28.545  -1.413   3.194
   33   1HD1  LEU   5          1HD1      LEU   5 -27.585  -3.401   1.903
   34   2HD1  LEU   5          2HD1      LEU   5 -26.467  -3.595   3.252
   35   3HD1  LEU   5          3HD1      LEU   5 -28.203  -3.726   3.521
   36   1HD2  LEU   5          1HD2      LEU   5 -26.701  -0.402   4.737
   37   2HD2  LEU   5          2HD2      LEU   5 -27.736  -1.681   5.370
   38   3HD2  LEU   5          3HD2      LEU   5 -26.104  -2.059   4.828
   39    H    ARG   6           H        ARG   6 -22.903  -1.356   1.202
   40    HA   ARG   6           HA       ARG   6 -23.195  -0.521  -1.575
   41   1HB   ARG   6          1HB       ARG   6 -23.704   1.498  -0.048
   42   2HB   ARG   6          2HB       ARG   6 -21.985   1.486   0.321
   43   1HG   ARG   6          1HG       ARG   6 -22.022   2.943  -1.477
   44   2HG   ARG   6          2HG       ARG   6 -21.722   1.422  -2.308
   45   1HD   ARG   6          1HD       ARG   6 -24.563   2.308  -1.860
   46   2HD   ARG   6          2HD       ARG   6 -23.627   3.018  -3.187
   47    HE   ARG   6           HE       ARG   6 -24.528   0.233  -3.024
   48   1HH1  ARG   6          1HH2      ARG   6 -24.526   1.814  -5.560
   49   2HH1  ARG   6          2HH2      ARG   6 -23.185   1.146  -6.422
   50   1HH2  ARG   6          1HH1      ARG   6 -21.815  -0.364  -3.573
   51   2HH2  ARG   6          2HH1      ARG   6 -21.618  -0.111  -5.269
   52    H    SER   7           H        SER   7 -20.859  -0.319   1.172
   53    HA   SER   7           HA       SER   7 -18.688  -1.078   1.413
   54   1HB   SER   7          1HB       SER   7 -19.236  -2.694  -1.099
   55   2HB   SER   7          2HB       SER   7 -17.938  -2.954   0.045
   56    HG   SER   7           HG       SER   7 -19.705  -3.255   1.641
   57    HA   PRO   8           HA       PRO   8 -16.488   1.826  -1.031
   58   1HB   PRO   8          1HB       PRO   8 -13.921   1.171  -0.379
   59   2HB   PRO   8          2HB       PRO   8 -15.023   2.058   0.696
   60   1HG   PRO   8          1HG       PRO   8 -14.275  -0.819   0.728
   61   2HG   PRO   8          2HG       PRO   8 -14.539   0.301   2.076
   62   1HD   PRO   8          1HD       PRO   8 -16.386  -1.519   1.304
   63   2HD   PRO   8          2HD       PRO   8 -16.801   0.039   2.051
   64    H    GLY   9           H        GLY   9 -14.562  -1.238  -1.251
   65   1HA   GLY   9          1HA       GLY   9 -14.221  -2.565  -3.200
   66   2HA   GLY   9          2HA       GLY   9 -15.059  -1.344  -4.160
   67    H    ILE  10           H        ILE  10 -13.840   0.884  -4.092
   68    HA   ILE  10           HA       ILE  10 -11.328   0.590  -5.395
   69    HB   ILE  10           HB       ILE  10 -12.981   2.446  -5.629
   70   1HG1  ILE  10          1HG1      ILE  10 -10.115   3.140  -4.957
   71   2HG1  ILE  10          2HG1      ILE  10 -10.757   2.687  -6.534
   72   1HG2  ILE  10          1HG2      ILE  10 -13.223   2.704  -3.058
   73   2HG2  ILE  10          2HG2      ILE  10 -11.764   3.687  -3.166
   74   3HG2  ILE  10          3HG2      ILE  10 -13.216   4.166  -4.044
   75   1HD1  ILE  10          1HD1      ILE  10 -12.257   4.734  -6.383
   76   2HD1  ILE  10          2HD1      ILE  10 -11.316   5.217  -4.973
   77   3HD1  ILE  10          3HD1      ILE  10 -10.533   5.076  -6.548
   78    H    SER  11           H        SER  11 -12.070   1.231  -1.964
   79    HA   SER  11           HA       SER  11  -9.406   1.946  -1.162
   80   1HB   SER  11          1HB       SER  11 -11.754   2.134   0.007
   81   2HB   SER  11          2HB       SER  11 -11.375   0.529   0.620
   82    HG   SER  11           HG       SER  11 -10.477   2.922   1.445
   83    H    ARG  12           H        ARG  12 -11.056  -1.221  -1.358
   84    HA   ARG  12           HA       ARG  12  -8.938  -2.767  -0.169
   85   1HB   ARG  12          1HB       ARG  12 -11.396  -3.409  -0.706
   86   2HB   ARG  12          2HB       ARG  12 -10.821  -3.724  -2.342
   87   1HG   ARG  12          1HG       ARG  12 -10.721  -5.819  -1.202
   88   2HG   ARG  12          2HG       ARG  12  -9.062  -5.243  -1.311
   89   1HD   ARG  12          1HD       ARG  12  -9.178  -5.896   0.935
   90   2HD   ARG  12          2HD       ARG  12  -9.600  -4.179   1.065
   91    HE   ARG  12           HE       ARG  12 -12.000  -4.869   1.056
   92   1HH1  ARG  12          1HH2      ARG  12 -11.034  -5.889   3.606
   93   2HH1  ARG  12          2HH2      ARG  12 -11.446  -7.567   3.568
   94   1HH2  ARG  12          1HH1      ARG  12 -11.908  -7.623   0.106
   95   2HH2  ARG  12          2HH1      ARG  12 -11.948  -8.565   1.555
   96    H    PHE  13           H        PHE  13  -9.617  -1.720  -3.501
   97    HA   PHE  13           HA       PHE  13  -7.424  -3.125  -4.751
   98   1HB   PHE  13          1HB       PHE  13  -8.838  -2.506  -6.419
   99   2HB   PHE  13          2HB       PHE  13  -9.584  -1.271  -5.429
  100    HD1  PHE  13           HD1      PHE  13  -6.550  -1.955  -7.527
  101    HD2  PHE  13           HD2      PHE  13  -9.202   0.999  -5.893
  102    HE1  PHE  13           HE1      PHE  13  -5.434  -0.203  -8.879
  103    HE2  PHE  13           HE2      PHE  13  -8.089   2.750  -7.241
  104    HZ   PHE  13           HZ       PHE  13  -6.206   2.153  -8.735
  105    H    ARG  14           H        ARG  14  -7.829   0.149  -3.387
  106    HA   ARG  14           HA       ARG  14  -5.350   1.306  -4.112
  107   1HB   ARG  14          1HB       ARG  14  -7.276   1.646  -1.831
  108   2HB   ARG  14          2HB       ARG  14  -5.793   2.599  -1.899
  109   1HG   ARG  14          1HG       ARG  14  -6.412   3.659  -3.901
  110   2HG   ARG  14          2HG       ARG  14  -7.612   2.429  -4.294
  111   1HD   ARG  14          1HD       ARG  14  -9.224   3.582  -3.211
  112   2HD   ARG  14          2HD       ARG  14  -8.246   3.640  -1.732
  113    HE   ARG  14           HE       ARG  14  -7.147   5.654  -2.584
  114   1HH1  ARG  14          1HH2      ARG  14 -10.001   6.438  -2.583
  115   2HH1  ARG  14          2HH2      ARG  14 -10.236   7.065  -4.175
  116   1HH2  ARG  14          1HH1      ARG  14  -7.324   5.587  -5.438
  117   2HH2  ARG  14          2HH1      ARG  14  -8.687   6.577  -5.827
  118    H    ARG  15           H        ARG  15  -6.022  -1.087  -1.580
  119    HA   ARG  15           HA       ARG  15  -3.774  -0.737   0.103
  120   1HB   ARG  15          1HB       ARG  15  -5.596  -2.233   0.642
  121   2HB   ARG  15          2HB       ARG  15  -5.302  -3.194  -0.800
  122   1HG   ARG  15          1HG       ARG  15  -4.457  -4.261   1.295
  123   2HG   ARG  15          2HG       ARG  15  -3.199  -4.000   0.093
  124   1HD   ARG  15          1HD       ARG  15  -2.108  -2.435   1.375
  125   2HD   ARG  15          2HD       ARG  15  -3.612  -1.799   2.072
  126    HE   ARG  15           HE       ARG  15  -3.702  -3.790   3.535
  127   1HH1  ARG  15          1HH2      ARG  15  -1.186  -2.477   4.354
  128   2HH1  ARG  15          2HH2      ARG  15  -0.029  -3.757   4.266
  129   1HH2  ARG  15          1HH1      ARG  15  -2.062  -5.794   2.289
  130   2HH2  ARG  15          2HH1      ARG  15  -0.532  -5.665   3.085
  131    H    LYS  16           H        LYS  16  -4.064  -2.639  -2.908
  132    HA   LYS  16           HA       LYS  16  -1.338  -3.589  -2.974
  133   1HB   LYS  16          1HB       LYS  16  -3.389  -4.498  -4.174
  134   2HB   LYS  16          2HB       LYS  16  -3.266  -3.125  -5.271
  135   1HG   LYS  16          1HG       LYS  16  -0.681  -4.222  -5.197
  136   2HG   LYS  16          2HG       LYS  16  -1.763  -5.612  -5.266
  137   1HD   LYS  16          1HD       LYS  16  -2.960  -4.093  -7.122
  138   2HD   LYS  16          2HD       LYS  16  -1.328  -3.443  -7.272
  139   1HE   LYS  16          1HE       LYS  16  -1.771  -6.430  -7.259
  140   2HE   LYS  16          2HE       LYS  16  -1.976  -5.496  -8.750
  141   1HZ   LYS  16          1HZ       LYS  16   0.448  -5.390  -7.022
  142   2HZ   LYS  16          2HZ       LYS  16   0.319  -6.291  -8.452
  143   3HZ   LYS  16          3HZ       LYS  16   0.224  -4.598  -8.512
  144    H    ILE  17           H        ILE  17  -2.962  -0.695  -4.258
  145    HA   ILE  17           HA       ILE  17  -0.809   0.310  -5.865
  146    HB   ILE  17           HB       ILE  17  -3.028   1.741  -4.348
  147   1HG1  ILE  17          1HG1      ILE  17  -3.996   0.137  -5.883
  148   2HG1  ILE  17          2HG1      ILE  17  -4.180   1.743  -6.577
  149   1HG2  ILE  17          1HG2      ILE  17  -1.362   2.696  -6.689
  150   2HG2  ILE  17          2HG2      ILE  17  -2.755   3.541  -6.011
  151   3HG2  ILE  17          3HG2      ILE  17  -1.300   3.321  -5.039
  152   1HD1  ILE  17          1HD1      ILE  17  -1.817   1.065  -7.695
  153   2HD1  ILE  17          2HD1      ILE  17  -2.511  -0.544  -7.495
  154   3HD1  ILE  17          3HD1      ILE  17  -3.369   0.676  -8.436
  155    H    ALA  18           H        ALA  18  -1.662   0.692  -2.420
  156    HA   ALA  18           HA       ALA  18   0.439   2.546  -1.739
  157   1HB   ALA  18          1HB       ALA  18  -1.446   0.702  -0.303
  158   2HB   ALA  18          2HB       ALA  18  -0.099   1.388   0.604
  159   3HB   ALA  18          3HB       ALA  18  -1.277   2.451  -0.165
  160    H    LYS  19           H        LYS  19   0.226  -1.040  -1.661
  161    HA   LYS  19           HA       LYS  19   2.730  -1.607  -0.437
  162   1HB   LYS  19          1HB       LYS  19   0.627  -3.030  -1.554
  163   2HB   LYS  19          2HB       LYS  19   1.961  -3.388  -2.649
  164   1HG   LYS  19          1HG       LYS  19   3.331  -3.834  -0.482
  165   2HG   LYS  19          2HG       LYS  19   1.759  -3.935   0.305
  166   1HD   LYS  19          1HD       LYS  19   1.374  -5.987  -0.530
  167   2HD   LYS  19          2HD       LYS  19   1.781  -5.469  -2.165
  168   1HE   LYS  19          1HE       LYS  19   4.269  -5.549  -1.220
  169   2HE   LYS  19          2HE       LYS  19   3.550  -6.693  -0.074
  170   1HZ   LYS  19          1HZ       LYS  19   2.988  -6.925  -2.971
  171   2HZ   LYS  19          2HZ       LYS  19   4.400  -7.588  -2.305
  172   3HZ   LYS  19          3HZ       LYS  19   2.880  -8.111  -1.761
  173    H    ARG  20           H        ARG  20   1.946  -0.705  -3.784
  174    HA   ARG  20           HA       ARG  20   4.586  -1.242  -4.878
  175   1HB   ARG  20          1HB       ARG  20   2.240  -1.044  -6.022
  176   2HB   ARG  20          2HB       ARG  20   2.561   0.692  -6.005
  177   1HG   ARG  20          1HG       ARG  20   4.591   0.405  -7.272
  178   2HG   ARG  20          2HG       ARG  20   4.483  -1.349  -7.147
  179   1HD   ARG  20          1HD       ARG  20   2.811  -1.505  -8.747
  180   2HD   ARG  20          2HD       ARG  20   2.183   0.122  -8.411
  181    HE   ARG  20           HE       ARG  20   4.915  -0.073  -9.552
  182   1HH1  ARG  20          1HH1      ARG  20   2.933   2.332  -9.343
  183   2HH1  ARG  20          2HH1      ARG  20   2.541   2.545 -11.011
  184   1HH2  ARG  20          1HH2      ARG  20   3.835  -0.555 -11.968
  185   2HH2  ARG  20          2HH2      ARG  20   3.058   0.886 -12.519
  186    H    SER  21           H        SER  21   2.873   1.678  -3.675
  187    HA   SER  21           HA       SER  21   5.004   3.540  -4.250
  188   1HB   SER  21          1HB       SER  21   2.405   3.743  -3.429
  189   2HB   SER  21          2HB       SER  21   3.240   4.023  -1.904
  190    HG   SER  21           HG       SER  21   2.864   5.733  -3.852
  191    H    ILE  22           H        ILE  22   4.148   1.591  -1.382
  192    HA   ILE  22           HA       ILE  22   6.174   2.576   0.384
  193    HB   ILE  22           HB       ILE  22   4.693  -0.069   0.152
  194   1HG1  ILE  22          1HG1      ILE  22   4.369   1.919   2.374
  195   2HG1  ILE  22          2HG1      ILE  22   3.639   2.282   0.811
  196   1HG2  ILE  22          1HG2      ILE  22   6.792   0.811   2.109
  197   2HG2  ILE  22          2HG2      ILE  22   5.430  -0.140   2.702
  198   3HG2  ILE  22          3HG2      ILE  22   6.477  -0.793   1.445
  199   1HD1  ILE  22          1HD1      ILE  22   2.628  -0.076   0.918
  200   2HD1  ILE  22          2HD1      ILE  22   3.092  -0.074   2.619
  201   3HD1  ILE  22          3HD1      ILE  22   1.951   1.127   2.015
  202    H    LYS  23           H        LYS  23   6.208   0.040  -2.131
  203    HA   LYS  23           HA       LYS  23   8.718  -1.163  -1.672
  204   1HB   LYS  23          1HB       LYS  23   6.785  -1.518  -3.469
  205   2HB   LYS  23          2HB       LYS  23   7.841  -0.520  -4.464
  206   1HG   LYS  23          1HG       LYS  23   8.929  -2.433  -4.949
  207   2HG   LYS  23          2HG       LYS  23   9.628  -2.294  -3.342
  208   1HD   LYS  23          1HD       LYS  23   7.179  -3.885  -4.147
  209   2HD   LYS  23          2HD       LYS  23   8.718  -4.523  -3.586
  210   1HE   LYS  23          1HE       LYS  23   6.933  -2.752  -1.878
  211   2HE   LYS  23          2HE       LYS  23   6.878  -4.515  -1.841
  212   1HZ   LYS  23          1HZ       LYS  23   9.575  -3.514  -1.638
  213   2HZ   LYS  23          2HZ       LYS  23   8.572  -2.934  -0.402
  214   3HZ   LYS  23          3HZ       LYS  23   8.733  -4.607  -0.649
  215    H    THR  24           H        THR  24   8.020   1.792  -3.596
  216    HA   THR  24           HA       THR  24  10.824   2.240  -4.202
  217    HB   THR  24           HB       THR  24   8.598   3.042  -5.388
  218    HG1  THR  24           HG1      THR  24  10.206   3.724  -6.519
  219   1HG2  THR  24          1HG2      THR  24   7.936   4.476  -3.363
  220   2HG2  THR  24          2HG2      THR  24   9.256   5.544  -3.825
  221   3HG2  THR  24          3HG2      THR  24   7.913   5.274  -4.934
  222    H    LEU  25           H        LEU  25   8.673   3.237  -1.586
  223    HA   LEU  25           HA       LEU  25  10.398   5.291  -0.493
  224   1HB   LEU  25          1HB       LEU  25   7.820   4.204  -0.036
  225   2HB   LEU  25          2HB       LEU  25   8.711   3.995   1.468
  226    HG   LEU  25           HG       LEU  25   9.411   6.567   0.678
  227   1HD1  LEU  25          1HD1      LEU  25   6.593   5.916  -0.151
  228   2HD1  LEU  25          2HD1      LEU  25   6.989   7.527   0.445
  229   3HD1  LEU  25          3HD1      LEU  25   7.801   6.893  -0.987
  230   1HD2  LEU  25          1HD2      LEU  25   8.854   5.772   2.962
  231   2HD2  LEU  25          2HD2      LEU  25   7.988   7.256   2.563
  232   3HD2  LEU  25          3HD2      LEU  25   7.150   5.706   2.515
  233    H    GLU  26           H        GLU  26   9.992   1.810   0.138
  234    HA   GLU  26           HA       GLU  26  11.711   1.555   2.406
  235   1HB   GLU  26          1HB       GLU  26  10.775  -0.251   0.171
  236   2HB   GLU  26          2HB       GLU  26  11.865  -0.858   1.417
  237   1HG   GLU  26          1HG       GLU  26  10.294  -0.470   3.144
  238   2HG   GLU  26          2HG       GLU  26   9.319   0.592   2.133
  239    H    HIS  27           H        HIS  27  12.385   1.076  -1.061
  240    HA   HIS  27           HA       HIS  27  15.209   0.620  -0.811
  241   1HB   HIS  27          1HB       HIS  27  13.332   1.368  -3.040
  242   2HB   HIS  27          2HB       HIS  27  15.064   1.208  -3.323
  243    HD1  HIS  27           HD1      HIS  27  15.922  -1.123  -3.697
  244    HD2  HIS  27           HD2      HIS  27  12.179  -1.133  -1.863
  245    HE1  HIS  27           HE1      HIS  27  15.196  -3.542  -3.563
  246    H    LYS  28           H        LYS  28  13.501   3.611  -0.455
  247    HA   LYS  28           HA       LYS  28  15.715   5.263  -1.494
  248   1HB   LYS  28          1HB       LYS  28  13.002   5.591  -1.339
  249   2HB   LYS  28          2HB       LYS  28  13.530   6.498   0.076
  250   1HG   LYS  28          1HG       LYS  28  14.328   8.176  -1.191
  251   2HG   LYS  28          2HG       LYS  28  15.249   7.062  -2.195
  252   1HD   LYS  28          1HD       LYS  28  13.814   7.530  -3.859
  253   2HD   LYS  28          2HD       LYS  28  12.596   6.621  -2.965
  254   1HE   LYS  28          1HE       LYS  28  11.737   8.593  -1.921
  255   2HE   LYS  28          2HE       LYS  28  13.130   9.559  -2.436
  256   1HZ   LYS  28          1HZ       LYS  28  11.334   8.201  -4.376
  257   2HZ   LYS  28          2HZ       LYS  28  11.077   9.787  -3.847
  258   3HZ   LYS  28          3HZ       LYS  28  12.500   9.401  -4.685
  259    H    ARG  29           H        ARG  29  14.105   4.721   1.684
  260    HA   ARG  29           HA       ARG  29  16.138   6.221   3.123
  261   1HB   ARG  29          1HB       ARG  29  14.938   5.461   5.118
  262   2HB   ARG  29          2HB       ARG  29  13.831   6.090   3.907
  263   1HG   ARG  29          1HG       ARG  29  13.984   3.367   3.310
  264   2HG   ARG  29          2HG       ARG  29  14.004   3.407   5.069
  265   1HD   ARG  29          1HD       ARG  29  11.955   4.877   3.377
  266   2HD   ARG  29          2HD       ARG  29  11.686   3.284   4.103
  267    HE   ARG  29           HE       ARG  29  12.553   4.832   6.240
  268   1HH1  ARG  29          1HH2      ARG  29   9.838   3.783   6.347
  269   2HH1  ARG  29          2HH2      ARG  29   8.849   5.200   6.300
  270   1HH2  ARG  29          1HH1      ARG  29  11.399   7.252   5.095
  271   2HH2  ARG  29          2HH1      ARG  29   9.742   7.186   5.583
  272    H    GLU  30           H        GLU  30  15.827   2.799   2.270
  273    HA   GLU  30           HA       GLU  30  17.556   1.644   4.215
  274   1HB   GLU  30          1HB       GLU  30  16.424   0.970   1.593
  275   2HB   GLU  30          2HB       GLU  30  18.008   0.253   1.847
  276   1HG   GLU  30          1HG       GLU  30  17.201  -1.235   3.323
  277   2HG   GLU  30          2HG       GLU  30  16.371   0.015   4.238
  278    H    ASN  31           H        ASN  31  18.345   3.000   1.002
  279    HA   ASN  31           HA       ASN  31  21.242   2.710   1.450
  280   1HB   ASN  31          1HB       ASN  31  19.423   3.039  -0.751
  281   2HB   ASN  31          2HB       ASN  31  20.664   4.284  -0.840
  282   1HD2  ASN  31          2HD2      ASN  31  23.026   3.383  -0.534
  283   2HD2  ASN  31          1HD2      ASN  31  23.340   1.871  -1.236
  284    H    ALA  32           H        ALA  32  19.152   4.941   2.733
  285    HA   ALA  32           HA       ALA  32  21.093   7.210   2.450
  286   1HB   ALA  32          1HB       ALA  32  18.086   7.145   2.841
  287   2HB   ALA  32          2HB       ALA  32  19.059   8.616   2.867
  288   3HB   ALA  32          3HB       ALA  32  18.951   7.657   1.392
  289    H    LYS  33           H        LYS  33  18.582   5.962   4.675
  290    HA   LYS  33           HA       LYS  33  18.458   5.702   6.950
  291   1HB   LYS  33          1HB       LYS  33  21.278   5.345   6.273
  292   2HB   LYS  33          2HB       LYS  33  21.049   5.906   7.926
  293   1HG   LYS  33          1HG       LYS  33  19.094   4.010   7.764
  294   2HG   LYS  33          2HG       LYS  33  20.309   3.325   6.689
  295   1HD   LYS  33          1HD       LYS  33  21.418   2.588   8.499
  296   2HD   LYS  33          2HD       LYS  33  21.747   4.264   8.915
  297   1HE   LYS  33          1HE       LYS  33  20.676   3.524  10.854
  298   2HE   LYS  33          2HE       LYS  33  19.306   4.182   9.946
  299   1HZ   LYS  33          1HZ       LYS  33  20.137   1.355   9.608
  300   2HZ   LYS  33          2HZ       LYS  33  19.083   1.815  10.855
  301   3HZ   LYS  33          3HZ       LYS  33  18.650   2.077   9.235
  302    H    GLU  34           H        GLU  34  21.187   8.037   6.765
  303    HA   GLU  34           HA       GLU  34  19.452  10.049   8.150
  304   1HB   GLU  34          1HB       GLU  34  22.209   9.014   8.800
  305   2HB   GLU  34          2HB       GLU  34  21.686  10.602   9.349
  306   1HG   GLU  34          1HG       GLU  34  20.587   9.658  11.060
  307   2HG   GLU  34          2HG       GLU  34  19.575   8.770   9.926
  Start of MODEL   17
    1   1H    CYS   1          1H        CYS   1 -26.489  -0.589  -0.114
    2   2H    CYS   1          2H        CYS   1 -25.475   0.513  -0.906
    3   3H    CYS   1          3H        CYS   1 -26.924   1.047  -0.198
    4    HA   CYS   1           HA       CYS   1 -28.258  -0.070  -1.787
    5   1HB   CYS   1          1HB       CYS   1 -25.910   1.515  -2.818
    6   2HB   CYS   1          2HB       CYS   1 -27.166   0.948  -3.915
    7    HG   CYS   1           HG       CYS   1 -28.825   2.534  -2.887
    8    H    ALA   2           H        ALA   2 -24.866  -0.589  -2.923
    9    HA   ALA   2           HA       ALA   2 -25.715  -3.276  -3.928
   10   1HB   ALA   2          1HB       ALA   2 -25.031  -1.508  -5.556
   11   2HB   ALA   2          2HB       ALA   2 -23.442  -1.465  -4.797
   12   3HB   ALA   2          3HB       ALA   2 -23.987  -2.926  -5.617
   13    H    VAL   3           H        VAL   3 -22.769  -3.943  -4.295
   14    HA   VAL   3           HA       VAL   3 -22.333  -5.287  -1.781
   15    HB   VAL   3           HB       VAL   3 -20.205  -5.968  -2.805
   16   1HG1  VAL   3          1HG1      VAL   3 -22.522  -6.941  -3.411
   17   2HG1  VAL   3          2HG1      VAL   3 -22.309  -6.109  -4.951
   18   3HG1  VAL   3          3HG1      VAL   3 -21.151  -7.340  -4.446
   19   1HG2  VAL   3          1HG2      VAL   3 -20.033  -3.637  -4.066
   20   2HG2  VAL   3          2HG2      VAL   3 -19.347  -5.093  -4.785
   21   3HG2  VAL   3          3HG2      VAL   3 -20.914  -4.495  -5.329
   22    H    GLU   4           H        GLU   4 -21.479  -2.063  -2.745
   23    HA   GLU   4           HA       GLU   4 -19.152  -1.825  -1.004
   24   1HB   GLU   4          1HB       GLU   4 -20.906   0.206  -2.407
   25   2HB   GLU   4          2HB       GLU   4 -19.379   0.584  -1.613
   26   1HG   GLU   4          1HG       GLU   4 -18.331   0.073  -3.537
   27   2HG   GLU   4          2HG       GLU   4 -18.795  -1.604  -3.271
   28    H    LEU   5           H        LEU   5 -20.182  -2.712   0.876
   29    HA   LEU   5           HA       LEU   5 -21.607  -0.676   2.549
   30   1HB   LEU   5          1HB       LEU   5 -22.181  -3.599   2.905
   31   2HB   LEU   5          2HB       LEU   5 -23.171  -2.218   3.330
   32    HG   LEU   5           HG       LEU   5 -22.637  -2.984   0.450
   33   1HD1  LEU   5          1HD1      LEU   5 -24.791  -3.974   2.329
   34   2HD1  LEU   5          2HD1      LEU   5 -24.898  -4.094   0.573
   35   3HD1  LEU   5          3HD1      LEU   5 -23.615  -4.939   1.437
   36   1HD2  LEU   5          1HD2      LEU   5 -24.876  -1.438   1.811
   37   2HD2  LEU   5          2HD2      LEU   5 -23.554  -0.718   0.888
   38   3HD2  LEU   5          3HD2      LEU   5 -24.737  -1.744   0.080
   39    H    ARG   6           H        ARG   6 -19.713  -3.710   2.501
   40    HA   ARG   6           HA       ARG   6 -18.290  -2.831   4.973
   41   1HB   ARG   6          1HB       ARG   6 -20.307  -4.490   5.200
   42   2HB   ARG   6          2HB       ARG   6 -19.148  -5.679   4.605
   43   1HG   ARG   6          1HG       ARG   6 -17.606  -5.142   6.415
   44   2HG   ARG   6          2HG       ARG   6 -18.682  -3.867   6.989
   45   1HD   ARG   6          1HD       ARG   6 -20.323  -6.142   6.838
   46   2HD   ARG   6          2HD       ARG   6 -18.799  -6.725   7.530
   47    HE   ARG   6           HE       ARG   6 -18.998  -4.748   9.148
   48   1HH1  ARG   6          1HH2      ARG   6 -20.896  -7.055   9.726
   49   2HH1  ARG   6          2HH2      ARG   6 -22.381  -6.218  10.013
   50   1HH2  ARG   6          1HH1      ARG   6 -21.260  -3.237   8.577
   51   2HH2  ARG   6          2HH1      ARG   6 -22.589  -4.024   9.354
   52    H    SER   7           H        SER   7 -18.296  -5.159   2.206
   53    HA   SER   7           HA       SER   7 -15.543  -5.961   2.611
   54   1HB   SER   7          1HB       SER   7 -15.914  -6.879   0.234
   55   2HB   SER   7          2HB       SER   7 -16.945  -7.491   1.514
   56    HG   SER   7           HG       SER   7 -17.991  -6.792  -0.514
   57    HA   PRO   8           HA       PRO   8 -13.801  -2.302   0.699
   58   1HB   PRO   8          1HB       PRO   8 -11.179  -3.021   0.880
   59   2HB   PRO   8          2HB       PRO   8 -12.124  -2.403   2.251
   60   1HG   PRO   8          1HG       PRO   8 -11.328  -5.179   1.614
   61   2HG   PRO   8          2HG       PRO   8 -11.515  -4.381   3.183
   62   1HD   PRO   8          1HD       PRO   8 -13.341  -6.110   2.087
   63   2HD   PRO   8          2HD       PRO   8 -13.711  -4.895   3.329
   64    H    GLY   9           H        GLY   9 -14.001  -2.084  -1.486
   65   1HA   GLY   9          1HA       GLY   9 -12.881  -4.164  -3.313
   66   2HA   GLY   9          2HA       GLY   9 -14.141  -2.998  -3.750
   67    H    ILE  10           H        ILE  10 -13.502  -0.672  -3.722
   68    HA   ILE  10           HA       ILE  10 -11.083  -0.208  -5.207
   69    HB   ILE  10           HB       ILE  10 -13.236   1.112  -5.294
   70   1HG1  ILE  10          1HG1      ILE  10 -10.612   2.530  -4.792
   71   2HG1  ILE  10          2HG1      ILE  10 -11.262   1.985  -6.334
   72   1HG2  ILE  10          1HG2      ILE  10 -13.433   1.245  -2.735
   73   2HG2  ILE  10          2HG2      ILE  10 -12.241   2.541  -2.826
   74   3HG2  ILE  10          3HG2      ILE  10 -13.796   2.715  -3.639
   75   1HD1  ILE  10          1HD1      ILE  10 -13.184   3.577  -6.014
   76   2HD1  ILE  10          2HD1      ILE  10 -12.363   4.201  -4.586
   77   3HD1  ILE  10          3HD1      ILE  10 -11.618   4.374  -6.175
   78    H    SER  11           H        SER  11 -11.960   0.088  -1.785
   79    HA   SER  11           HA       SER  11  -9.646   1.458  -0.815
   80   1HB   SER  11          1HB       SER  11 -11.922   0.954   0.267
   81   2HB   SER  11          2HB       SER  11 -11.308  -0.662   0.582
   82    HG   SER  11           HG       SER  11  -9.682   0.272   1.830
   83    H    ARG  12           H        ARG  12 -10.326  -2.013  -1.355
   84    HA   ARG  12           HA       ARG  12  -7.806  -2.986  -0.298
   85   1HB   ARG  12          1HB       ARG  12 -10.150  -4.023  -1.790
   86   2HB   ARG  12          2HB       ARG  12  -8.638  -4.833  -2.190
   87   1HG   ARG  12          1HG       ARG  12  -9.148  -4.361   0.701
   88   2HG   ARG  12          2HG       ARG  12 -10.169  -5.561  -0.088
   89   1HD   ARG  12          1HD       ARG  12  -7.294  -5.789  -0.763
   90   2HD   ARG  12          2HD       ARG  12  -7.686  -6.113   0.934
   91    HE   ARG  12           HE       ARG  12  -9.526  -7.421  -0.924
   92   1HH1  ARG  12          1HH1      ARG  12  -8.648  -8.442   1.787
   93   2HH1  ARG  12          2HH1      ARG  12  -7.651  -9.787   1.354
   94   1HH2  ARG  12          1HH2      ARG  12  -7.317  -8.773  -1.973
   95   2HH2  ARG  12          2HH2      ARG  12  -6.886  -9.975  -0.809
   96    H    PHE  13           H        PHE  13  -9.004  -2.010  -3.500
   97    HA   PHE  13           HA       PHE  13  -6.666  -2.628  -5.035
   98   1HB   PHE  13          1HB       PHE  13  -8.449  -2.236  -6.413
   99   2HB   PHE  13          2HB       PHE  13  -9.211  -1.139  -5.283
  100    HD1  PHE  13           HD1      PHE  13  -6.610  -1.413  -7.932
  101    HD2  PHE  13           HD2      PHE  13  -8.997   1.232  -5.531
  102    HE1  PHE  13           HE1      PHE  13  -5.915   0.504  -9.343
  103    HE2  PHE  13           HE2      PHE  13  -8.303   3.142  -6.940
  104    HZ   PHE  13           HZ       PHE  13  -6.765   2.782  -8.845
  105    H    ARG  14           H        ARG  14  -7.663   0.301  -3.223
  106    HA   ARG  14           HA       ARG  14  -5.472   1.990  -3.970
  107   1HB   ARG  14          1HB       ARG  14  -7.356   1.824  -1.607
  108   2HB   ARG  14          2HB       ARG  14  -6.134   3.094  -1.725
  109   1HG   ARG  14          1HG       ARG  14  -7.087   4.022  -3.656
  110   2HG   ARG  14          2HG       ARG  14  -7.977   2.554  -4.041
  111   1HD   ARG  14          1HD       ARG  14  -9.746   3.150  -2.749
  112   2HD   ARG  14          2HD       ARG  14  -8.709   3.712  -1.423
  113    HE   ARG  14           HE       ARG  14  -9.600   5.350  -3.718
  114   1HH1  ARG  14          1HH2      ARG  14  -9.758   6.208  -0.837
  115   2HH1  ARG  14          2HH2      ARG  14  -8.444   7.327  -0.715
  116   1HH2  ARG  14          1HH1      ARG  14  -6.931   6.215  -3.665
  117   2HH2  ARG  14          2HH1      ARG  14  -6.811   7.331  -2.348
  118    H    ARG  15           H        ARG  15  -5.859  -0.449  -1.408
  119    HA   ARG  15           HA       ARG  15  -3.429   0.041   0.030
  120   1HB   ARG  15          1HB       ARG  15  -5.642  -1.691   0.142
  121   2HB   ARG  15          2HB       ARG  15  -4.257  -2.756  -0.078
  122   1HG   ARG  15          1HG       ARG  15  -4.545  -2.454   2.283
  123   2HG   ARG  15          2HG       ARG  15  -3.122  -1.524   1.819
  124   1HD   ARG  15          1HD       ARG  15  -4.371   0.549   1.855
  125   2HD   ARG  15          2HD       ARG  15  -5.902  -0.321   2.082
  126    HE   ARG  15           HE       ARG  15  -3.768  -0.736   4.109
  127   1HH1  ARG  15          1HH1      ARG  15  -6.849  -1.379   4.130
  128   2HH1  ARG  15          2HH1      ARG  15  -7.367  -0.241   5.326
  129   1HH2  ARG  15          1HH2      ARG  15  -4.402   1.595   5.241
  130   2HH2  ARG  15          2HH2      ARG  15  -5.973   1.462   5.953
  131    H    LYS  16           H        LYS  16  -4.162  -1.933  -2.850
  132    HA   LYS  16           HA       LYS  16  -1.549  -3.184  -3.027
  133   1HB   LYS  16          1HB       LYS  16  -3.796  -3.901  -4.068
  134   2HB   LYS  16          2HB       LYS  16  -3.517  -2.649  -5.274
  135   1HG   LYS  16          1HG       LYS  16  -2.689  -4.677  -6.221
  136   2HG   LYS  16          2HG       LYS  16  -1.270  -3.751  -5.737
  137   1HD   LYS  16          1HD       LYS  16  -2.156  -5.379  -3.524
  138   2HD   LYS  16          2HD       LYS  16  -1.967  -6.386  -4.955
  139   1HE   LYS  16          1HE       LYS  16   0.317  -5.956  -5.133
  140   2HE   LYS  16          2HE       LYS  16   0.200  -4.409  -4.274
  141   1HZ   LYS  16          1HZ       LYS  16  -0.358  -5.609  -2.246
  142   2HZ   LYS  16          2HZ       LYS  16  -0.217  -7.093  -3.059
  143   3HZ   LYS  16          3HZ       LYS  16   1.147  -6.109  -2.835
  144    H    ILE  17           H        ILE  17  -3.027  -0.250  -4.396
  145    HA   ILE  17           HA       ILE  17  -0.787   0.497  -6.065
  146    HB   ILE  17           HB       ILE  17  -3.367   1.623  -5.078
  147   1HG1  ILE  17          1HG1      ILE  17  -3.456   2.327  -7.507
  148   2HG1  ILE  17          2HG1      ILE  17  -1.892   1.544  -7.719
  149   1HG2  ILE  17          1HG2      ILE  17  -1.133   3.447  -6.006
  150   2HG2  ILE  17          2HG2      ILE  17  -2.838   3.899  -5.978
  151   3HG2  ILE  17          3HG2      ILE  17  -2.001   3.527  -4.471
  152   1HD1  ILE  17          1HD1      ILE  17  -2.904  -0.589  -6.882
  153   2HD1  ILE  17          2HD1      ILE  17  -4.468   0.223  -6.822
  154   3HD1  ILE  17          3HD1      ILE  17  -3.651  -0.005  -8.367
  155    H    ALA  18           H        ALA  18  -1.781   1.213  -2.727
  156    HA   ALA  18           HA       ALA  18   0.353   3.019  -2.040
  157   1HB   ALA  18          1HB       ALA  18  -1.785   2.757  -0.793
  158   2HB   ALA  18          2HB       ALA  18  -1.295   1.127  -0.328
  159   3HB   ALA  18          3HB       ALA  18  -0.389   2.522   0.263
  160    H    LYS  19           H        LYS  19   0.026  -0.542  -1.964
  161    HA   LYS  19           HA       LYS  19   2.368  -1.168  -0.454
  162   1HB   LYS  19          1HB       LYS  19   0.659  -2.533  -2.515
  163   2HB   LYS  19          2HB       LYS  19   2.207  -3.268  -2.108
  164   1HG   LYS  19          1HG       LYS  19   0.202  -2.451   0.000
  165   2HG   LYS  19          2HG       LYS  19   0.196  -4.048  -0.738
  166   1HD   LYS  19          1HD       LYS  19   1.776  -4.702   0.720
  167   2HD   LYS  19          2HD       LYS  19   2.884  -3.532   0.011
  168   1HE   LYS  19          1HE       LYS  19   2.855  -2.787   2.220
  169   2HE   LYS  19          2HE       LYS  19   1.527  -1.822   1.551
  170   1HZ   LYS  19          1HZ       LYS  19   1.167  -4.505   2.788
  171   2HZ   LYS  19          2HZ       LYS  19   0.910  -3.036   3.605
  172   3HZ   LYS  19          3HZ       LYS  19  -0.053  -3.449   2.274
  173    H    ARG  20           H        ARG  20   1.875  -0.610  -3.951
  174    HA   ARG  20           HA       ARG  20   4.638  -1.020  -4.723
  175   1HB   ARG  20          1HB       ARG  20   2.110   0.042  -5.911
  176   2HB   ARG  20          2HB       ARG  20   3.616   0.540  -6.679
  177   1HG   ARG  20          1HG       ARG  20   4.196  -2.035  -6.504
  178   2HG   ARG  20          2HG       ARG  20   2.441  -2.206  -6.431
  179   1HD   ARG  20          1HD       ARG  20   2.259  -0.862  -8.538
  180   2HD   ARG  20          2HD       ARG  20   4.032  -0.850  -8.639
  181    HE   ARG  20           HE       ARG  20   3.834  -3.422  -8.556
  182   1HH1  ARG  20          1HH1      ARG  20   0.808  -3.337  -8.379
  183   2HH1  ARG  20          2HH1      ARG  20   0.353  -3.650 -10.018
  184   1HH2  ARG  20          1HH2      ARG  20   3.534  -2.952 -11.283
  185   2HH2  ARG  20          2HH2      ARG  20   1.923  -3.427 -11.689
  186    H    SER  21           H        SER  21   2.678   1.851  -3.897
  187    HA   SER  21           HA       SER  21   4.691   3.850  -4.384
  188   1HB   SER  21          1HB       SER  21   2.202   3.753  -2.662
  189   2HB   SER  21          2HB       SER  21   3.154   5.212  -2.910
  190    HG   SER  21           HG       SER  21   1.504   3.786  -4.656
  191    H    ILE  22           H        ILE  22   4.217   1.635  -1.699
  192    HA   ILE  22           HA       ILE  22   6.003   3.237   0.062
  193    HB   ILE  22           HB       ILE  22   3.949   1.075   0.409
  194   1HG1  ILE  22          1HG1      ILE  22   4.409   3.473   2.158
  195   2HG1  ILE  22          2HG1      ILE  22   3.673   3.677   0.569
  196   1HG2  ILE  22          1HG2      ILE  22   6.208   1.687   2.324
  197   2HG2  ILE  22          2HG2      ILE  22   4.667   1.031   2.875
  198   3HG2  ILE  22          3HG2      ILE  22   5.662   0.113   1.747
  199   1HD1  ILE  22          1HD1      ILE  22   2.546   1.486   2.211
  200   2HD1  ILE  22          2HD1      ILE  22   2.256   3.117   2.816
  201   3HD1  ILE  22          3HD1      ILE  22   1.728   2.672   1.193
  202    H    LYS  23           H        LYS  23   5.811   0.039  -1.561
  203    HA   LYS  23           HA       LYS  23   8.096  -1.134  -0.349
  204   1HB   LYS  23          1HB       LYS  23   6.726  -1.502  -3.009
  205   2HB   LYS  23          2HB       LYS  23   8.132  -2.465  -2.563
  206   1HG   LYS  23          1HG       LYS  23   5.763  -2.223  -0.714
  207   2HG   LYS  23          2HG       LYS  23   5.793  -3.427  -2.000
  208   1HD   LYS  23          1HD       LYS  23   7.879  -4.363  -1.098
  209   2HD   LYS  23          2HD       LYS  23   7.894  -3.145   0.176
  210   1HE   LYS  23          1HE       LYS  23   5.470  -4.905  -0.151
  211   2HE   LYS  23          2HE       LYS  23   6.899  -5.522   0.695
  212   1HZ   LYS  23          1HZ       LYS  23   5.521  -2.955   1.337
  213   2HZ   LYS  23          2HZ       LYS  23   5.388  -4.404   2.228
  214   3HZ   LYS  23          3HZ       LYS  23   6.875  -3.602   2.138
  215    H    THR  24           H        THR  24   8.049   0.509  -3.591
  216    HA   THR  24           HA       THR  24  10.870   0.456  -3.958
  217    HB   THR  24           HB       THR  24   8.746   2.416  -4.886
  218    HG1  THR  24           HG1      THR  24  10.026   0.200  -6.132
  219   1HG2  THR  24          1HG2      THR  24  11.675   2.269  -5.450
  220   2HG2  THR  24          2HG2      THR  24  10.595   2.650  -6.790
  221   3HG2  THR  24          3HG2      THR  24  10.619   3.676  -5.357
  222    H    LEU  25           H        LEU  25   8.824   2.781  -2.224
  223    HA   LEU  25           HA       LEU  25  10.871   4.724  -1.621
  224   1HB   LEU  25          1HB       LEU  25   8.265   4.852  -1.501
  225   2HB   LEU  25          2HB       LEU  25   8.448   4.105   0.082
  226    HG   LEU  25           HG       LEU  25  10.273   6.373  -0.366
  227   1HD1  LEU  25          1HD1      LEU  25   8.295   7.205  -1.592
  228   2HD1  LEU  25          2HD1      LEU  25   7.286   6.869  -0.184
  229   3HD1  LEU  25          3HD1      LEU  25   8.549   8.097  -0.093
  230   1HD2  LEU  25          1HD2      LEU  25   9.640   5.027   1.790
  231   2HD2  LEU  25          2HD2      LEU  25   9.839   6.774   1.902
  232   3HD2  LEU  25          3HD2      LEU  25   8.223   6.075   1.822
  233    H    GLU  26           H        GLU  26   9.619   1.838   0.024
  234    HA   GLU  26           HA       GLU  26  11.450   2.119   2.308
  235   1HB   GLU  26          1HB       GLU  26   9.167   0.334   1.515
  236   2HB   GLU  26          2HB       GLU  26  10.246  -0.146   2.820
  237   1HG   GLU  26          1HG       GLU  26   9.784   2.378   3.602
  238   2HG   GLU  26          2HG       GLU  26   8.280   2.082   2.722
  239    H    HIS  27           H        HIS  27  10.940  -1.160   1.226
  240    HA   HIS  27           HA       HIS  27  12.446  -2.818   0.661
  241   1HB   HIS  27          1HB       HIS  27  12.884  -0.536  -1.199
  242   2HB   HIS  27          2HB       HIS  27  14.079  -1.823  -1.242
  243    HD1  HIS  27           HD1      HIS  27  11.851  -4.140  -0.621
  244    HD2  HIS  27           HD2      HIS  27  11.718  -1.264  -3.637
  245    HE1  HIS  27           HE1      HIS  27  10.329  -5.056  -2.415
  246    H    LYS  28           H        LYS  28  13.229  -0.940   2.905
  247    HA   LYS  28           HA       LYS  28  15.908  -1.960   3.359
  248   1HB   LYS  28          1HB       LYS  28  17.074   0.161   3.372
  249   2HB   LYS  28          2HB       LYS  28  16.307  -0.059   1.808
  250   1HG   LYS  28          1HG       LYS  28  14.360   1.341   2.781
  251   2HG   LYS  28          2HG       LYS  28  15.487   1.782   4.058
  252   1HD   LYS  28          1HD       LYS  28  16.252   3.405   2.708
  253   2HD   LYS  28          2HD       LYS  28  16.938   2.145   1.683
  254   1HE   LYS  28          1HE       LYS  28  15.165   2.224   0.163
  255   2HE   LYS  28          2HE       LYS  28  14.029   2.856   1.366
  256   1HZ   LYS  28          1HZ       LYS  28  16.357   4.357   0.288
  257   2HZ   LYS  28          2HZ       LYS  28  14.752   4.555  -0.213
  258   3HZ   LYS  28          3HZ       LYS  28  15.188   4.941   1.381
  259    H    ARG  29           H        ARG  29  13.436   0.408   4.456
  260    HA   ARG  29           HA       ARG  29  14.349   0.484   7.202
  261   1HB   ARG  29          1HB       ARG  29  13.045   2.261   6.085
  262   2HB   ARG  29          2HB       ARG  29  11.691   1.157   5.907
  263   1HG   ARG  29          1HG       ARG  29  11.411   2.722   7.814
  264   2HG   ARG  29          2HG       ARG  29  11.398   1.038   8.314
  265   1HD   ARG  29          1HD       ARG  29  12.768   2.161   9.906
  266   2HD   ARG  29          2HD       ARG  29  13.919   1.354   8.832
  267    HE   ARG  29           HE       ARG  29  13.795   3.702   7.574
  268   1HH1  ARG  29          1HH1      ARG  29  12.321   4.718  10.083
  269   2HH1  ARG  29          2HH1      ARG  29  13.614   5.485  10.935
  270   1HH2  ARG  29          1HH2      ARG  29  16.106   3.939   9.034
  271   2HH2  ARG  29          2HH2      ARG  29  15.790   5.037  10.328
  272    H    GLU  30           H        GLU  30  12.038  -1.497   5.414
  273    HA   GLU  30           HA       GLU  30  10.512  -2.755   7.359
  274   1HB   GLU  30          1HB       GLU  30  10.245  -4.491   5.712
  275   2HB   GLU  30          2HB       GLU  30  10.417  -2.959   4.866
  276   1HG   GLU  30          1HG       GLU  30  12.952  -3.575   4.762
  277   2HG   GLU  30          2HG       GLU  30  12.409  -5.202   5.133
  278    H    ASN  31           H        ASN  31  13.898  -3.522   6.528
  279    HA   ASN  31           HA       ASN  31  13.979  -5.517   8.764
  280   1HB   ASN  31          1HB       ASN  31  14.986  -5.403   5.988
  281   2HB   ASN  31          2HB       ASN  31  16.143  -6.028   7.158
  282   1HD2  ASN  31          2HD2      ASN  31  15.434  -7.948   8.477
  283   2HD2  ASN  31          1HD2      ASN  31  14.228  -8.971   7.862
  284    H    ALA  32           H        ALA  32  14.369  -2.538   8.962
  285    HA   ALA  32           HA       ALA  32  17.181  -2.519   9.992
  286   1HB   ALA  32          1HB       ALA  32  15.608  -0.511   8.375
  287   2HB   ALA  32          2HB       ALA  32  17.002  -0.017   9.338
  288   3HB   ALA  32          3HB       ALA  32  17.199  -1.190   8.034
  289    H    LYS  33           H        LYS  33  14.222  -0.469  10.186
  290    HA   LYS  33           HA       LYS  33  13.779  -0.946  12.998
  291   1HB   LYS  33          1HB       LYS  33  14.629   1.122  13.895
  292   2HB   LYS  33          2HB       LYS  33  15.928   0.371  12.989
  293   1HG   LYS  33          1HG       LYS  33  15.603   1.885  11.133
  294   2HG   LYS  33          2HG       LYS  33  14.124   2.528  11.842
  295   1HD   LYS  33          1HD       LYS  33  16.689   2.670  13.398
  296   2HD   LYS  33          2HD       LYS  33  16.385   3.844  12.123
  297   1HE   LYS  33          1HE       LYS  33  14.766   4.926  13.324
  298   2HE   LYS  33          2HE       LYS  33  14.113   3.421  13.993
  299   1HZ   LYS  33          1HZ       LYS  33  16.719   4.607  14.810
  300   2HZ   LYS  33          2HZ       LYS  33  15.272   4.798  15.676
  301   3HZ   LYS  33          3HZ       LYS  33  15.945   3.256  15.495
  302    H    GLU  34           H        GLU  34  12.611   1.601  13.621
  303    HA   GLU  34           HA       GLU  34  10.285   1.615  11.746
  304   1HB   GLU  34          1HB       GLU  34  10.613   2.532  14.626
  305   2HB   GLU  34          2HB       GLU  34   9.108   2.578  13.714
  306   1HG   GLU  34          1HG       GLU  34  10.270  -0.070  13.563
  307   2HG   GLU  34          2HG       GLU  34  10.111   0.425  15.244
  Start of MODEL   18
    1   1H    CYS   1          1H        CYS   1 -21.227   0.528   2.983
    2   2H    CYS   1          2H        CYS   1 -19.582   0.838   2.710
    3   3H    CYS   1          3H        CYS   1 -20.759   1.721   1.871
    4    HA   CYS   1           HA       CYS   1 -21.390  -0.099   0.547
    5   1HB   CYS   1          1HB       CYS   1 -18.897   1.035   0.536
    6   2HB   CYS   1          2HB       CYS   1 -18.494  -0.680   0.597
    7    HG   CYS   1           HG       CYS   1 -18.936  -0.601  -1.843
    8    H    ALA   2           H        ALA   2 -20.600  -2.471  -0.065
    9    HA   ALA   2           HA       ALA   2 -20.060  -4.204   2.290
   10   1HB   ALA   2          1HB       ALA   2 -22.519  -3.656   2.165
   11   2HB   ALA   2          2HB       ALA   2 -22.552  -4.444   0.586
   12   3HB   ALA   2          3HB       ALA   2 -22.155  -5.375   2.029
   13    H    VAL   3           H        VAL   3 -18.350  -3.800   0.065
   14    HA   VAL   3           HA       VAL   3 -18.767  -5.562  -2.119
   15    HB   VAL   3           HB       VAL   3 -16.334  -5.409  -2.487
   16   1HG1  VAL   3          1HG1      VAL   3 -18.050  -3.474  -2.893
   17   2HG1  VAL   3          2HG1      VAL   3 -17.169  -2.672  -1.594
   18   3HG1  VAL   3          3HG1      VAL   3 -16.323  -3.166  -3.060
   19   1HG2  VAL   3          1HG2      VAL   3 -16.306  -4.022   0.214
   20   2HG2  VAL   3          2HG2      VAL   3 -15.514  -5.546  -0.186
   21   3HG2  VAL   3          3HG2      VAL   3 -14.958  -4.042  -0.918
   22    H    GLU   4           H        GLU   4 -17.577  -6.212   1.081
   23    HA   GLU   4           HA       GLU   4 -17.468  -9.154   0.529
   24   1HB   GLU   4          1HB       GLU   4 -15.292  -7.760   0.845
   25   2HB   GLU   4          2HB       GLU   4 -15.793  -7.596   2.523
   26   1HG   GLU   4          1HG       GLU   4 -15.485  -9.846   2.983
   27   2HG   GLU   4          2HG       GLU   4 -15.737 -10.337   1.310
   28    H    LEU   5           H        LEU   5 -19.715  -7.497   1.335
   29    HA   LEU   5           HA       LEU   5 -21.440  -7.362   2.831
   30   1HB   LEU   5          1HB       LEU   5 -20.395  -9.966   2.929
   31   2HB   LEU   5          2HB       LEU   5 -20.661  -9.518   4.608
   32    HG   LEU   5           HG       LEU   5 -22.615 -10.624   3.397
   33   1HD1  LEU   5          1HD1      LEU   5 -22.785  -9.295   5.518
   34   2HD1  LEU   5          2HD1      LEU   5 -23.179  -7.882   4.542
   35   3HD1  LEU   5          3HD1      LEU   5 -24.252  -9.280   4.541
   36   1HD2  LEU   5          1HD2      LEU   5 -22.167  -8.936   1.369
   37   2HD2  LEU   5          2HD2      LEU   5 -23.791  -9.520   1.733
   38   3HD2  LEU   5          3HD2      LEU   5 -23.281  -7.924   2.284
   39    H    ARG   6           H        ARG   6 -18.585  -6.256   3.563
   40    HA   ARG   6           HA       ARG   6 -19.319  -4.767   5.895
   41   1HB   ARG   6          1HB       ARG   6 -18.798  -7.337   6.539
   42   2HB   ARG   6          2HB       ARG   6 -17.153  -6.714   6.533
   43   1HG   ARG   6          1HG       ARG   6 -18.552  -4.759   7.918
   44   2HG   ARG   6          2HG       ARG   6 -19.311  -6.256   8.460
   45   1HD   ARG   6          1HD       ARG   6 -17.127  -7.178   9.090
   46   2HD   ARG   6          2HD       ARG   6 -16.319  -5.712   8.495
   47    HE   ARG   6           HE       ARG   6 -18.072  -5.849  10.889
   48   1HH1  ARG   6          1HH2      ARG   6 -15.327  -4.840  11.186
   49   2HH1  ARG   6          2HH2      ARG   6 -15.519  -3.125  11.110
   50   1HH2  ARG   6          1HH1      ARG   6 -18.704  -3.300   9.689
   51   2HH2  ARG   6          2HH1      ARG   6 -17.462  -2.237  10.251
   52    H    SER   7           H        SER   7 -18.039  -4.296   3.255
   53    HA   SER   7           HA       SER   7 -15.511  -3.018   4.182
   54   1HB   SER   7          1HB       SER   7 -14.833  -5.187   3.470
   55   2HB   SER   7          2HB       SER   7 -15.887  -5.135   2.071
   56    HG   SER   7           HG       SER   7 -13.632  -4.734   1.645
   57    HA   PRO   8           HA       PRO   8 -16.900   0.213   1.477
   58   1HB   PRO   8          1HB       PRO   8 -14.537   1.487   1.016
   59   2HB   PRO   8          2HB       PRO   8 -15.415   1.593   2.557
   60   1HG   PRO   8          1HG       PRO   8 -13.049  -0.046   1.844
   61   2HG   PRO   8          2HG       PRO   8 -13.431   0.793   3.357
   62   1HD   PRO   8          1HD       PRO   8 -13.735  -1.880   3.006
   63   2HD   PRO   8          2HD       PRO   8 -14.700  -0.920   4.150
   64    H    GLY   9           H        GLY   9 -16.656   0.993  -0.757
   65   1HA   GLY   9          1HA       GLY   9 -15.807  -1.128  -2.619
   66   2HA   GLY   9          2HA       GLY   9 -16.750   0.302  -3.032
   67    H    ILE  10           H        ILE  10 -14.251  -0.834  -4.220
   68    HA   ILE  10           HA       ILE  10 -12.265  -0.204  -5.141
   69    HB   ILE  10           HB       ILE  10 -14.159   1.538  -5.672
   70   1HG1  ILE  10          1HG1      ILE  10 -11.878   0.691  -6.846
   71   2HG1  ILE  10          2HG1      ILE  10 -12.974   1.867  -7.547
   72   1HG2  ILE  10          1HG2      ILE  10 -12.136   3.196  -4.192
   73   2HG2  ILE  10          2HG2      ILE  10 -13.099   3.866  -5.503
   74   3HG2  ILE  10          3HG2      ILE  10 -13.897   3.214  -4.077
   75   1HD1  ILE  10          1HD1      ILE  10 -10.580   2.626  -5.847
   76   2HD1  ILE  10          2HD1      ILE  10 -10.531   2.519  -7.606
   77   3HD1  ILE  10          3HD1      ILE  10 -11.579   3.700  -6.823
   78    H    SER  11           H        SER  11 -12.464   0.303  -1.881
   79    HA   SER  11           HA       SER  11  -9.933   1.865  -1.719
   80   1HB   SER  11          1HB       SER  11 -12.101   2.270  -0.336
   81   2HB   SER  11          2HB       SER  11 -11.577   0.877   0.601
   82    HG   SER  11           HG       SER  11 -10.336   2.280   1.587
   83    H    ARG  12           H        ARG  12 -11.212  -1.383  -1.034
   84    HA   ARG  12           HA       ARG  12  -8.928  -2.343   0.405
   85   1HB   ARG  12          1HB       ARG  12  -9.870  -4.565  -0.055
   86   2HB   ARG  12          2HB       ARG  12 -11.118  -3.444   0.452
   87   1HG   ARG  12          1HG       ARG  12 -12.267  -3.756  -1.453
   88   2HG   ARG  12          2HG       ARG  12 -10.853  -3.424  -2.447
   89   1HD   ARG  12          1HD       ARG  12 -10.306  -5.941  -1.377
   90   2HD   ARG  12          2HD       ARG  12 -12.039  -6.002  -1.734
   91    HE   ARG  12           HE       ARG  12  -9.884  -5.646  -3.712
   92   1HH1  ARG  12          1HH1      ARG  12 -12.919  -6.911  -3.310
   93   2HH1  ARG  12          2HH1      ARG  12 -13.579  -6.334  -4.800
   94   1HH2  ARG  12          1HH2      ARG  12 -10.881  -4.254  -5.520
   95   2HH2  ARG  12          2HH2      ARG  12 -12.422  -4.827  -6.054
   96    H    PHE  13           H        PHE  13  -9.609  -2.066  -3.047
   97    HA   PHE  13           HA       PHE  13  -7.303  -3.622  -3.915
   98   1HB   PHE  13          1HB       PHE  13  -8.720  -3.646  -5.679
   99   2HB   PHE  13          2HB       PHE  13  -9.678  -2.349  -5.002
  100    HD1  PHE  13           HD1      PHE  13  -6.850  -3.189  -7.242
  101    HD2  PHE  13           HD2      PHE  13  -9.371  -0.058  -5.718
  102    HE1  PHE  13           HE1      PHE  13  -6.026  -1.662  -9.012
  103    HE2  PHE  13           HE2      PHE  13  -8.548   1.466  -7.489
  104    HZ   PHE  13           HZ       PHE  13  -6.875   0.665  -9.136
  105    H    ARG  14           H        ARG  14  -7.988  -0.239  -3.152
  106    HA   ARG  14           HA       ARG  14  -5.783   1.060  -4.365
  107   1HB   ARG  14          1HB       ARG  14  -7.538   1.550  -1.986
  108   2HB   ARG  14          2HB       ARG  14  -6.127   2.575  -2.218
  109   1HG   ARG  14          1HG       ARG  14  -6.889   3.243  -4.414
  110   2HG   ARG  14          2HG       ARG  14  -8.212   2.083  -4.356
  111   1HD   ARG  14          1HD       ARG  14  -9.412   3.892  -3.628
  112   2HD   ARG  14          2HD       ARG  14  -8.704   3.475  -2.061
  113    HE   ARG  14           HE       ARG  14  -6.800   5.110  -3.352
  114   1HH1  ARG  14          1HH1      ARG  14  -9.711   6.128  -4.116
  115   2HH1  ARG  14          2HH1      ARG  14  -9.848   7.439  -3.002
  116   1HH2  ARG  14          1HH2      ARG  14  -7.102   6.438  -1.093
  117   2HH2  ARG  14          2HH2      ARG  14  -8.347   7.624  -1.270
  118    H    ARG  15           H        ARG  15  -5.875  -0.999  -1.488
  119    HA   ARG  15           HA       ARG  15  -3.493  -0.202  -0.161
  120   1HB   ARG  15          1HB       ARG  15  -5.187  -2.645  -0.371
  121   2HB   ARG  15          2HB       ARG  15  -3.554  -2.887   0.234
  122   1HG   ARG  15          1HG       ARG  15  -4.454  -2.331   2.241
  123   2HG   ARG  15          2HG       ARG  15  -4.289  -0.680   1.659
  124   1HD   ARG  15          1HD       ARG  15  -6.543  -0.807   2.377
  125   2HD   ARG  15          2HD       ARG  15  -6.661  -1.035   0.624
  126    HE   ARG  15           HE       ARG  15  -7.047  -3.384   0.967
  127   1HH1  ARG  15          1HH2      ARG  15  -8.616  -1.988   3.278
  128   2HH1  ARG  15          2HH2      ARG  15  -8.265  -3.066   4.584
  129   1HH2  ARG  15          1HH1      ARG  15  -5.649  -4.648   2.905
  130   2HH2  ARG  15          2HH1      ARG  15  -6.569  -4.592   4.366
  131    H    LYS  16           H        LYS  16  -3.979  -2.419  -2.923
  132    HA   LYS  16           HA       LYS  16  -1.273  -3.329  -3.175
  133   1HB   LYS  16          1HB       LYS  16  -3.438  -4.234  -4.213
  134   2HB   LYS  16          2HB       LYS  16  -3.287  -2.947  -5.408
  135   1HG   LYS  16          1HG       LYS  16  -0.870  -3.866  -5.744
  136   2HG   LYS  16          2HG       LYS  16  -1.479  -5.311  -4.940
  137   1HD   LYS  16          1HD       LYS  16  -2.407  -5.994  -6.866
  138   2HD   LYS  16          2HD       LYS  16  -3.423  -4.556  -6.880
  139   1HE   LYS  16          1HE       LYS  16  -2.279  -4.294  -8.895
  140   2HE   LYS  16          2HE       LYS  16  -1.208  -3.398  -7.805
  141   1HZ   LYS  16          1HZ       LYS  16   0.013  -5.521  -7.429
  142   2HZ   LYS  16          2HZ       LYS  16  -0.916  -6.233  -8.656
  143   3HZ   LYS  16          3HZ       LYS  16   0.121  -4.941  -9.023
  144    H    ILE  17           H        ILE  17  -2.990  -0.486  -4.499
  145    HA   ILE  17           HA       ILE  17  -0.904   0.448  -6.241
  146    HB   ILE  17           HB       ILE  17  -3.007   2.013  -4.681
  147   1HG1  ILE  17          1HG1      ILE  17  -3.120   1.068  -7.564
  148   2HG1  ILE  17          2HG1      ILE  17  -3.867   0.182  -6.235
  149   1HG2  ILE  17          1HG2      ILE  17  -1.029   3.295  -5.721
  150   2HG2  ILE  17          2HG2      ILE  17  -1.703   2.830  -7.283
  151   3HG2  ILE  17          3HG2      ILE  17  -2.650   3.819  -6.173
  152   1HD1  ILE  17          1HD1      ILE  17  -4.847   2.682  -5.773
  153   2HD1  ILE  17          2HD1      ILE  17  -4.708   2.706  -7.530
  154   3HD1  ILE  17          3HD1      ILE  17  -5.679   1.463  -6.739
  155    H    ALA  18           H        ALA  18  -1.685   1.076  -2.816
  156    HA   ALA  18           HA       ALA  18   0.500   2.870  -2.272
  157   1HB   ALA  18          1HB       ALA  18  -1.388   1.156  -0.665
  158   2HB   ALA  18          2HB       ALA  18  -0.051   1.971   0.145
  159   3HB   ALA  18          3HB       ALA  18  -1.263   2.914  -0.721
  160    H    LYS  19           H        LYS  19   0.191  -0.685  -2.176
  161    HA   LYS  19           HA       LYS  19   2.554  -1.395  -0.804
  162   1HB   LYS  19          1HB       LYS  19   0.558  -2.617  -2.429
  163   2HB   LYS  19          2HB       LYS  19   2.117  -3.130  -3.062
  164   1HG   LYS  19          1HG       LYS  19   1.773  -3.169  -0.098
  165   2HG   LYS  19          2HG       LYS  19   0.918  -4.395  -1.029
  166   1HD   LYS  19          1HD       LYS  19   2.801  -5.540  -1.423
  167   2HD   LYS  19          2HD       LYS  19   3.635  -4.103  -2.003
  168   1HE   LYS  19          1HE       LYS  19   3.262  -4.734   0.946
  169   2HE   LYS  19          2HE       LYS  19   4.710  -5.166   0.026
  170   1HZ   LYS  19          1HZ       LYS  19   4.482  -2.622  -0.685
  171   2HZ   LYS  19          2HZ       LYS  19   3.759  -2.535   0.850
  172   3HZ   LYS  19          3HZ       LYS  19   5.348  -3.114   0.689
  173    H    ARG  20           H        ARG  20   2.112  -0.358  -4.166
  174    HA   ARG  20           HA       ARG  20   4.768  -0.918  -5.133
  175   1HB   ARG  20          1HB       ARG  20   2.297   0.255  -6.047
  176   2HB   ARG  20          2HB       ARG  20   3.623   1.331  -6.466
  177   1HG   ARG  20          1HG       ARG  20   4.777  -0.919  -7.261
  178   2HG   ARG  20          2HG       ARG  20   3.106  -1.477  -7.371
  179   1HD   ARG  20          1HD       ARG  20   2.563   0.486  -8.812
  180   2HD   ARG  20          2HD       ARG  20   4.268   0.969  -8.757
  181    HE   ARG  20           HE       ARG  20   4.755  -1.357  -9.726
  182   1HH1  ARG  20          1HH1      ARG  20   1.996  -2.404  -9.786
  183   2HH1  ARG  20          2HH1      ARG  20   1.483  -2.069 -11.404
  184   1HH2  ARG  20          1HH2      ARG  20   4.024   0.261 -11.973
  185   2HH2  ARG  20          2HH2      ARG  20   2.652  -0.531 -12.664
  186    H    SER  21           H        SER  21   3.242   2.081  -3.833
  187    HA   SER  21           HA       SER  21   5.600   3.698  -4.045
  188   1HB   SER  21          1HB       SER  21   4.370   5.290  -2.723
  189   2HB   SER  21          2HB       SER  21   3.232   4.488  -3.791
  190    HG   SER  21           HG       SER  21   2.497   3.301  -2.037
  191    H    ILE  22           H        ILE  22   4.479   1.525  -1.470
  192    HA   ILE  22           HA       ILE  22   6.384   2.360   0.533
  193    HB   ILE  22           HB       ILE  22   4.887  -0.246   0.094
  194   1HG1  ILE  22          1HG1      ILE  22   4.244   1.781   2.217
  195   2HG1  ILE  22          2HG1      ILE  22   3.725   2.105   0.563
  196   1HG2  ILE  22          1HG2      ILE  22   6.644   0.725   2.335
  197   2HG2  ILE  22          2HG2      ILE  22   5.287  -0.345   2.687
  198   3HG2  ILE  22          3HG2      ILE  22   6.567  -0.873   1.597
  199   1HD1  ILE  22          1HD1      ILE  22   3.086  -0.414   2.126
  200   2HD1  ILE  22          2HD1      ILE  22   1.976   0.929   1.854
  201   3HD1  ILE  22          3HD1      ILE  22   2.537  -0.038   0.492
  202    H    LYS  23           H        LYS  23   6.498  -0.057  -2.095
  203    HA   LYS  23           HA       LYS  23   8.954  -1.338  -1.374
  204   1HB   LYS  23          1HB       LYS  23   7.209  -2.026  -3.106
  205   2HB   LYS  23          2HB       LYS  23   7.905  -0.803  -4.172
  206   1HG   LYS  23          1HG       LYS  23   9.950  -1.932  -4.358
  207   2HG   LYS  23          2HG       LYS  23   9.687  -2.852  -2.880
  208   1HD   LYS  23          1HD       LYS  23   9.113  -4.531  -4.292
  209   2HD   LYS  23          2HD       LYS  23   7.564  -3.692  -4.385
  210   1HE   LYS  23          1HE       LYS  23   8.367  -2.436  -6.370
  211   2HE   LYS  23          2HE       LYS  23   9.902  -3.323  -6.297
  212   1HZ   LYS  23          1HZ       LYS  23   8.644  -5.411  -6.448
  213   2HZ   LYS  23          2HZ       LYS  23   7.201  -4.532  -6.601
  214   3HZ   LYS  23          3HZ       LYS  23   8.390  -4.422  -7.806
  215    H    THR  24           H        THR  24   8.293   1.490  -3.479
  216    HA   THR  24           HA       THR  24  11.068   2.051  -4.076
  217    HB   THR  24           HB       THR  24   8.813   4.079  -4.005
  218    HG1  THR  24           HG1      THR  24   7.801   2.918  -5.429
  219   1HG2  THR  24          1HG2      THR  24  11.230   3.668  -5.776
  220   2HG2  THR  24          2HG2      THR  24   9.989   4.889  -6.055
  221   3HG2  THR  24          3HG2      THR  24  10.983   4.958  -4.601
  222    H    LEU  25           H        LEU  25   8.762   3.219  -1.617
  223    HA   LEU  25           HA       LEU  25  10.385   5.171  -0.319
  224   1HB   LEU  25          1HB       LEU  25   7.920   4.834  -0.075
  225   2HB   LEU  25          2HB       LEU  25   8.242   3.355   0.824
  226    HG   LEU  25           HG       LEU  25   9.802   5.481   1.965
  227   1HD1  LEU  25          1HD1      LEU  25   7.860   6.810   0.854
  228   2HD1  LEU  25          2HD1      LEU  25   6.851   6.075   2.101
  229   3HD1  LEU  25          3HD1      LEU  25   8.207   7.105   2.559
  230   1HD2  LEU  25          1HD2      LEU  25   7.513   3.719   2.861
  231   2HD2  LEU  25          2HD2      LEU  25   9.220   3.591   3.284
  232   3HD2  LEU  25          3HD2      LEU  25   8.245   4.904   3.941
  233    H    GLU  26           H        GLU  26  10.062   1.640   0.224
  234    HA   GLU  26           HA       GLU  26  11.811   1.583   2.534
  235   1HB   GLU  26          1HB       GLU  26  10.608  -0.426   0.638
  236   2HB   GLU  26          2HB       GLU  26  11.802  -0.940   1.833
  237   1HG   GLU  26          1HG       GLU  26  10.357   0.317   3.561
  238   2HG   GLU  26          2HG       GLU  26   9.099   0.312   2.322
  239    H    HIS  27           H        HIS  27  12.294   1.067  -0.963
  240    HA   HIS  27           HA       HIS  27  14.941   0.099  -1.015
  241   1HB   HIS  27          1HB       HIS  27  13.273   0.434  -2.906
  242   2HB   HIS  27          2HB       HIS  27  13.740   2.132  -2.913
  243    HD1  HIS  27           HD1      HIS  27  16.145   2.712  -3.717
  244    HD2  HIS  27           HD2      HIS  27  15.227  -1.346  -3.945
  245    HE1  HIS  27           HE1      HIS  27  17.960   1.646  -5.129
  246    H    LYS  28           H        LYS  28  13.826   3.508  -0.858
  247    HA   LYS  28           HA       LYS  28  16.608   4.465  -0.645
  248   1HB   LYS  28          1HB       LYS  28  15.625   6.661  -0.813
  249   2HB   LYS  28          2HB       LYS  28  14.880   5.611  -2.007
  250   1HG   LYS  28          1HG       LYS  28  13.206   5.300   0.166
  251   2HG   LYS  28          2HG       LYS  28  13.680   6.990   0.301
  252   1HD   LYS  28          1HD       LYS  28  12.955   6.056  -2.425
  253   2HD   LYS  28          2HD       LYS  28  11.637   6.142  -1.265
  254   1HE   LYS  28          1HE       LYS  28  13.538   8.468  -1.599
  255   2HE   LYS  28          2HE       LYS  28  12.141   8.271  -2.666
  256   1HZ   LYS  28          1HZ       LYS  28  10.937   7.867  -0.354
  257   2HZ   LYS  28          2HZ       LYS  28  12.215   8.837   0.203
  258   3HZ   LYS  28          3HZ       LYS  28  11.159   9.422  -0.990
  259    H    ARG  29           H        ARG  29  14.668   3.056   1.636
  260    HA   ARG  29           HA       ARG  29  15.545   4.887   3.829
  261   1HB   ARG  29          1HB       ARG  29  13.094   3.432   3.208
  262   2HB   ARG  29          2HB       ARG  29  13.677   3.068   4.830
  263   1HG   ARG  29          1HG       ARG  29  13.704   5.380   5.450
  264   2HG   ARG  29          2HG       ARG  29  13.440   5.898   3.785
  265   1HD   ARG  29          1HD       ARG  29  11.190   5.087   3.781
  266   2HD   ARG  29          2HD       ARG  29  11.432   4.200   5.298
  267    HE   ARG  29           HE       ARG  29  11.169   7.149   5.059
  268   1HH1  ARG  29          1HH2      ARG  29   9.685   5.094   6.882
  269   2HH1  ARG  29          2HH2      ARG  29  10.330   5.535   8.425
  270   1HH2  ARG  29          1HH1      ARG  29  12.946   7.419   7.089
  271   2HH2  ARG  29          2HH1      ARG  29  12.188   6.864   8.540
  272    H    GLU  30           H        GLU  30  15.354   1.419   2.902
  273    HA   GLU  30           HA       GLU  30  16.496   0.238   5.171
  274   1HB   GLU  30          1HB       GLU  30  17.282  -1.531   3.546
  275   2HB   GLU  30          2HB       GLU  30  15.579  -1.120   3.448
  276   1HG   GLU  30          1HG       GLU  30  15.778  -0.429   1.308
  277   2HG   GLU  30          2HG       GLU  30  17.217   0.524   1.654
  278    H    ASN  31           H        ASN  31  18.172   2.011   2.614
  279    HA   ASN  31           HA       ASN  31  20.824   1.415   3.847
  280   1HB   ASN  31          1HB       ASN  31  20.238   1.098   1.377
  281   2HB   ASN  31          2HB       ASN  31  20.167   2.853   1.267
  282   1HD2  ASN  31          2HD2      ASN  31  22.123   3.672   0.453
  283   2HD2  ASN  31          1HD2      ASN  31  23.657   3.036   0.808
  284    H    ALA  32           H        ALA  32  18.744   3.334   5.007
  285    HA   ALA  32           HA       ALA  32  20.473   5.757   5.207
  286   1HB   ALA  32          1HB       ALA  32  18.586   5.898   3.466
  287   2HB   ALA  32          2HB       ALA  32  17.475   5.853   4.836
  288   3HB   ALA  32          3HB       ALA  32  18.635   7.173   4.683
  289    H    LYS  33           H        LYS  33  19.266   7.239   6.996
  290    HA   LYS  33           HA       LYS  33  18.598   5.453   9.312
  291   1HB   LYS  33          1HB       LYS  33  20.068   8.084   9.047
  292   2HB   LYS  33          2HB       LYS  33  19.460   7.518  10.602
  293   1HG   LYS  33          1HG       LYS  33  20.692   5.302  10.052
  294   2HG   LYS  33          2HG       LYS  33  21.556   6.250   8.841
  295   1HD   LYS  33          1HD       LYS  33  22.275   7.835  10.589
  296   2HD   LYS  33          2HD       LYS  33  21.420   6.883  11.804
  297   1HE   LYS  33          1HE       LYS  33  22.873   4.976  11.441
  298   2HE   LYS  33          2HE       LYS  33  23.647   5.772  10.058
  299   1HZ   LYS  33          1HZ       LYS  33  23.652   6.798  12.852
  300   2HZ   LYS  33          2HZ       LYS  33  24.962   6.052  12.073
  301   3HZ   LYS  33          3HZ       LYS  33  24.394   7.544  11.516
  302    H    GLU  34           H        GLU  34  17.987   8.817   8.168
  303    HA   GLU  34           HA       GLU  34  15.241   8.642   9.343
  304   1HB   GLU  34          1HB       GLU  34  17.153  10.921   8.770
  305   2HB   GLU  34          2HB       GLU  34  15.455  11.199   9.140
  306   1HG   GLU  34          1HG       GLU  34  15.669  10.202  11.312
  307   2HG   GLU  34          2HG       GLU  34  17.277   9.585  10.941
  Start of MODEL   19
    1   1H    CYS   1          1H        CYS   1 -18.846 -18.198   6.095
    2   2H    CYS   1          2H        CYS   1 -18.776 -18.582   7.749
    3   3H    CYS   1          3H        CYS   1 -20.135 -17.792   7.121
    4    HA   CYS   1           HA       CYS   1 -18.771 -16.192   8.299
    5   1HB   CYS   1          1HB       CYS   1 -16.734 -17.715   7.863
    6   2HB   CYS   1          2HB       CYS   1 -16.595 -16.878   6.318
    7    HG   CYS   1           HG       CYS   1 -16.165 -14.656   7.584
    8    H    ALA   2           H        ALA   2 -18.726 -14.018   7.515
    9    HA   ALA   2           HA       ALA   2 -19.817 -13.645   4.765
   10   1HB   ALA   2          1HB       ALA   2 -20.908 -12.827   6.940
   11   2HB   ALA   2          2HB       ALA   2 -19.624 -11.621   6.997
   12   3HB   ALA   2          3HB       ALA   2 -20.748 -11.647   5.639
   13    H    VAL   3           H        VAL   3 -17.003 -14.176   4.858
   14    HA   VAL   3           HA       VAL   3 -15.338 -11.869   4.973
   15    HB   VAL   3           HB       VAL   3 -13.768 -13.202   3.590
   16   1HG1  VAL   3          1HG1      VAL   3 -14.291 -13.536   6.133
   17   2HG1  VAL   3          2HG1      VAL   3 -14.937 -15.088   5.600
   18   3HG1  VAL   3          3HG1      VAL   3 -13.250 -14.682   5.288
   19   1HG2  VAL   3          1HG2      VAL   3 -16.131 -15.098   3.372
   20   2HG2  VAL   3          2HG2      VAL   3 -15.172 -14.408   2.065
   21   3HG2  VAL   3          3HG2      VAL   3 -14.465 -15.618   3.132
   22    H    GLU   4           H        GLU   4 -17.105 -13.239   2.202
   23    HA   GLU   4           HA       GLU   4 -16.121 -11.328   0.285
   24   1HB   GLU   4          1HB       GLU   4 -18.127 -12.155  -1.058
   25   2HB   GLU   4          2HB       GLU   4 -16.970 -13.380  -0.560
   26   1HG   GLU   4          1HG       GLU   4 -18.510 -14.462   0.699
   27   2HG   GLU   4          2HG       GLU   4 -19.095 -12.969   1.423
   28    H    LEU   5           H        LEU   5 -18.806 -11.308   2.506
   29    HA   LEU   5           HA       LEU   5 -20.236  -9.035   1.430
   30   1HB   LEU   5          1HB       LEU   5 -20.514 -10.930   3.522
   31   2HB   LEU   5          2HB       LEU   5 -20.488  -9.351   4.302
   32    HG   LEU   5           HG       LEU   5 -22.174  -8.674   2.416
   33   1HD1  LEU   5          1HD1      LEU   5 -22.415 -11.698   2.455
   34   2HD1  LEU   5          2HD1      LEU   5 -23.620 -10.613   1.764
   35   3HD1  LEU   5          3HD1      LEU   5 -22.003 -10.691   1.068
   36   1HD2  LEU   5          1HD2      LEU   5 -22.788 -10.435   4.802
   37   2HD2  LEU   5          2HD2      LEU   5 -22.873  -8.676   4.701
   38   3HD2  LEU   5          3HD2      LEU   5 -24.054  -9.666   3.845
   39    H    ARG   6           H        ARG   6 -17.658  -9.439   3.846
   40    HA   ARG   6           HA       ARG   6 -17.547  -6.642   4.644
   41   1HB   ARG   6          1HB       ARG   6 -16.896  -8.726   5.954
   42   2HB   ARG   6          2HB       ARG   6 -15.448  -8.794   4.954
   43   1HG   ARG   6          1HG       ARG   6 -14.506  -6.950   5.936
   44   2HG   ARG   6          2HG       ARG   6 -16.060  -6.172   6.231
   45   1HD   ARG   6          1HD       ARG   6 -15.555  -8.694   7.740
   46   2HD   ARG   6          2HD       ARG   6 -14.606  -7.276   8.222
   47    HE   ARG   6           HE       ARG   6 -17.521  -6.857   7.868
   48   1HH1  ARG   6          1HH1      ARG   6 -15.788  -4.919   9.324
   49   2HH1  ARG   6          2HH1      ARG   6 -16.109  -5.297  10.980
   50   1HH2  ARG   6          1HH2      ARG   6 -17.521  -8.408  10.242
   51   2HH2  ARG   6          2HH2      ARG   6 -17.109  -7.308  11.510
   52    H    SER   7           H        SER   7 -16.152  -8.470   1.987
   53    HA   SER   7           HA       SER   7 -13.816  -6.875   1.496
   54   1HB   SER   7          1HB       SER   7 -15.475  -8.865   0.003
   55   2HB   SER   7          2HB       SER   7 -14.313  -7.907  -0.898
   56    HG   SER   7           HG       SER   7 -13.934  -9.804   1.128
   57    HA   PRO   8           HA       PRO   8 -16.094  -3.372  -0.179
   58   1HB   PRO   8          1HB       PRO   8 -13.958  -1.707  -0.473
   59   2HB   PRO   8          2HB       PRO   8 -14.762  -2.010   1.080
   60   1HG   PRO   8          1HG       PRO   8 -12.190  -3.033   0.068
   61   2HG   PRO   8          2HG       PRO   8 -12.704  -2.688   1.724
   62   1HD   PRO   8          1HD       PRO   8 -12.546  -5.204   0.569
   63   2HD   PRO   8          2HD       PRO   8 -13.429  -4.793   2.053
   64    H    GLY   9           H        GLY   9 -12.905  -4.107  -1.727
   65   1HA   GLY   9          1HA       GLY   9 -12.985  -5.017  -4.061
   66   2HA   GLY   9          2HA       GLY   9 -14.246  -3.830  -4.389
   67    H    ILE  10           H        ILE  10 -13.658  -1.575  -4.475
   68    HA   ILE  10           HA       ILE  10 -11.157  -1.011  -5.745
   69    HB   ILE  10           HB       ILE  10 -13.069   0.874  -4.338
   70   1HG1  ILE  10          1HG1      ILE  10 -13.132   0.850  -7.254
   71   2HG1  ILE  10          2HG1      ILE  10 -13.546  -0.733  -6.583
   72   1HG2  ILE  10          1HG2      ILE  10 -10.588   1.315  -5.832
   73   2HG2  ILE  10          2HG2      ILE  10 -11.953   2.233  -6.469
   74   3HG2  ILE  10          3HG2      ILE  10 -11.482   2.410  -4.780
   75   1HD1  ILE  10          1HD1      ILE  10 -14.755   1.841  -5.559
   76   2HD1  ILE  10          2HD1      ILE  10 -15.512   0.859  -6.815
   77   3HD1  ILE  10          3HD1      ILE  10 -15.267   0.195  -5.198
   78    H    SER  11           H        SER  11 -12.277  -0.244  -2.416
   79    HA   SER  11           HA       SER  11  -9.943   1.030  -1.504
   80   1HB   SER  11          1HB       SER  11 -12.309   0.619  -0.422
   81   2HB   SER  11          2HB       SER  11 -11.516  -0.772   0.302
   82    HG   SER  11           HG       SER  11 -11.425   1.315   1.478
   83    H    ARG  12           H        ARG  12 -10.658  -2.452  -1.693
   84    HA   ARG  12           HA       ARG  12  -8.453  -3.465  -0.191
   85   1HB   ARG  12          1HB       ARG  12 -10.580  -4.594  -1.236
   86   2HB   ARG  12          2HB       ARG  12  -9.569  -4.791  -2.667
   87   1HG   ARG  12          1HG       ARG  12  -8.573  -5.664   0.040
   88   2HG   ARG  12          2HG       ARG  12  -9.627  -6.708  -0.909
   89   1HD   ARG  12          1HD       ARG  12  -7.944  -6.267  -2.856
   90   2HD   ARG  12          2HD       ARG  12  -6.834  -5.775  -1.562
   91    HE   ARG  12           HE       ARG  12  -8.042  -8.486  -1.831
   92   1HH1  ARG  12          1HH2      ARG  12  -5.123  -8.254  -1.985
   93   2HH1  ARG  12          2HH2      ARG  12  -4.608  -8.581  -0.367
   94   1HH2  ARG  12          1HH1      ARG  12  -7.764  -8.022   1.012
   95   2HH2  ARG  12          2HH1      ARG  12  -6.124  -8.443   1.356
   96    H    PHE  13           H        PHE  13  -8.793  -2.712  -3.677
   97    HA   PHE  13           HA       PHE  13  -5.977  -3.284  -4.219
   98   1HB   PHE  13          1HB       PHE  13  -6.807  -3.497  -6.306
   99   2HB   PHE  13          2HB       PHE  13  -8.387  -3.165  -5.641
  100    HD1  PHE  13           HD1      PHE  13  -5.403  -1.569  -7.254
  101    HD2  PHE  13           HD2      PHE  13  -9.536  -1.206  -6.182
  102    HE1  PHE  13           HE1      PHE  13  -5.591   0.472  -8.652
  103    HE2  PHE  13           HE2      PHE  13  -9.729   0.835  -7.573
  104    HZ   PHE  13           HZ       PHE  13  -7.761   1.674  -8.808
  105    H    ARG  14           H        ARG  14  -7.894  -0.467  -3.382
  106    HA   ARG  14           HA       ARG  14  -6.193   1.676  -4.141
  107   1HB   ARG  14          1HB       ARG  14  -8.553   1.730  -3.244
  108   2HB   ARG  14          2HB       ARG  14  -7.896   1.373  -1.650
  109   1HG   ARG  14          1HG       ARG  14  -6.426   3.471  -2.005
  110   2HG   ARG  14          2HG       ARG  14  -7.544   3.864  -3.313
  111   1HD   ARG  14          1HD       ARG  14  -9.200   4.462  -1.871
  112   2HD   ARG  14          2HD       ARG  14  -8.904   3.068  -0.817
  113    HE   ARG  14           HE       ARG  14  -7.255   4.327   0.376
  114   1HH1  ARG  14          1HH1      ARG  14  -5.897   5.744  -1.842
  115   2HH1  ARG  14          2HH1      ARG  14  -6.384   7.388  -1.610
  116   1HH2  ARG  14          1HH2      ARG  14  -9.051   6.562   0.483
  117   2HH2  ARG  14          2HH2      ARG  14  -8.190   7.853  -0.278
  118    H    ARG  15           H        ARG  15  -6.159  -0.461  -1.283
  119    HA   ARG  15           HA       ARG  15  -4.082   0.872   0.200
  120   1HB   ARG  15          1HB       ARG  15  -5.604  -1.635   0.266
  121   2HB   ARG  15          2HB       ARG  15  -3.932  -1.875   0.759
  122   1HG   ARG  15          1HG       ARG  15  -5.542   0.405   1.889
  123   2HG   ARG  15          2HG       ARG  15  -5.669  -1.214   2.573
  124   1HD   ARG  15          1HD       ARG  15  -3.379  -1.259   3.199
  125   2HD   ARG  15          2HD       ARG  15  -2.986   0.136   2.177
  126    HE   ARG  15           HE       ARG  15  -4.631   0.296   4.671
  127   1HH1  ARG  15          1HH2      ARG  15  -1.946   1.458   4.807
  128   2HH1  ARG  15          2HH2      ARG  15  -2.196   3.113   4.382
  129   1HH2  ARG  15          1HH1      ARG  15  -5.333   2.541   2.966
  130   2HH2  ARG  15          2HH1      ARG  15  -4.142   3.739   3.335
  131    H    LYS  16           H        LYS  16  -4.070  -1.697  -2.259
  132    HA   LYS  16           HA       LYS  16  -1.259  -2.279  -2.232
  133   1HB   LYS  16          1HB       LYS  16  -3.304  -3.551  -3.231
  134   2HB   LYS  16          2HB       LYS  16  -3.057  -2.519  -4.640
  135   1HG   LYS  16          1HG       LYS  16  -0.704  -3.288  -4.782
  136   2HG   LYS  16          2HG       LYS  16  -0.979  -4.350  -3.403
  137   1HD   LYS  16          1HD       LYS  16  -1.571  -5.915  -4.909
  138   2HD   LYS  16          2HD       LYS  16  -3.071  -5.013  -5.088
  139   1HE   LYS  16          1HE       LYS  16  -0.813  -3.960  -6.693
  140   2HE   LYS  16          2HE       LYS  16  -1.374  -5.574  -7.162
  141   1HZ   LYS  16          1HZ       LYS  16  -3.675  -4.691  -7.118
  142   2HZ   LYS  16          2HZ       LYS  16  -3.052  -3.138  -6.861
  143   3HZ   LYS  16          3HZ       LYS  16  -2.700  -3.967  -8.302
  144    H    ILE  17           H        ILE  17  -3.176   0.217  -3.910
  145    HA   ILE  17           HA       ILE  17  -1.216   1.029  -5.837
  146    HB   ILE  17           HB       ILE  17  -3.390   2.578  -4.374
  147   1HG1  ILE  17          1HG1      ILE  17  -3.400   1.545  -7.221
  148   2HG1  ILE  17          2HG1      ILE  17  -4.029   0.593  -5.876
  149   1HG2  ILE  17          1HG2      ILE  17  -1.478   3.371  -6.534
  150   2HG2  ILE  17          2HG2      ILE  17  -3.136   3.970  -6.630
  151   3HG2  ILE  17          3HG2      ILE  17  -2.148   4.332  -5.217
  152   1HD1  ILE  17          1HD1      ILE  17  -5.149   3.190  -5.623
  153   2HD1  ILE  17          2HD1      ILE  17  -5.309   2.728  -7.315
  154   3HD1  ILE  17          3HD1      ILE  17  -5.978   1.696  -6.055
  155    H    ALA  18           H        ALA  18  -1.883   2.130  -2.497
  156    HA   ALA  18           HA       ALA  18   0.343   3.988  -2.384
  157   1HB   ALA  18          1HB       ALA  18  -1.689   2.816  -0.533
  158   2HB   ALA  18          2HB       ALA  18  -0.220   3.447   0.211
  159   3HB   ALA  18          3HB       ALA  18  -1.231   4.502  -0.776
  160    H    LYS  19           H        LYS  19  -0.080   0.555  -1.476
  161    HA   LYS  19           HA       LYS  19   2.406   0.178  -0.129
  162   1HB   LYS  19          1HB       LYS  19   0.288  -1.375  -0.560
  163   2HB   LYS  19          2HB       LYS  19   1.262  -1.943  -1.919
  164   1HG   LYS  19          1HG       LYS  19   3.171  -2.226  -0.227
  165   2HG   LYS  19          2HG       LYS  19   1.939  -2.038   1.022
  166   1HD   LYS  19          1HD       LYS  19   0.651  -3.907  -0.113
  167   2HD   LYS  19          2HD       LYS  19   2.075  -4.175  -1.117
  168   1HE   LYS  19          1HE       LYS  19   2.676  -5.616   0.557
  169   2HE   LYS  19          2HE       LYS  19   3.218  -4.140   1.373
  170   1HZ   LYS  19          1HZ       LYS  19   0.436  -5.170   1.573
  171   2HZ   LYS  19          2HZ       LYS  19   1.647  -5.556   2.690
  172   3HZ   LYS  19          3HZ       LYS  19   1.158  -3.943   2.501
  173    H    ARG  20           H        ARG  20   1.593   0.228  -3.594
  174    HA   ARG  20           HA       ARG  20   4.047  -0.780  -4.658
  175   1HB   ARG  20          1HB       ARG  20   1.706  -0.184  -5.720
  176   2HB   ARG  20          2HB       ARG  20   2.446   1.394  -5.984
  177   1HG   ARG  20          1HG       ARG  20   4.319   0.304  -7.192
  178   2HG   ARG  20          2HG       ARG  20   3.541  -1.262  -6.961
  179   1HD   ARG  20          1HD       ARG  20   1.578  -0.509  -8.245
  180   2HD   ARG  20          2HD       ARG  20   2.320   1.086  -8.462
  181    HE   ARG  20           HE       ARG  20   3.973   0.107  -9.909
  182   1HH1  ARG  20          1HH2      ARG  20   1.423  -1.273 -10.865
  183   2HH1  ARG  20          2HH2      ARG  20   1.947  -2.916 -10.985
  184   1HH2  ARG  20          1HH1      ARG  20   4.826  -2.381  -9.076
  185   2HH2  ARG  20          2HH1      ARG  20   3.914  -3.554  -9.959
  186    H    SER  21           H        SER  21   3.036   2.537  -3.757
  187    HA   SER  21           HA       SER  21   5.524   3.773  -4.632
  188   1HB   SER  21          1HB       SER  21   3.023   4.585  -3.220
  189   2HB   SER  21          2HB       SER  21   4.435   5.621  -3.044
  190    HG   SER  21           HG       SER  21   4.161   6.225  -5.058
  191    H    ILE  22           H        ILE  22   4.547   2.181  -1.646
  192    HA   ILE  22           HA       ILE  22   6.776   3.411  -0.118
  193    HB   ILE  22           HB       ILE  22   4.623   1.416   0.655
  194   1HG1  ILE  22          1HG1      ILE  22   4.742   4.264   1.612
  195   2HG1  ILE  22          2HG1      ILE  22   4.077   3.936   0.011
  196   1HG2  ILE  22          1HG2      ILE  22   6.930   2.611   2.107
  197   2HG2  ILE  22          2HG2      ILE  22   5.403   2.555   2.984
  198   3HG2  ILE  22          3HG2      ILE  22   6.115   1.068   2.359
  199   1HD1  ILE  22          1HD1      ILE  22   2.633   2.144   1.188
  200   2HD1  ILE  22          2HD1      ILE  22   3.083   2.963   2.685
  201   3HD1  ILE  22          3HD1      ILE  22   2.200   3.835   1.432
  202    H    LYS  23           H        LYS  23   5.746   0.190  -1.299
  203    HA   LYS  23           HA       LYS  23   7.811  -1.421  -0.237
  204   1HB   LYS  23          1HB       LYS  23   5.751  -2.176  -1.393
  205   2HB   LYS  23          2HB       LYS  23   6.406  -1.598  -2.921
  206   1HG   LYS  23          1HG       LYS  23   8.349  -3.316  -1.674
  207   2HG   LYS  23          2HG       LYS  23   6.790  -4.136  -1.696
  208   1HD   LYS  23          1HD       LYS  23   6.572  -3.806  -4.084
  209   2HD   LYS  23          2HD       LYS  23   8.028  -2.812  -4.124
  210   1HE   LYS  23          1HE       LYS  23   8.517  -5.428  -2.893
  211   2HE   LYS  23          2HE       LYS  23   7.942  -5.562  -4.562
  212   1HZ   LYS  23          1HZ       LYS  23   9.609  -3.936  -5.239
  213   2HZ   LYS  23          2HZ       LYS  23  10.178  -3.825  -3.645
  214   3HZ   LYS  23          3HZ       LYS  23  10.335  -5.281  -4.504
  215    H    THR  24           H        THR  24   7.779   0.473  -3.264
  216    HA   THR  24           HA       THR  24  10.401  -0.317  -4.193
  217    HB   THR  24           HB       THR  24   8.658   2.121  -4.742
  218    HG1  THR  24           HG1      THR  24   7.529   0.756  -5.856
  219   1HG2  THR  24          1HG2      THR  24  11.118   2.261  -5.465
  220   2HG2  THR  24          2HG2      THR  24  10.746   0.940  -6.576
  221   3HG2  THR  24          3HG2      THR  24   9.908   2.482  -6.726
  222    H    LEU  25           H        LEU  25   9.151   2.432  -2.302
  223    HA   LEU  25           HA       LEU  25  11.601   3.894  -1.998
  224   1HB   LEU  25          1HB       LEU  25   8.879   4.083  -1.223
  225   2HB   LEU  25          2HB       LEU  25   9.809   4.136   0.268
  226    HG   LEU  25           HG       LEU  25  11.234   5.776  -1.511
  227   1HD1  LEU  25          1HD1      LEU  25   8.243   6.079  -1.805
  228   2HD1  LEU  25          2HD1      LEU  25   9.349   7.424  -2.083
  229   3HD1  LEU  25          3HD1      LEU  25   9.460   5.971  -3.076
  230   1HD2  LEU  25          1HD2      LEU  25   9.264   6.386   0.716
  231   2HD2  LEU  25          2HD2      LEU  25  11.015   6.237   0.852
  232   3HD2  LEU  25          3HD2      LEU  25  10.311   7.602  -0.015
  233    H    GLU  26           H        GLU  26   9.963   1.510   0.085
  234    HA   GLU  26           HA       GLU  26  11.770   1.427   2.273
  235   1HB   GLU  26          1HB       GLU  26   9.912  -0.583   0.988
  236   2HB   GLU  26          2HB       GLU  26  10.810  -0.953   2.460
  237   1HG   GLU  26          1HG       GLU  26   9.145   1.553   2.272
  238   2HG   GLU  26          2HG       GLU  26   8.403   0.009   2.692
  239    H    HIS  27           H        HIS  27  11.787  -0.374  -0.798
  240    HA   HIS  27           HA       HIS  27  13.898  -2.200  -0.353
  241   1HB   HIS  27          1HB       HIS  27  12.384  -1.102  -2.571
  242   2HB   HIS  27          2HB       HIS  27  14.071  -1.312  -3.027
  243    HD1  HIS  27           HD1      HIS  27  14.546  -3.579  -3.940
  244    HD2  HIS  27           HD2      HIS  27  11.451  -3.672  -1.136
  245    HE1  HIS  27           HE1      HIS  27  13.766  -5.981  -3.811
  246    H    LYS  28           H        LYS  28  14.075   1.092  -1.751
  247    HA   LYS  28           HA       LYS  28  16.970   1.114  -1.941
  248   1HB   LYS  28          1HB       LYS  28  14.770   3.166  -2.162
  249   2HB   LYS  28          2HB       LYS  28  16.463   3.643  -2.227
  250   1HG   LYS  28          1HG       LYS  28  16.176   3.264  -4.466
  251   2HG   LYS  28          2HG       LYS  28  16.535   1.604  -3.995
  252   1HD   LYS  28          1HD       LYS  28  14.150   1.107  -3.812
  253   2HD   LYS  28          2HD       LYS  28  13.747   2.780  -4.193
  254   1HE   LYS  28          1HE       LYS  28  14.291   2.541  -6.440
  255   2HE   LYS  28          2HE       LYS  28  15.446   1.234  -6.131
  256   1HZ   LYS  28          1HZ       LYS  28  12.668   0.704  -5.385
  257   2HZ   LYS  28          2HZ       LYS  28  13.005   0.793  -7.044
  258   3HZ   LYS  28          3HZ       LYS  28  13.836  -0.320  -6.070
  259    H    ARG  29           H        ARG  29  14.710   1.947   0.650
  260    HA   ARG  29           HA       ARG  29  16.432   3.653   2.168
  261   1HB   ARG  29          1HB       ARG  29  13.957   3.330   2.465
  262   2HB   ARG  29          2HB       ARG  29  14.295   1.753   3.172
  263   1HG   ARG  29          1HG       ARG  29  13.981   3.425   4.934
  264   2HG   ARG  29          2HG       ARG  29  15.640   2.832   4.943
  265   1HD   ARG  29          1HD       ARG  29  15.241   5.192   3.212
  266   2HD   ARG  29          2HD       ARG  29  14.947   5.499   4.934
  267    HE   ARG  29           HE       ARG  29  17.450   4.107   4.064
  268   1HH1  ARG  29          1HH2      ARG  29  17.672   7.062   3.908
  269   2HH1  ARG  29          2HH2      ARG  29  18.223   7.494   5.489
  270   1HH2  ARG  29          1HH1      ARG  29  17.316   4.431   6.905
  271   2HH2  ARG  29          2HH1      ARG  29  18.018   5.981   7.213
  272    H    GLU  30           H        GLU  30  15.917   0.093   2.415
  273    HA   GLU  30           HA       GLU  30  18.121  -0.105   4.375
  274   1HB   GLU  30          1HB       GLU  30  16.285  -2.137   3.061
  275   2HB   GLU  30          2HB       GLU  30  17.500  -2.547   4.275
  276   1HG   GLU  30          1HG       GLU  30  16.384  -0.687   5.707
  277   2HG   GLU  30          2HG       GLU  30  15.027  -0.861   4.597
  278    H    ASN  31           H        ASN  31  17.520  -0.944   0.962
  279    HA   ASN  31           HA       ASN  31  20.326  -1.893   0.657
  280   1HB   ASN  31          1HB       ASN  31  18.257  -3.183  -0.124
  281   2HB   ASN  31          2HB       ASN  31  18.036  -1.921  -1.329
  282   1HD2  ASN  31          2HD2      ASN  31  18.399  -3.612  -3.029
  283   2HD2  ASN  31          1HD2      ASN  31  19.979  -4.126  -3.367
  284    H    ALA  32           H        ALA  32  20.282   0.766   1.167
  285    HA   ALA  32           HA       ALA  32  20.061   2.388  -1.264
  286   1HB   ALA  32          1HB       ALA  32  19.994   2.805   1.501
  287   2HB   ALA  32          2HB       ALA  32  21.461   3.623   0.961
  288   3HB   ALA  32          3HB       ALA  32  19.903   4.034   0.244
  289    H    LYS  33           H        LYS  33  22.667   0.668   0.349
  290    HA   LYS  33           HA       LYS  33  24.873   0.301  -0.187
  291   1HB   LYS  33          1HB       LYS  33  23.835   1.443  -2.777
  292   2HB   LYS  33          2HB       LYS  33  25.519   0.981  -2.590
  293   1HG   LYS  33          1HG       LYS  33  24.828  -1.081  -3.213
  294   2HG   LYS  33          2HG       LYS  33  24.241  -1.220  -1.558
  295   1HD   LYS  33          1HD       LYS  33  22.051  -0.953  -2.156
  296   2HD   LYS  33          2HD       LYS  33  22.424   0.139  -3.485
  297   1HE   LYS  33          1HE       LYS  33  23.349  -2.683  -3.797
  298   2HE   LYS  33          2HE       LYS  33  21.605  -2.402  -3.892
  299   1HZ   LYS  33          1HZ       LYS  33  22.146  -0.519  -5.452
  300   2HZ   LYS  33          2HZ       LYS  33  23.730  -1.133  -5.535
  301   3HZ   LYS  33          3HZ       LYS  33  22.429  -2.076  -6.061
  302    H    GLU  34           H        GLU  34  26.982   1.415  -0.706
  303    HA   GLU  34           HA       GLU  34  26.915   4.322   0.020
  304   1HB   GLU  34          1HB       GLU  34  28.555   2.013   1.074
  305   2HB   GLU  34          2HB       GLU  34  29.081   3.682   1.273
  306   1HG   GLU  34          1HG       GLU  34  27.197   4.242   2.596
  307   2HG   GLU  34          2HG       GLU  34  26.313   2.804   2.101