*HEADER    VIRAL PROTEIN                           08-OCT-12   2LZQ              
*TITLE     STRUCTURE OF NS2(32-57) GBVB PROTEIN                                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NS2 PEPTIDE;                                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HEPATITIS GB VIRUS B;                           
*SOURCE   4 ORGANISM_COMMON: GBV-B;                                              
*SOURCE   5 ORGANISM_TAXID: 39113                                                
*KEYWDS    NS2, GBVB, VIRAL PROTEIN                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    36                                                                    
*AUTHOR    R.MONTSERRET, F.PENIN, A.MARTIN                                       
*REVDAT   1   09-APR-14 2LZQ    0                                                


!============================================================================
!   > RESTRAINTS FROM ns2_noe_list.txt
!   > SEQUENCE
!  RSALVNSYLWQRWENWFWNVTLRPE
!
!   > DISTANCE RESTRAINTS
!   class |  [lower limit, upper limits[  | distance restraint
! --------+-------------------------------+---------------------
!    weak |            0 ,        1       |   5.0
!  medium |            1 ,        3       |   3.9
!  strong |            3 ,        8       |   2.8
!
!   > CORRECTION FACTOR FOR PSEUDO-ATOMS
! -CH2       = +1.0 A (ex.: HB#  in F)
! -Haromatic = +2.0 A (ex.: HD*  in Y)
! -CH3#      = +1.0 A (ex.: HG2# in I)
! -CH3*      = +2.4 A (ex.: HD*  in L)
!============================================================================
! <========== R1 ==========>
assign (resid 1     and name HA   )(resid 2     and name HN   )  2.8  1.0  0.3
assign (resid 1     and name HB#  )(resid 2     and name HN   )  5.0  3.2  1.5
assign (resid 1     and name HG#  )(resid 2     and name HN   )  5.0  3.2  1.5
! <========== S2 ==========>
assign (resid 2     and name HA   )(resid 3     and name HN   )  2.8  1.0  0.3
assign (resid 2     and name HB1  )(resid 3     and name HN   )  5.0  3.2  0.5
assign (resid 2     and name HB2  )(resid 3     and name HN   )  3.9  2.1  0.4
! <========== A3 ==========>
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  1.4
assign (resid 2     and name HB1  )(resid 4     and name HN   )  5.0  3.2  0.5
assign (resid 2     and name HB2  )(resid 4     and name HN   )  5.0  3.2  0.5
! <========== L4 ==========>
assign (resid 4     and name HN   )(resid 5     and name HN   )  2.8  1.0  0.3
assign (resid 4     and name HA   )(resid 5     and name HN   )  2.8  1.0  0.3
assign (resid 4     and name HB#  )(resid 5     and name HN   )  5.0  3.2  1.5
assign (resid 2     and name HB1  )(resid 5     and name HN   )  2.8  1.0  0.3
! <========== V5 ==========>
assign (resid 5     and name HN   )(resid 6     and name HN   )  2.8  1.0  0.3
assign (resid 5     and name HA   )(resid 6     and name HN   )  3.9  2.1  0.4
assign (resid 5     and name HB   )(resid 6     and name HN   )  2.8  1.0  0.3
assign (resid 5     and name HG2# )(resid 6     and name HN   )  5.0  3.2  1.5
assign (resid 5     and name HG1# )(resid 6     and name HN   )  5.0  3.2  1.5
assign (resid 4     and name HA   )(resid 6     and name HN   )  5.0  3.2  0.5
assign (resid 3     and name HA   )(resid 6     and name HB#  )  3.9  2.1  1.4
! <========== N6 ==========>
assign (resid 6     and name HN   )(resid 7     and name HN   )  2.8  1.0  0.3
assign (resid 6     and name HA   )(resid 7     and name HN   )  5.0  3.2  0.5
assign (resid 6     and name HB#  )(resid 7     and name HN   )  2.8  1.0  1.3
assign (resid 5     and name HA   )(resid 7     and name HN   )  5.0  3.2  0.5
assign (resid 4     and name HA   )(resid 7     and name HN   )  5.0  3.2  0.5
assign (resid 4     and name HA   )(resid 7     and name HB1  )  3.9  2.1  0.4
assign (resid 4     and name HA   )(resid 7     and name HB2  )  3.9  2.1  0.4
assign (resid 3     and name HA   )(resid 7     and name HN   )  5.0  3.2  0.5
! <========== S7 ==========>
assign (resid 7     and name HB1  )(resid 8     and name HN   )  5.0  3.2  0.5
assign (resid 7     and name HB2  )(resid 8     and name HN   )  3.9  2.1  0.4
assign (resid 6     and name HN   )(resid 8     and name HN   )  5.0  3.2  0.5
assign (resid 5     and name HA   )(resid 8     and name HN   )  5.0  3.2  0.5
assign (resid 5     and name HA   )(resid 8     and name HB#  )  3.9  2.1  1.4
! <========== Y8 ==========>
assign (resid 8     and name HN   )(resid 9     and name HN   )  2.8  1.0  0.3
assign (resid 8     and name HA   )(resid 9     and name HN   )  3.9  2.1  0.4
assign (resid 8     and name HB#  )(resid 9     and name HN   )  2.8  1.0  1.3
assign (resid 6     and name HA   )(resid 9     and name HB1  )  2.8  1.0  0.3
assign (resid 6     and name HA   )(resid 9     and name HB2  )  5.0  3.2  0.5
!
assign (resid 8     and name HD*  )(resid 9     and name HN   )  3.9  2.1  2.4
assign (resid 8     and name HD*  )(resid 9     and name HA   )  5.0  3.2  2.5
assign (resid 8     and name HD*  )(resid 9     and name HG   )  3.9  2.1  2.4
assign (resid 8     and name HD*  )(resid 9     and name HD2# )  2.8  1.0  3.3
assign (resid 8     and name HD*  )(resid 9     and name HD1# )  5.0  3.2  3.5
assign (resid 8     and name HE*  )(resid 9     and name HA   )  5.0  3.2  2.5
assign (resid 8     and name HE*  )(resid 9     and name HD2# )  3.9  2.1  3.4
! <========== L9 ==========>
assign (resid 9     and name HA   )(resid 10    and name HN   )  3.9  2.1  0.4
assign (resid 9     and name HB1  )(resid 10    and name HN   )  3.9  2.1  0.4
assign (resid 9     and name HB2  )(resid 10    and name HN   )  2.8  1.0  0.3
assign (resid 7     and name HA   )(resid 10    and name HN   )  3.9  2.1  0.4
assign (resid 7     and name HA   )(resid 10    and name HB#  )  2.8  1.0  1.3
!
assign (resid 8     and name HD*  )(resid 10    and name HN   )  5.0  3.2  2.5
! <========== W10 ==========>
assign (resid 10    and name HA   )(resid 11    and name HN   )  5.0  3.2  0.5
assign (resid 10    and name HB#  )(resid 11    and name HN   )  2.8  1.0  1.3
assign (resid 9     and name HA   )(resid 11    and name HN   )  5.0  3.2  0.5
assign (resid 8     and name HA   )(resid 11    and name HN   )  3.9  2.1  0.4
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  )  3.9  2.1  0.4
!
assign (resid 10    and name HD1  )(resid 11    and name HA   )  5.0  3.2  0.5
assign (resid 10    and name HE3  )(resid 11    and name HA   )  5.0  3.2  0.5
! <========== Q11 ==========>
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   )  3.9  2.1  0.4
assign (resid 11    and name HB1  )(resid 12    and name HN   )  3.9  2.1  0.4
assign (resid 11    and name HB2  )(resid 12    and name HN   )  5.0  3.2  0.5
assign (resid 9     and name HA   )(resid 12    and name HB#  )  3.9  2.1  1.4
assign (resid 8     and name HA   )(resid 12    and name HN   )  5.0  3.2  0.5
!
assign (resid 8     and name HE*  )(resid 12    and name HB#  )  5.0  3.2  3.5
assign (resid 8     and name HE*  )(resid 12    and name HD1  )  5.0  3.2  2.5
assign (resid 8     and name HE*  )(resid 12    and name HD2  )  5.0  3.2  2.5
assign (resid 8     and name HE*  )(resid 12    and name HG1  )  5.0  3.2  2.5
! <========== R12 ==========>
assign (resid 12    and name HN   )(resid 13    and name HN   )  2.8  1.0  0.3
assign (resid 12    and name HA   )(resid 13    and name HN   )  3.9  2.1  0.4
assign (resid 12    and name HB#  )(resid 13    and name HN   )  2.8  1.0  1.3
assign (resid 11    and name HN   )(resid 13    and name HN   )  5.0  3.2  0.5
assign (resid 10    and name HA   )(resid 13    and name HB1  )  5.0  3.2  0.5
assign (resid 10    and name HA   )(resid 13    and name HB2  )  3.9  2.1  0.4
!
assign (resid 12    and name HB#  )(resid 13    and name HD1  )  5.0  3.2  1.5
! <========== W13 ==========>
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 HB1  )(resid 14    and name HN   )  2.8  1.0  0.3
assign (resid 13    and name HB2  )(resid 14    and name HN   )  3.9  2.1  0.4
assign (resid 12    and name HN   )(resid 14    and name HN   )  5.0  3.2  0.5
assign (resid 11    and name HA   )(resid 14    and name HN   )  5.0  3.2  0.5
assign (resid 11    and name HA   )(resid 14    and name HB#  )  2.8  1.0  1.3
!
assign (resid 13    and name HD1  )(resid 14    and name HG#  )  3.9  2.1  1.4
assign (resid 13    and name HE3  )(resid 14    and name HB#  )  5.0  3.2  1.5
assign (resid 13    and name HE3  )(resid 14    and name HG#  )  3.9  2.1  1.4
assign (resid 10    and name HE1  )(resid 14    and name HG#  )  3.9  2.1  1.4
! <========== E14 ==========>
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 HB#  )(resid 15    and name HN   )  2.8  1.0  1.3
assign (resid 14    and name HG#  )(resid 15    and name HN   )  5.0  3.2  0.5
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 12    and name HA   )(resid 15    and name HN   )  3.9  2.1  0.4
assign (resid 12    and name HA   )(resid 15    and name HB1  )  3.9  2.1  0.4
assign (resid 12    and name HA   )(resid 15    and name HB2  )  5.0  3.2  0.5
assign (resid 11    and name HA   )(resid 15    and name HN   )  5.0  3.2  0.5
! <========== N15 ==========>
assign (resid 15    and name HA   )(resid 16    and name HN   )  3.9  2.1  0.4
assign (resid 15    and name HB1  )(resid 16    and name HN   )  3.9  2.1  0.4
assign (resid 15    and name HB2  )(resid 16    and name HN   )  3.9  2.1  0.4
assign (resid 14    and name HA   )(resid 16    and name HN   )  5.0  3.2  0.5
assign (resid 13    and name HA   )(resid 16    and name HN   )  3.9  2.1  0.4
assign (resid 13    and name HA   )(resid 16    and name HB1  )  3.9  2.1  0.4
assign (resid 12    and name HA   )(resid 16    and name HN   )  5.0  3.2  0.5
!
assign (resid 14    and name HG#  )(resid 16    and name HE3  )  5.0  3.2  1.5
assign (resid 13    and name HA   )(resid 16    and name HE3  )  3.9  2.1  0.4
! <========== W16 ==========>
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 HB1  )(resid 17    and name HN   )  3.9  2.1  0.4
assign (resid 16    and name HB2  )(resid 17    and name HN   )  3.9  2.1  0.4
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 HB1  )  3.9  2.1  0.4
assign (resid 14    and name HA   )(resid 17    and name HB2  )  3.9  2.1  0.4
assign (resid 13    and name HA   )(resid 17    and name HN   )  5.0  3.2  0.5
!
assign (resid 16    and name HD1  )(resid 17    and name HN   )  5.0  3.2  0.5
assign (resid 16    and name HE3  )(resid 17    and name HN   )  2.8  1.0  0.3
assign (resid 16    and name HE3  )(resid 17    and name HB1  )  5.0  3.2  0.5
assign (resid 16    and name HE3  )(resid 17    and name HB2  )  3.9  2.1  0.4
assign (resid 14    and name HA   )(resid 17    and name HD*  )  5.0  3.2  2.5
assign (resid 13    and name HE3  )(resid 17    and name HN   )  3.9  2.1  0.4
! <========== F17 ==========>
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 HB1  )(resid 18    and name HN   )  5.0  3.2  0.5
assign (resid 17    and name HB2  )(resid 18    and name HN   )  3.9  2.1  0.4
assign (resid 16    and name HN   )(resid 18    and name HN   )  5.0  3.2  0.5
assign (resid 15    and name HA   )(resid 18    and name HB#  )  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 17    and name HD*  )(resid 18    and name HN   )  3.9  2.1  2.4
assign (resid 17    and name HD*  )(resid 18    and name HA   )  5.0  3.2  2.5
assign (resid 14    and name HB#  )(resid 18    and name HD1  )  2.8  1.0  1.3
assign (resid 14    and name HG#  )(resid 18    and name HD1  )  3.9  2.1  1.4
! <========== W18 ==========>
assign (resid 18    and name HN   )(resid 19    and name HN   )  2.8  1.0  0.3
assign (resid 18    and name HA   )(resid 19    and name HN   )  5.0  3.2  0.5
assign (resid 18    and name HB#  )(resid 19    and name HN   )  3.9  2.1  1.4
assign (resid 16    and name HA   )(resid 19    and name HB1  )  5.0  3.2  0.5
assign (resid 16    and name HA   )(resid 19    and name HB2  )  5.0  3.2  0.5
!
assign (resid 15    and name HD21 )(resid 19    and name HN   )  3.9  2.1  0.4
! <========== N19 ==========>
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   )  3.9  2.1  0.4
assign (resid 19    and name HB1  )(resid 20    and name HN   )  3.9  2.1  0.4
assign (resid 19    and name HB2  )(resid 20    and name HN   )  3.9  2.1  0.4
assign (resid 17    and name HA   )(resid 20    and name HN   )  5.0  3.2  0.5
assign (resid 17    and name HA   )(resid 20    and name HB   )  5.0  3.2  0.5
assign (resid 17    and name HA   )(resid 20    and name HG1# )  5.0  3.2  1.5
assign (resid 17    and name HA   )(resid 20    and name HG2# )  5.0  3.2  1.5
!
assign (resid 16    and name HD1  )(resid 20    and name HG1# )  3.9  2.1  1.4
assign (resid 16    and name HD1  )(resid 20    and name HG2# )  3.9  2.1  1.4
assign (resid 16    and name HE1  )(resid 20    and name HG1# )  2.8  1.0  1.3
assign (resid 16    and name HE1  )(resid 20    and name HG2# )  3.9  2.1  1.4
assign (resid 16    and name HH2  )(resid 20    and name HG2# )  5.0  3.2  1.5
assign (resid 16    and name HZ2  )(resid 20    and name HG1# )  3.9  2.1  1.4
assign (resid 16    and name HZ2  )(resid 20    and name HG2# )  3.9  2.1  1.4
! <========== V20 ==========>
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   )  3.9  2.1  0.4
assign (resid 20    and name HB   )(resid 21    and name HN   )  3.9  2.1  0.4
assign (resid 20    and name HG2# )(resid 21    and name HN   )  5.0  3.2  1.5
assign (resid 20    and name HG1# )(resid 21    and name HN   )  5.0  3.2  1.5
assign (resid 19    and name HN   )(resid 21    and name HN   )  5.0  3.2  0.5
assign (resid 18    and name HA   )(resid 21    and name HN   )  5.0  3.2  0.5
assign (resid 18    and name HA   )(resid 21    and name HB   )  5.0  3.2  0.5
assign (resid 17    and name HA   )(resid 21    and name HN   )  5.0  3.2  0.5
!
assign (resid 18    and name HE3  )(resid 21    and name HG2# )  5.0  3.2  1.5
assign (resid 18    and name HZ3  )(resid 21    and name HG2# )  3.9  2.1  1.4
assign (resid 17    and name HD*  )(resid 21    and name HG2# )  5.0  3.2  3.5
! <========== T21 ==========>
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   )  2.8  1.0  0.3
assign (resid 21    and name HB   )(resid 22    and name HN   )  2.8  1.0  0.3
assign (resid 21    and name HG2# )(resid 22    and name HN   )  5.0  3.2  1.5
assign (resid 20    and name HN   )(resid 22    and name HN   )  5.0  3.2  0.5
assign (resid 18    and name HA   )(resid 22    and name HN   )  5.0  3.2  0.5
!
assign (resid 18    and name HD1  )(resid 22    and name HD*  )  3.9  2.1  2.8
assign (resid 18    and name HE3  )(resid 22    and name HG   )  2.8  1.0  0.3
assign (resid 18    and name HE3  )(resid 22    and name HD*  )  2.8  1.0  2.3
assign (resid 18    and name HZ3  )(resid 22    and name HD*  )  3.9  2.1  2.8
assign (resid 17    and name HE*  )(resid 22    and name HD*  )  5.0  3.2  4.9
! <========== L22 ==========>
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   )  2.8  1.0  0.3
assign (resid 22    and name HB1  )(resid 23    and name HN   )  3.9  2.1  0.4
assign (resid 22    and name HB2  )(resid 23    and name HN   )  2.8  1.0  0.3
assign (resid 20    and name HA   )(resid 23    and name HN   )  5.0  3.2  0.5
!
assign (resid 22    and name HD*  )(resid 23    and name HN   )  5.0  3.2  2.9
! <========== R23 ==========>
assign (resid 23    and name HN   )(resid 24    and name HD1  )  3.9  2.1  0.4
assign (resid 23    and name HN   )(resid 24    and name HD2  )  3.9  2.1  0.4
assign (resid 23    and name HA   )(resid 24    and name HD1  )  3.9  2.1  0.4
assign (resid 23    and name HA   )(resid 24    and name HD2  )  3.9  2.1  0.4
! <========== P24 ==========>
assign (resid 24    and name HA   )(resid 25    and name HN   )  2.8  1.0  0.3
assign (resid 24    and name HB1  )(resid 25    and name HN   )  5.0  3.2  0.5
assign (resid 24    and name HB2  )(resid 25    and name HN   )  5.0  3.2  0.5
assign (resid 24    and name HD1  )(resid 25    and name HN   )  5.0  3.2  0.5
assign (resid 24    and name HD2  )(resid 25    and name HN   )  5.0  3.2  0.5
! <========== E25 ==========>
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   ARG   1           HA       ARG   1 -16.324   0.164  -5.340
    2    HB2  ARG   1           HB2      ARG   1 -17.644  -1.123  -7.126
    3    HB3  ARG   1           HB3      ARG   1 -18.772  -1.553  -5.841
    4    HG2  ARG   1           HG2      ARG   1 -19.213   0.805  -5.384
    5    HG3  ARG   1           HG3      ARG   1 -18.008   1.289  -6.579
    6    HD2  ARG   1           HD2      ARG   1 -19.326   0.299  -8.382
    7    HD3  ARG   1           HD3      ARG   1 -20.503  -0.333  -7.214
    8    HE   ARG   1           HE       ARG   1 -20.000   2.594  -7.637
    9   HH11  ARG   1          HH11      ARG   1 -21.349   2.007  -5.085
   10   HH12  ARG   1          HH12      ARG   1 -23.027   2.028  -5.511
   11   HH21  ARG   1          HH21      ARG   1 -22.431   1.713  -8.922
   12   HH22  ARG   1          HH22      ARG   1 -23.643   1.861  -7.694
   13    H    SER   2           H        SER   2 -15.689  -0.246  -2.948
   14    HA   SER   2           HA       SER   2 -18.097   0.080  -1.277
   15    HB2  SER   2           HB2      SER   2 -17.095  -2.463  -1.699
   16    HB3  SER   2           HB3      SER   2 -16.298  -1.989  -0.201
   17    HG   SER   2           HG       SER   2 -19.010  -2.354  -0.773
   18    H    ALA   3           H        ALA   3 -17.538   0.890   0.869
   19    HA   ALA   3           HA       ALA   3 -15.281   2.657   0.957
   20    HB1  ALA   3           HB1      ALA   3 -16.027   2.940   3.319
   21    HB2  ALA   3           HB2      ALA   3 -17.074   1.534   3.131
   22    HB3  ALA   3           HB3      ALA   3 -17.377   2.990   2.185
   23    H    LEU   4           H        LEU   4 -15.724  -0.662   2.117
   24    HA   LEU   4           HA       LEU   4 -13.045  -0.606   3.428
   25    HB2  LEU   4           HB2      LEU   4 -13.819  -2.692   4.456
   26    HB3  LEU   4           HB3      LEU   4 -15.060  -1.454   4.629
   27    HG   LEU   4           HG       LEU   4 -15.566  -2.720   2.148
   28   HD11  LEU   4          HD11      LEU   4 -15.725  -5.063   2.696
   29   HD12  LEU   4          HD12      LEU   4 -15.235  -4.759   4.363
   30   HD13  LEU   4          HD13      LEU   4 -14.075  -4.549   3.052
   31   HD21  LEU   4          HD21      LEU   4 -17.143  -1.743   3.899
   32   HD22  LEU   4          HD22      LEU   4 -16.957  -3.257   4.784
   33   HD23  LEU   4          HD23      LEU   4 -17.666  -3.260   3.170
   34    H    VAL   5           H        VAL   5 -14.036  -1.082   0.350
   35    HA   VAL   5           HA       VAL   5 -12.366  -3.517  -0.120
   36    HB   VAL   5           HB       VAL   5 -14.517  -2.060  -1.681
   37   HG11  VAL   5          HG11      VAL   5 -14.158  -4.078  -3.295
   38   HG12  VAL   5          HG12      VAL   5 -12.549  -4.159  -2.580
   39   HG13  VAL   5          HG13      VAL   5 -13.066  -2.698  -3.421
   40   HG21  VAL   5          HG21      VAL   5 -15.701  -4.189  -1.459
   41   HG22  VAL   5          HG22      VAL   5 -15.184  -3.645   0.137
   42   HG23  VAL   5          HG23      VAL   5 -14.292  -4.922  -0.692
   43    H    ASN   6           H        ASN   6 -12.995  -0.352  -1.728
   44    HA   ASN   6           HA       ASN   6 -10.601  -0.358  -3.304
   45    HB2  ASN   6           HB2      ASN   6 -12.834   1.081  -3.303
   46    HB3  ASN   6           HB3      ASN   6 -11.878   2.173  -2.301
   47   HD21  ASN   6          HD21      ASN   6 -12.349   3.507  -4.475
   48   HD22  ASN   6          HD22      ASN   6 -11.141   3.392  -5.661
   49    H    SER   7           H        SER   7 -11.288   1.021  -0.065
   50    HA   SER   7           HA       SER   7  -8.801   2.371   0.333
   51    HB2  SER   7           HB2      SER   7 -11.018   2.327   1.701
   52    HB3  SER   7           HB3      SER   7 -10.335   0.907   2.488
   53    HG   SER   7           HG       SER   7  -9.469   2.424   3.703
   54    H    TYR   8           H        TYR   8  -9.784  -0.985   1.117
   55    HA   TYR   8           HA       TYR   8  -7.252  -1.813   2.213
   56    HB2  TYR   8           HB2      TYR   8  -9.088  -3.183   2.727
   57    HB3  TYR   8           HB3      TYR   8  -9.727  -3.107   1.087
   58    HD1  TYR   8           HD1      TYR   8  -6.685  -4.319   2.933
   59    HD2  TYR   8           HD2      TYR   8  -9.432  -4.950  -0.309
   60    HE1  TYR   8           HE2      TYR   8  -5.545  -6.450   2.380
   61    HE2  TYR   8           HE1      TYR   8  -8.292  -7.080  -0.861
   62    HH   TYR   8           HH       TYR   8  -6.499  -8.751   1.045
   63    H    LEU   9           H        LEU   9  -8.656  -1.960  -1.067
   64    HA   LEU   9           HA       LEU   9  -6.527  -3.381  -2.349
   65    HB2  LEU   9           HB2      LEU   9  -8.930  -1.863  -3.010
   66    HB3  LEU   9           HB3      LEU   9  -7.658  -1.579  -4.194
   67    HG   LEU   9           HG       LEU   9  -9.051  -3.515  -4.833
   68   HD11  LEU   9          HD11      LEU   9  -7.272  -4.961  -5.398
   69   HD12  LEU   9          HD12      LEU   9  -6.387  -4.593  -3.918
   70   HD13  LEU   9          HD13      LEU   9  -6.492  -3.391  -5.203
   71   HD21  LEU   9          HD21      LEU   9  -9.302  -5.428  -3.466
   72   HD22  LEU   9          HD22      LEU   9  -9.501  -4.083  -2.344
   73   HD23  LEU   9          HD23      LEU   9  -7.970  -4.956  -2.411
   74    H    TRP  10           H        TRP  10  -7.121   0.132  -1.973
   75    HA   TRP  10           HA       TRP  10  -4.719   0.993  -3.321
   76    HB2  TRP  10           HB2      TRP  10  -6.390   2.621  -3.116
   77    HB3  TRP  10           HB3      TRP  10  -6.781   2.153  -1.462
   78    HD1  TRP  10           HD1      TRP  10  -4.032   3.979  -3.456
   79    HE1  TRP  10           HE1      TRP  10  -2.840   5.628  -1.870
   80    HE3  TRP  10           HE3      TRP  10  -6.341   2.797   0.941
   81    HZ2  TRP  10           HZ2      TRP  10  -2.867   6.348   0.899
   82    HZ3  TRP  10           HZ3      TRP  10  -5.740   3.977   3.034
   83    HH2  TRP  10           HH2      TRP  10  -4.009   5.750   3.019
   84    H    GLN  11           H        GLN  11  -5.519   0.530   0.149
   85    HA   GLN  11           HA       GLN  11  -3.072   1.346   1.305
   86    HB2  GLN  11           HB2      GLN  11  -5.264   0.677   2.406
   87    HB3  GLN  11           HB3      GLN  11  -4.795  -1.005   2.156
   88    HG2  GLN  11           HG2      GLN  11  -2.757  -0.652   3.489
   89    HG3  GLN  11           HG3      GLN  11  -3.186   1.045   3.713
   90   HE21  GLN  11          HE21      GLN  11  -4.186   1.421   5.696
   91   HE22  GLN  11          HE22      GLN  11  -5.160   0.305   6.526
   92    H    ARG  12           H        ARG  12  -3.966  -1.800  -0.119
   93    HA   ARG  12           HA       ARG  12  -1.557  -3.211   0.589
   94    HB2  ARG  12           HB2      ARG  12  -3.869  -4.034  -0.239
   95    HB3  ARG  12           HB3      ARG  12  -3.268  -3.682  -1.859
   96    HG2  ARG  12           HG2      ARG  12  -1.345  -5.194  -0.244
   97    HG3  ARG  12           HG3      ARG  12  -2.868  -6.053  -0.471
   98    HD2  ARG  12           HD2      ARG  12  -1.292  -4.797  -2.749
   99    HD3  ARG  12           HD3      ARG  12  -1.201  -6.513  -2.304
  100    HE   ARG  12           HE       ARG  12  -3.416  -5.256  -3.696
  101   HH11  ARG  12          HH11      ARG  12  -2.590  -8.181  -3.815
  102   HH12  ARG  12          HH12      ARG  12  -3.941  -8.948  -3.047
  103   HH21  ARG  12          HH21      ARG  12  -5.153  -6.001  -1.652
  104   HH22  ARG  12          HH22      ARG  12  -5.400  -7.708  -1.816
  105    H    TRP  13           H        TRP  13  -2.472  -1.269  -2.270
  106    HA   TRP  13           HA       TRP  13  -0.185  -1.860  -3.881
  107    HB2  TRP  13           HB2      TRP  13  -1.456  -0.599  -5.266
  108    HB3  TRP  13           HB3      TRP  13  -2.516  -0.218  -3.916
  109    HD1  TRP  13           HD1      TRP  13  -2.697   2.237  -3.336
  110    HE1  TRP  13           HE1      TRP  13  -1.310   4.359  -3.799
  111    HE3  TRP  13           HE3      TRP  13   1.324   0.164  -5.706
  112    HZ2  TRP  13           HZ2      TRP  13   1.178   5.082  -5.014
  113    HZ3  TRP  13           HZ3      TRP  13   3.184   1.591  -6.507
  114    HH2  TRP  13           HH2      TRP  13   3.117   4.045  -6.163
  115    H    GLU  14           H        GLU  14  -0.742   0.750  -1.488
  116    HA   GLU  14           HA       GLU  14   1.908   1.904  -1.813
  117    HB2  GLU  14           HB2      GLU  14  -0.435   2.154   0.045
  118    HB3  GLU  14           HB3      GLU  14   1.104   2.865   0.535
  119    HG2  GLU  14           HG2      GLU  14   1.037   3.776  -1.985
  120    HG3  GLU  14           HG3      GLU  14  -0.699   3.615  -1.720
  121    H    ASN  15           H        ASN  15   0.432  -0.421   0.458
  122    HA   ASN  15           HA       ASN  15   2.526  -0.703   2.335
  123    HB2  ASN  15           HB2      ASN  15   0.181  -1.749   2.243
  124    HB3  ASN  15           HB3      ASN  15   0.881  -2.976   1.186
  125   HD21  ASN  15          HD21      ASN  15   2.902  -4.125   2.153
  126   HD22  ASN  15          HD22      ASN  15   2.897  -4.407   3.826
  127    H    TRP  16           H        TRP  16   2.077  -2.423  -0.786
  128    HA   TRP  16           HA       TRP  16   4.526  -3.947  -0.621
  129    HB2  TRP  16           HB2      TRP  16   2.935  -4.766  -2.140
  130    HB3  TRP  16           HB3      TRP  16   2.528  -3.157  -2.732
  131    HD1  TRP  16           HD1      TRP  16   5.378  -5.748  -2.923
  132    HE1  TRP  16           HE1      TRP  16   6.668  -5.374  -5.122
  133    HE3  TRP  16           HE3      TRP  16   3.013  -1.555  -4.629
  134    HZ2  TRP  16           HZ2      TRP  16   6.696  -3.539  -7.313
  135    HZ3  TRP  16           HZ3      TRP  16   3.694  -0.516  -6.774
  136    HH2  TRP  16           HH2      TRP  16   5.530  -1.501  -8.116
  137    H    PHE  17           H        PHE  17   3.664  -0.870  -2.229
  138    HA   PHE  17           HA       PHE  17   6.144  -0.279  -3.463
  139    HB2  PHE  17           HB2      PHE  17   4.204   1.019  -3.960
  140    HB3  PHE  17           HB3      PHE  17   3.904   1.363  -2.258
  141    HD1  PHE  17           HD1      PHE  17   6.607   1.826  -4.830
  142    HD2  PHE  17           HD2      PHE  17   4.529   3.444  -1.435
  143    HE1  PHE  17           HE2      PHE  17   7.938   3.910  -5.007
  144    HE2  PHE  17           HE1      PHE  17   5.859   5.528  -1.616
  145    HZ   PHE  17           HZ       PHE  17   7.564   5.761  -3.400
  146    H    TRP  18           H        TRP  18   4.985   0.609  -0.183
  147    HA   TRP  18           HA       TRP  18   7.421   1.896   0.662
  148    HB2  TRP  18           HB2      TRP  18   5.112   0.573   2.118
  149    HB3  TRP  18           HB3      TRP  18   6.384   1.466   2.948
  150    HD1  TRP  18           HD1      TRP  18   3.065   2.056   2.028
  151    HE1  TRP  18           HE1      TRP  18   2.578   4.510   1.405
  152    HE3  TRP  18           HE3      TRP  18   7.829   3.736   1.273
  153    HZ2  TRP  18           HZ2      TRP  18   4.017   6.870   0.690
  154    HZ3  TRP  18           HZ3      TRP  18   8.240   6.092   0.624
  155    HH2  TRP  18           HH2      TRP  18   6.342   7.660   0.332
  156    H    ASN  19           H        ASN  19   6.220  -1.460   0.952
  157    HA   ASN  19           HA       ASN  19   8.163  -2.557   2.668
  158    HB2  ASN  19           HB2      ASN  19   6.182  -3.428   0.765
  159    HB3  ASN  19           HB3      ASN  19   7.625  -4.425   0.589
  160   HD21  ASN  19          HD21      ASN  19   8.558  -5.200   2.842
  161   HD22  ASN  19          HD22      ASN  19   7.407  -5.684   3.991
  162    H    VAL  20           H        VAL  20   8.385  -2.118  -0.891
  163    HA   VAL  20           HA       VAL  20  11.164  -3.125  -0.898
  164    HB   VAL  20           HB       VAL  20  10.956  -2.689  -3.357
  165   HG11  VAL  20          HG11      VAL  20   9.320  -4.433  -3.770
  166   HG12  VAL  20          HG12      VAL  20   8.569  -4.155  -2.198
  167   HG13  VAL  20          HG13      VAL  20  10.198  -4.825  -2.291
  168   HG21  VAL  20          HG21      VAL  20   8.080  -1.943  -2.780
  169   HG22  VAL  20          HG22      VAL  20   8.943  -1.839  -4.311
  170   HG23  VAL  20          HG23      VAL  20   9.336  -0.726  -3.002
  171    H    THR  21           H        THR  21   9.519  -0.002  -0.913
  172    HA   THR  21           HA       THR  21  11.849   1.524  -1.785
  173    HB   THR  21           HB       THR  21   9.249   2.279  -0.412
  174    HG1  THR  21           HG1      THR  21   8.675   1.657  -2.366
  175   HG21  THR  21          HG21      THR  21  11.499   3.927  -1.555
  176   HG22  THR  21          HG22      THR  21  10.665   4.118  -0.012
  177   HG23  THR  21          HG23      THR  21   9.850   4.552  -1.514
  178    H    LEU  22           H        LEU  22  10.426   0.624   1.332
  179    HA   LEU  22           HA       LEU  22  12.254   2.286   2.898
  180    HB2  LEU  22           HB2      LEU  22  10.331   0.038   3.575
  181    HB3  LEU  22           HB3      LEU  22  11.191   0.989   4.785
  182    HG   LEU  22           HG       LEU  22   9.373   2.193   2.677
  183   HD11  LEU  22          HD11      LEU  22   8.851   1.402   5.554
  184   HD12  LEU  22          HD12      LEU  22   7.985   0.859   4.118
  185   HD13  LEU  22          HD13      LEU  22   7.828   2.528   4.664
  186   HD21  LEU  22          HD21      LEU  22   9.455   4.077   4.475
  187   HD22  LEU  22          HD22      LEU  22  10.850   3.876   3.415
  188   HD23  LEU  22          HD23      LEU  22  10.894   3.244   5.061
  189    H    ARG  23           H        ARG  23  11.792  -1.256   2.844
  190    HA   ARG  23           HA       ARG  23  13.324  -3.018   3.203
  191    HB2  ARG  23           HB2      ARG  23  14.816  -0.969   1.553
  192    HB3  ARG  23           HB3      ARG  23  15.531  -2.532   1.945
  193    HG2  ARG  23           HG2      ARG  23  12.753  -2.591   0.885
  194    HG3  ARG  23           HG3      ARG  23  14.015  -2.125  -0.256
  195    HD2  ARG  23           HD2      ARG  23  15.268  -4.182   0.240
  196    HD3  ARG  23           HD3      ARG  23  14.046  -4.649   1.440
  197    HE   ARG  23           HE       ARG  23  13.485  -4.356  -1.490
  198   HH11  ARG  23          HH11      ARG  23  11.415  -4.285   0.929
  199   HH12  ARG  23          HH12      ARG  23  10.730  -5.866   0.737
  200   HH21  ARG  23          HH21      ARG  23  13.220  -6.970  -1.426
  201   HH22  ARG  23          HH22      ARG  23  11.759  -7.394  -0.597
  202    HA   PRO  24           HA       PRO  24  15.350  -0.882   6.764
  203    HB2  PRO  24           HB2      PRO  24  14.299  -2.491   8.710
  204    HB3  PRO  24           HB3      PRO  24  13.463  -1.057   8.086
  205    HG2  PRO  24           HG2      PRO  24  12.988  -3.923   7.506
  206    HG3  PRO  24           HG3      PRO  24  11.839  -2.581   7.598
  207    HD2  PRO  24           HD2      PRO  24  12.808  -3.693   5.254
  208    HD3  PRO  24           HD3      PRO  24  12.075  -2.081   5.398
  209    H    GLU  25           H        GLU  25  17.158  -2.078   5.494
  210    HA   GLU  25           HA       GLU  25  17.865  -4.734   6.657
  211    HB2  GLU  25           HB2      GLU  25  18.617  -3.102   4.246
  212    HB3  GLU  25           HB3      GLU  25  19.714  -4.367   4.800
  213    HG2  GLU  25           HG2      GLU  25  17.787  -5.978   4.746
  214    HG3  GLU  25           HG3      GLU  25  16.803  -4.706   4.023
  215    H    ARG  26           H        ARG  26  20.231  -5.022   7.239
  216    HA   ARG  26           HA       ARG  26  22.122  -4.441   8.517
  217    HB2  ARG  26           HB2      ARG  26  21.707  -2.493   6.526
  218    HB3  ARG  26           HB3      ARG  26  22.050  -1.582   7.995
  219    HG2  ARG  26           HG2      ARG  26  23.787  -3.934   7.580
  220    HG3  ARG  26           HG3      ARG  26  23.972  -2.660   6.374
  221    HD2  ARG  26           HD2      ARG  26  24.293  -0.996   8.196
  222    HD3  ARG  26           HD3      ARG  26  24.175  -2.306   9.388
  223    HE   ARG  26           HE       ARG  26  26.249  -3.223   8.541
  224   HH11  ARG  26          HH11      ARG  26  25.977  -2.546   5.656
  225   HH12  ARG  26          HH12      ARG  26  27.141  -1.280   5.453
  226   HH21  ARG  26          HH21      ARG  26  27.414  -0.634   8.859
  227   HH22  ARG  26          HH22      ARG  26  27.959  -0.192   7.276
  Start of MODEL    2
    1    HA   ARG   1           HA       ARG   1 -17.771   2.666  -4.023
    2    HB2  ARG   1           HB2      ARG   1 -16.096   1.899  -5.852
    3    HB3  ARG   1           HB3      ARG   1 -15.487   0.781  -4.633
    4    HG2  ARG   1           HG2      ARG   1 -17.872  -0.028  -4.331
    5    HG3  ARG   1           HG3      ARG   1 -18.296   0.927  -5.753
    6    HD2  ARG   1           HD2      ARG   1 -17.053  -0.432  -7.202
    7    HD3  ARG   1           HD3      ARG   1 -16.002  -1.024  -5.900
    8    HE   ARG   1           HE       ARG   1 -18.892  -1.785  -6.146
    9   HH11  ARG   1          HH11      ARG   1 -16.540  -3.559  -7.062
   10   HH12  ARG   1          HH12      ARG   1 -16.416  -4.645  -5.719
   11   HH21  ARG   1          HH21      ARG   1 -18.353  -2.670  -3.612
   12   HH22  ARG   1          HH22      ARG   1 -17.447  -4.138  -3.755
   13    H    SER   2           H        SER   2 -18.560   2.030  -2.065
   14    HA   SER   2           HA       SER   2 -18.705   1.029   0.064
   15    HB2  SER   2           HB2      SER   2 -17.058  -0.606  -1.617
   16    HB3  SER   2           HB3      SER   2 -16.374  -0.629   0.005
   17    HG   SER   2           HG       SER   2 -18.913  -1.427  -0.899
   18    H    ALA   3           H        ALA   3 -17.119   0.513   2.080
   19    HA   ALA   3           HA       ALA   3 -15.323   2.905   2.344
   20    HB1  ALA   3           HB1      ALA   3 -16.813   1.288   4.439
   21    HB2  ALA   3           HB2      ALA   3 -17.390   2.800   3.737
   22    HB3  ALA   3           HB3      ALA   3 -15.926   2.786   4.722
   23    H    LEU   4           H        LEU   4 -15.679  -0.459   3.578
   24    HA   LEU   4           HA       LEU   4 -12.782  -0.553   4.205
   25    HB2  LEU   4           HB2      LEU   4 -15.199  -1.683   5.187
   26    HB3  LEU   4           HB3      LEU   4 -14.215  -3.025   4.603
   27    HG   LEU   4           HG       LEU   4 -12.278  -1.790   5.888
   28   HD11  LEU   4          HD11      LEU   4 -13.450   0.225   6.492
   29   HD12  LEU   4          HD12      LEU   4 -13.232  -0.706   7.974
   30   HD13  LEU   4          HD13      LEU   4 -14.798  -0.693   7.164
   31   HD21  LEU   4          HD21      LEU   4 -14.520  -3.385   7.155
   32   HD22  LEU   4          HD22      LEU   4 -13.020  -3.008   8.003
   33   HD23  LEU   4          HD23      LEU   4 -12.983  -3.990   6.539
   34    H    VAL   5           H        VAL   5 -13.626  -0.462   1.344
   35    HA   VAL   5           HA       VAL   5 -12.623  -3.151   0.460
   36    HB   VAL   5           HB       VAL   5 -14.532  -1.178  -0.848
   37   HG11  VAL   5          HG11      VAL   5 -13.658  -2.106  -2.749
   38   HG12  VAL   5          HG12      VAL   5 -14.725  -3.446  -2.326
   39   HG13  VAL   5          HG13      VAL   5 -13.016  -3.508  -1.894
   40   HG21  VAL   5          HG21      VAL   5 -16.089  -3.186  -0.630
   41   HG22  VAL   5          HG22      VAL   5 -15.651  -2.407   0.889
   42   HG23  VAL   5          HG23      VAL   5 -14.869  -3.914   0.414
   43    H    ASN   6           H        ASN   6 -12.801   0.285  -0.585
   44    HA   ASN   6           HA       ASN   6 -10.574   0.090  -2.417
   45    HB2  ASN   6           HB2      ASN   6 -12.459   2.069  -1.381
   46    HB3  ASN   6           HB3      ASN   6 -10.851   2.757  -1.619
   47   HD21  ASN   6          HD21      ASN   6 -13.509   1.072  -3.305
   48   HD22  ASN   6          HD22      ASN   6 -13.004   1.503  -4.869
   49    H    SER   7           H        SER   7 -10.856   0.981   1.016
   50    HA   SER   7           HA       SER   7  -8.295   2.113   1.463
   51    HB2  SER   7           HB2      SER   7 -10.382   1.772   2.987
   52    HB3  SER   7           HB3      SER   7  -9.674   0.201   3.357
   53    HG   SER   7           HG       SER   7  -9.117   2.345   4.583
   54    H    TYR   8           H        TYR   8  -9.317  -1.314   1.546
   55    HA   TYR   8           HA       TYR   8  -6.639  -2.333   2.075
   56    HB2  TYR   8           HB2      TYR   8  -8.045  -3.997   2.712
   57    HB3  TYR   8           HB3      TYR   8  -9.390  -3.256   1.853
   58    HD1  TYR   8           HD1      TYR   8  -6.402  -5.449   1.395
   59    HD2  TYR   8           HD2      TYR   8 -10.187  -4.167  -0.182
   60    HE1  TYR   8           HE1      TYR   8  -6.298  -7.241  -0.315
   61    HE2  TYR   8           HE2      TYR   8 -10.081  -5.957  -1.892
   62    HH   TYR   8           HH       TYR   8  -8.869  -8.300  -2.031
   63    H    LEU   9           H        LEU   9  -8.659  -1.857  -0.823
   64    HA   LEU   9           HA       LEU   9  -6.955  -3.222  -2.698
   65    HB2  LEU   9           HB2      LEU   9  -9.262  -1.379  -2.671
   66    HB3  LEU   9           HB3      LEU   9  -8.255  -1.240  -4.111
   67    HG   LEU   9           HG       LEU   9  -9.133  -3.940  -3.091
   68   HD11  LEU   9          HD11      LEU   9 -11.193  -2.683  -3.389
   69   HD12  LEU   9          HD12      LEU   9 -11.004  -3.783  -4.755
   70   HD13  LEU   9          HD13      LEU   9 -10.637  -2.069  -4.946
   71   HD21  LEU   9          HD21      LEU   9  -8.657  -4.634  -5.342
   72   HD22  LEU   9          HD22      LEU   9  -7.300  -3.632  -4.832
   73   HD23  LEU   9          HD23      LEU   9  -8.536  -2.965  -5.898
   74    H    TRP  10           H        TRP  10  -7.152   0.203  -1.682
   75    HA   TRP  10           HA       TRP  10  -5.037   1.142  -3.417
   76    HB2  TRP  10           HB2      TRP  10  -6.538   2.771  -2.616
   77    HB3  TRP  10           HB3      TRP  10  -6.514   2.124  -0.977
   78    HD1  TRP  10           HD1      TRP  10  -4.184   3.979  -3.437
   79    HE1  TRP  10           HE1      TRP  10  -2.537   5.412  -2.065
   80    HE3  TRP  10           HE3      TRP  10  -5.517   2.569   1.286
   81    HZ2  TRP  10           HZ2      TRP  10  -1.875   5.894   0.673
   82    HZ3  TRP  10           HZ3      TRP  10  -4.361   3.529   3.256
   83    HH2  TRP  10           HH2      TRP  10  -2.543   5.188   2.957
   84    H    GLN  11           H        GLN  11  -5.133   0.002  -0.030
   85    HA   GLN  11           HA       GLN  11  -2.464   0.612   0.731
   86    HB2  GLN  11           HB2      GLN  11  -4.569  -1.389   1.487
   87    HB3  GLN  11           HB3      GLN  11  -2.947  -1.601   2.146
   88    HG2  GLN  11           HG2      GLN  11  -4.075   1.148   2.274
   89    HG3  GLN  11           HG3      GLN  11  -4.809  -0.052   3.338
   90   HE21  GLN  11          HE21      GLN  11  -3.398  -1.092   4.964
   91   HE22  GLN  11          HE22      GLN  11  -1.919  -0.382   5.399
   92    H    ARG  12           H        ARG  12  -3.782  -2.289  -0.904
   93    HA   ARG  12           HA       ARG  12  -1.452  -3.888  -0.991
   94    HB2  ARG  12           HB2      ARG  12  -4.023  -4.024  -1.891
   95    HB3  ARG  12           HB3      ARG  12  -3.165  -3.795  -3.416
   96    HG2  ARG  12           HG2      ARG  12  -1.703  -5.705  -2.898
   97    HG3  ARG  12           HG3      ARG  12  -2.529  -5.928  -1.354
   98    HD2  ARG  12           HD2      ARG  12  -4.544  -5.829  -3.378
   99    HD3  ARG  12           HD3      ARG  12  -3.292  -6.964  -3.918
  100    HE   ARG  12           HE       ARG  12  -4.279  -7.154  -1.110
  101   HH11  ARG  12          HH11      ARG  12  -2.459  -9.228  -2.205
  102   HH12  ARG  12          HH12      ARG  12  -3.556 -10.479  -2.690
  103   HH21  ARG  12          HH21      ARG  12  -6.351  -8.408  -2.635
  104   HH22  ARG  12          HH22      ARG  12  -5.769 -10.013  -2.934
  105    H    TRP  13           H        TRP  13  -2.168  -0.946  -2.745
  106    HA   TRP  13           HA       TRP  13  -0.123  -1.398  -4.813
  107    HB2  TRP  13           HB2      TRP  13  -2.456   0.074  -4.534
  108    HB3  TRP  13           HB3      TRP  13  -1.206   1.305  -4.395
  109    HD1  TRP  13           HD1      TRP  13  -3.125   1.176  -6.869
  110    HE1  TRP  13           HE1      TRP  13  -2.161   0.834  -9.236
  111    HE3  TRP  13           HE3      TRP  13   1.390  -0.907  -5.697
  112    HZ2  TRP  13           HZ2      TRP  13   0.209  -0.182 -10.467
  113    HZ3  TRP  13           HZ3      TRP  13   2.977  -1.549  -7.484
  114    HH2  TRP  13           HH2      TRP  13   2.396  -1.189  -9.865
  115    H    GLU  14           H        GLU  14  -0.615   1.085  -2.269
  116    HA   GLU  14           HA       GLU  14   2.157   1.994  -2.465
  117    HB2  GLU  14           HB2      GLU  14  -0.217   2.640  -0.705
  118    HB3  GLU  14           HB3      GLU  14   1.332   3.474  -0.568
  119    HG2  GLU  14           HG2      GLU  14   0.992   3.689  -3.225
  120    HG3  GLU  14           HG3      GLU  14  -0.703   3.598  -2.746
  121    H    ASN  15           H        ASN  15   0.251   0.230   0.035
  122    HA   ASN  15           HA       ASN  15   2.202   0.109   2.069
  123    HB2  ASN  15           HB2      ASN  15  -0.248  -0.734   1.965
  124    HB3  ASN  15           HB3      ASN  15   0.436  -2.226   1.317
  125   HD21  ASN  15          HD21      ASN  15   2.260  -3.219   2.729
  126   HD22  ASN  15          HD22      ASN  15   2.097  -3.075   4.413
  127    H    TRP  16           H        TRP  16   1.881  -1.946  -0.841
  128    HA   TRP  16           HA       TRP  16   4.046  -3.748  -0.131
  129    HB2  TRP  16           HB2      TRP  16   2.534  -4.576  -1.731
  130    HB3  TRP  16           HB3      TRP  16   2.452  -3.038  -2.589
  131    HD1  TRP  16           HD1      TRP  16   4.776  -6.058  -2.085
  132    HE1  TRP  16           HE1      TRP  16   6.420  -6.167  -4.069
  133    HE3  TRP  16           HE3      TRP  16   3.545  -1.724  -4.491
  134    HZ2  TRP  16           HZ2      TRP  16   7.118  -4.621  -6.372
  135    HZ3  TRP  16           HZ3      TRP  16   4.715  -1.067  -6.573
  136    HH2  TRP  16           HH2      TRP  16   6.498  -2.508  -7.517
  137    H    PHE  17           H        PHE  17   3.818  -0.937  -2.348
  138    HA   PHE  17           HA       PHE  17   6.526  -0.848  -3.190
  139    HB2  PHE  17           HB2      PHE  17   4.551   0.426  -4.096
  140    HB3  PHE  17           HB3      PHE  17   4.627   1.467  -2.673
  141    HD1  PHE  17           HD1      PHE  17   6.577   0.292  -5.628
  142    HD2  PHE  17           HD2      PHE  17   6.191   3.249  -2.536
  143    HE1  PHE  17           HE2      PHE  17   8.331   1.665  -6.720
  144    HE2  PHE  17           HE1      PHE  17   7.945   4.620  -3.627
  145    HZ   PHE  17           HZ       PHE  17   9.015   3.828  -5.719
  146    H    TRP  18           H        TRP  18   4.942   0.772  -0.409
  147    HA   TRP  18           HA       TRP  18   7.306   2.090   0.560
  148    HB2  TRP  18           HB2      TRP  18   4.734   1.171   1.880
  149    HB3  TRP  18           HB3      TRP  18   5.915   2.207   2.677
  150    HD1  TRP  18           HD1      TRP  18   2.816   2.870   1.558
  151    HE1  TRP  18           HE1      TRP  18   2.541   5.036   0.188
  152    HE3  TRP  18           HE3      TRP  18   7.680   3.700   0.209
  153    HZ2  TRP  18           HZ2      TRP  18   4.160   6.874  -1.278
  154    HZ3  TRP  18           HZ3      TRP  18   8.278   5.664  -1.172
  155    HH2  TRP  18           HH2      TRP  18   6.527   7.253  -1.916
  156    H    ASN  19           H        ASN  19   5.915  -1.132   1.219
  157    HA   ASN  19           HA       ASN  19   7.674  -1.841   3.377
  158    HB2  ASN  19           HB2      ASN  19   5.659  -3.043   1.668
  159    HB3  ASN  19           HB3      ASN  19   6.992  -4.164   1.936
  160   HD21  ASN  19          HD21      ASN  19   4.374  -2.407   3.535
  161   HD22  ASN  19          HD22      ASN  19   4.533  -3.182   5.036
  162    H    VAL  20           H        VAL  20   7.952  -2.348  -0.170
  163    HA   VAL  20           HA       VAL  20  10.597  -3.622   0.160
  164    HB   VAL  20           HB       VAL  20  10.447  -3.842  -2.307
  165   HG11  VAL  20          HG11      VAL  20   8.513  -5.317  -2.362
  166   HG12  VAL  20          HG12      VAL  20   7.825  -4.525  -0.945
  167   HG13  VAL  20          HG13      VAL  20   9.306  -5.472  -0.794
  168   HG21  VAL  20          HG21      VAL  20   9.127  -2.508  -3.558
  169   HG22  VAL  20          HG22      VAL  20   8.765  -1.597  -2.093
  170   HG23  VAL  20          HG23      VAL  20   7.708  -2.916  -2.593
  171    H    THR  21           H        THR  21   9.532  -0.393   0.007
  172    HA   THR  21           HA       THR  21  12.065   0.518  -1.297
  173    HB   THR  21           HB       THR  21   9.415   1.886  -0.740
  174    HG1  THR  21           HG1      THR  21   9.014   0.846  -2.521
  175   HG21  THR  21          HG21      THR  21  11.232   3.517  -0.611
  176   HG22  THR  21          HG22      THR  21  10.341   3.741  -2.115
  177   HG23  THR  21          HG23      THR  21  11.902   2.922  -2.129
  178    H    LEU  22           H        LEU  22  10.069   0.948   1.617
  179    HA   LEU  22           HA       LEU  22  12.150   2.673   2.846
  180    HB2  LEU  22           HB2      LEU  22   9.393   1.776   3.737
  181    HB3  LEU  22           HB3      LEU  22  10.394   2.941   4.599
  182    HG   LEU  22           HG       LEU  22   9.764   3.379   1.690
  183   HD11  LEU  22          HD11      LEU  22   7.805   4.762   2.473
  184   HD12  LEU  22          HD12      LEU  22   7.988   4.015   4.061
  185   HD13  LEU  22          HD13      LEU  22   7.581   3.023   2.661
  186   HD21  LEU  22          HD21      LEU  22  11.453   4.787   2.840
  187   HD22  LEU  22          HD22      LEU  22  10.245   5.238   4.043
  188   HD23  LEU  22          HD23      LEU  22  10.043   5.733   2.362
  189    H    ARG  23           H        ARG  23  11.172  -0.645   2.867
  190    HA   ARG  23           HA       ARG  23  13.229  -1.287   4.871
  191    HB2  ARG  23           HB2      ARG  23  11.400  -2.524   6.245
  192    HB3  ARG  23           HB3      ARG  23  11.502  -0.772   6.411
  193    HG2  ARG  23           HG2      ARG  23   9.490  -0.429   5.389
  194    HG3  ARG  23           HG3      ARG  23   9.755  -1.714   4.214
  195    HD2  ARG  23           HD2      ARG  23   8.504  -3.153   5.434
  196    HD3  ARG  23           HD3      ARG  23   9.476  -2.830   6.883
  197    HE   ARG  23           HE       ARG  23   7.148  -1.161   6.012
  198   HH11  ARG  23          HH11      ARG  23   9.374   0.057   7.756
  199   HH12  ARG  23          HH12      ARG  23   8.678  -0.118   9.333
  200   HH21  ARG  23          HH21      ARG  23   6.262  -2.396   8.298
  201   HH22  ARG  23          HH22      ARG  23   6.907  -1.514   9.641
  202    HA   PRO  24           HA       PRO  24  12.214  -4.492   1.615
  203    HB2  PRO  24           HB2      PRO  24  14.703  -4.578   0.476
  204    HB3  PRO  24           HB3      PRO  24  13.430  -3.462  -0.058
  205    HG2  PRO  24           HG2      PRO  24  15.779  -2.954   1.696
  206    HG3  PRO  24           HG3      PRO  24  15.057  -1.925   0.449
  207    HD2  PRO  24           HD2      PRO  24  14.649  -1.565   3.121
  208    HD3  PRO  24           HD3      PRO  24  13.477  -1.083   1.874
  209    H    GLU  25           H        GLU  25  12.147  -6.317   2.885
  210    HA   GLU  25           HA       GLU  25  12.905  -8.256   3.986
  211    HB2  GLU  25           HB2      GLU  25  14.863  -7.550   2.154
  212    HB3  GLU  25           HB3      GLU  25  15.768  -7.679   3.662
  213    HG2  GLU  25           HG2      GLU  25  15.810  -9.882   2.850
  214    HG3  GLU  25           HG3      GLU  25  14.455  -9.914   3.978
  215    H    ARG  26           H        ARG  26  13.981  -8.903   6.013
  216    HA   ARG  26           HA       ARG  26  14.691  -6.562   7.760
  217    HB2  ARG  26           HB2      ARG  26  12.978  -9.015   8.174
  218    HB3  ARG  26           HB3      ARG  26  13.645  -8.137   9.550
  219    HG2  ARG  26           HG2      ARG  26  12.500  -6.252   7.699
  220    HG3  ARG  26           HG3      ARG  26  11.311  -7.505   8.059
  221    HD2  ARG  26           HD2      ARG  26  12.408  -6.979  10.556
  222    HD3  ARG  26           HD3      ARG  26  12.339  -5.375   9.799
  223    HE   ARG  26           HE       ARG  26  10.018  -7.094  10.407
  224   HH11  ARG  26          HH11      ARG  26  10.036  -4.182  11.006
  225   HH12  ARG  26          HH12      ARG  26   9.083  -3.524   9.720
  226   HH21  ARG  26          HH21      ARG  26   9.338  -6.360   7.726
  227   HH22  ARG  26          HH22      ARG  26   8.680  -4.763   7.857
  Start of MODEL    3
    1    HA   ARG   1           HA       ARG   1 -19.090   0.936  -2.475
    2    HB2  ARG   1           HB2      ARG   1 -21.250   1.961  -3.446
    3    HB3  ARG   1           HB3      ARG   1 -21.870   1.926  -1.796
    4    HG2  ARG   1           HG2      ARG   1 -19.995   3.305  -1.030
    5    HG3  ARG   1           HG3      ARG   1 -19.303   3.297  -2.654
    6    HD2  ARG   1           HD2      ARG   1 -21.983   4.145  -2.981
    7    HD3  ARG   1           HD3      ARG   1 -21.351   5.040  -1.584
    8    HE   ARG   1           HE       ARG   1 -19.978   4.951  -4.248
    9   HH11  ARG   1          HH11      ARG   1 -18.401   5.781  -1.785
   10   HH12  ARG   1          HH12      ARG   1 -18.543   7.506  -1.853
   11   HH21  ARG   1          HH21      ARG   1 -21.190   7.457  -4.108
   12   HH22  ARG   1          HH22      ARG   1 -20.130   8.459  -3.173
   13    H    SER   2           H        SER   2 -18.325  -0.513  -0.744
   14    HA   SER   2           HA       SER   2 -19.868  -0.413   1.810
   15    HB2  SER   2           HB2      SER   2 -18.865  -2.515   0.600
   16    HB3  SER   2           HB3      SER   2 -17.343  -1.972   1.303
   17    HG   SER   2           HG       SER   2 -18.181  -2.232   3.313
   18    H    ALA   3           H        ALA   3 -17.391   1.304   0.304
   19    HA   ALA   3           HA       ALA   3 -15.821   2.868   1.095
   20    HB1  ALA   3           HB1      ALA   3 -18.017   3.096   2.625
   21    HB2  ALA   3           HB2      ALA   3 -16.562   4.043   2.936
   22    HB3  ALA   3           HB3      ALA   3 -16.879   2.581   3.871
   23    H    LEU   4           H        LEU   4 -15.662  -0.312   1.801
   24    HA   LEU   4           HA       LEU   4 -13.163  -0.004   3.423
   25    HB2  LEU   4           HB2      LEU   4 -15.501  -1.895   3.658
   26    HB3  LEU   4           HB3      LEU   4 -13.926  -2.320   4.327
   27    HG   LEU   4           HG       LEU   4 -14.935   0.400   4.977
   28   HD11  LEU   4          HD11      LEU   4 -16.304  -0.566   6.862
   29   HD12  LEU   4          HD12      LEU   4 -16.155  -2.142   6.086
   30   HD13  LEU   4          HD13      LEU   4 -16.997  -0.830   5.262
   31   HD21  LEU   4          HD21      LEU   4 -13.885  -0.129   7.123
   32   HD22  LEU   4          HD22      LEU   4 -12.781  -0.548   5.814
   33   HD23  LEU   4          HD23      LEU   4 -13.691  -1.813   6.640
   34    H    VAL   5           H        VAL   5 -14.397  -0.957   0.458
   35    HA   VAL   5           HA       VAL   5 -12.655  -3.320   0.086
   36    HB   VAL   5           HB       VAL   5 -14.469  -1.790  -1.818
   37   HG11  VAL   5          HG11      VAL   5 -12.786  -3.214  -2.943
   38   HG12  VAL   5          HG12      VAL   5 -14.412  -3.868  -3.144
   39   HG13  VAL   5          HG13      VAL   5 -13.309  -4.592  -1.973
   40   HG21  VAL   5          HG21      VAL   5 -14.955  -4.140   0.029
   41   HG22  VAL   5          HG22      VAL   5 -15.998  -3.794  -1.350
   42   HG23  VAL   5          HG23      VAL   5 -15.844  -2.618  -0.044
   43    H    ASN   6           H        ASN   6 -13.042  -0.081  -1.427
   44    HA   ASN   6           HA       ASN   6 -10.655  -0.206  -3.017
   45    HB2  ASN   6           HB2      ASN   6 -12.710   1.344  -3.149
   46    HB3  ASN   6           HB3      ASN   6 -11.931   2.292  -1.882
   47   HD21  ASN   6          HD21      ASN   6 -11.229   0.920  -5.149
   48   HD22  ASN   6          HD22      ASN   6 -10.194   2.183  -5.615
   49    H    SER   7           H        SER   7 -11.255   1.040   0.286
   50    HA   SER   7           HA       SER   7  -8.741   2.283   0.758
   51    HB2  SER   7           HB2      SER   7  -9.324   1.629   3.180
   52    HB3  SER   7           HB3      SER   7 -10.537   2.564   2.309
   53    HG   SER   7           HG       SER   7 -10.924   0.305   3.481
   54    H    TYR   8           H        TYR   8  -9.752  -1.103   1.356
   55    HA   TYR   8           HA       TYR   8  -7.194  -2.044   2.283
   56    HB2  TYR   8           HB2      TYR   8  -9.070  -3.380   2.789
   57    HB3  TYR   8           HB3      TYR   8  -9.730  -3.233   1.162
   58    HD1  TYR   8           HD1      TYR   8  -6.747  -4.609   2.976
   59    HD2  TYR   8           HD2      TYR   8  -9.425  -4.977  -0.362
   60    HE1  TYR   8           HE2      TYR   8  -5.653  -6.739   2.333
   61    HE2  TYR   8           HE1      TYR   8  -8.331  -7.107  -1.005
   62    HH   TYR   8           HH       TYR   8  -6.772  -8.960   0.713
   63    H    LEU   9           H        LEU   9  -8.717  -1.895  -0.935
   64    HA   LEU   9           HA       LEU   9  -6.682  -3.307  -2.392
   65    HB2  LEU   9           HB2      LEU   9  -9.081  -1.697  -2.853
   66    HB3  LEU   9           HB3      LEU   9  -7.865  -1.420  -4.095
   67    HG   LEU   9           HG       LEU   9  -9.358  -3.279  -4.723
   68   HD11  LEU   9          HD11      LEU   9  -6.801  -3.239  -5.188
   69   HD12  LEU   9          HD12      LEU   9  -7.669  -4.754  -5.434
   70   HD13  LEU   9          HD13      LEU   9  -6.714  -4.513  -3.972
   71   HD21  LEU   9          HD21      LEU   9  -9.589  -5.244  -3.408
   72   HD22  LEU   9          HD22      LEU   9  -9.746  -3.918  -2.257
   73   HD23  LEU   9          HD23      LEU   9  -8.229  -4.810  -2.374
   74    H    TRP  10           H        TRP  10  -7.247   0.198  -1.904
   75    HA   TRP  10           HA       TRP  10  -4.944   1.133  -3.320
   76    HB2  TRP  10           HB2      TRP  10  -6.616   2.717  -2.858
   77    HB3  TRP  10           HB3      TRP  10  -6.803   2.175  -1.192
   78    HD1  TRP  10           HD1      TRP  10  -4.250   4.039  -3.411
   79    HE1  TRP  10           HE1      TRP  10  -2.902   5.646  -1.910
   80    HE3  TRP  10           HE3      TRP  10  -6.169   2.796   1.154
   81    HZ2  TRP  10           HZ2      TRP  10  -2.672   6.316   0.862
   82    HZ3  TRP  10           HZ3      TRP  10  -5.368   3.931   3.207
   83    HH2  TRP  10           HH2      TRP  10  -3.624   5.687   3.067
   84    H    GLN  11           H        GLN  11  -5.425   0.434   0.173
   85    HA   GLN  11           HA       GLN  11  -2.862   1.207   1.113
   86    HB2  GLN  11           HB2      GLN  11  -4.969   0.472   2.380
   87    HB3  GLN  11           HB3      GLN  11  -4.462  -1.188   2.063
   88    HG2  GLN  11           HG2      GLN  11  -2.975  -1.105   3.751
   89    HG3  GLN  11           HG3      GLN  11  -2.223   0.336   3.067
   90   HE21  GLN  11          HE21      GLN  11  -3.989  -0.785   5.745
   91   HE22  GLN  11          HE22      GLN  11  -4.510   0.718   6.340
   92    H    ARG  12           H        ARG  12  -3.947  -1.883  -0.306
   93    HA   ARG  12           HA       ARG  12  -1.580  -3.422   0.061
   94    HB2  ARG  12           HB2      ARG  12  -4.073  -3.497  -1.384
   95    HB3  ARG  12           HB3      ARG  12  -2.777  -4.027  -2.454
   96    HG2  ARG  12           HG2      ARG  12  -2.615  -5.128   0.279
   97    HG3  ARG  12           HG3      ARG  12  -4.036  -5.644  -0.631
   98    HD2  ARG  12           HD2      ARG  12  -1.224  -5.769  -1.771
   99    HD3  ARG  12           HD3      ARG  12  -2.001  -7.134  -0.946
  100    HE   ARG  12           HE       ARG  12  -3.826  -6.115  -2.890
  101   HH11  ARG  12          HH11      ARG  12  -3.283  -8.987  -2.750
  102   HH12  ARG  12          HH12      ARG  12  -2.371  -9.295  -4.189
  103   HH21  ARG  12          HH21      ARG  12  -1.573  -5.952  -4.711
  104   HH22  ARG  12          HH22      ARG  12  -1.397  -7.570  -5.306
  105    H    TRP  13           H        TRP  13  -2.494  -1.148  -2.525
  106    HA   TRP  13           HA       TRP  13  -0.360  -1.572  -4.342
  107    HB2  TRP  13           HB2      TRP  13  -2.552   0.092  -4.049
  108    HB3  TRP  13           HB3      TRP  13  -1.207   1.222  -3.932
  109    HD1  TRP  13           HD1      TRP  13  -3.171   1.191  -6.394
  110    HE1  TRP  13           HE1      TRP  13  -2.246   0.769  -8.765
  111    HE3  TRP  13           HE3      TRP  13   1.216  -1.146  -5.228
  112    HZ2  TRP  13           HZ2      TRP  13   0.051  -0.403  -9.999
  113    HZ3  TRP  13           HZ3      TRP  13   2.750  -1.904  -7.017
  114    HH2  TRP  13           HH2      TRP  13   2.175  -1.534  -9.398
  115    H    GLU  14           H        GLU  14  -0.572   1.044  -1.900
  116    HA   GLU  14           HA       GLU  14   2.221   1.761  -2.134
  117    HB2  GLU  14           HB2      GLU  14   0.067   2.351  -0.082
  118    HB3  GLU  14           HB3      GLU  14   1.619   3.188  -0.166
  119    HG2  GLU  14           HG2      GLU  14   0.899   3.494  -2.722
  120    HG3  GLU  14           HG3      GLU  14  -0.716   3.332  -2.030
  121    H    ASN  15           H        ASN  15   0.442  -0.482  -0.054
  122    HA   ASN  15           HA       ASN  15   2.256  -0.809   2.092
  123    HB2  ASN  15           HB2      ASN  15   0.140  -1.906   2.154
  124    HB3  ASN  15           HB3      ASN  15   0.404  -2.672   0.589
  125   HD21  ASN  15          HD21      ASN  15   2.645  -2.529   3.415
  126   HD22  ASN  15          HD22      ASN  15   2.743  -4.213   3.602
  127    H    TRP  16           H        TRP  16   2.198  -2.562  -1.042
  128    HA   TRP  16           HA       TRP  16   4.673  -3.990  -0.578
  129    HB2  TRP  16           HB2      TRP  16   3.235  -4.931  -2.184
  130    HB3  TRP  16           HB3      TRP  16   2.859  -3.366  -2.905
  131    HD1  TRP  16           HD1      TRP  16   5.596  -6.044  -2.807
  132    HE1  TRP  16           HE1      TRP  16   7.158  -5.704  -4.829
  133    HE3  TRP  16           HE3      TRP  16   3.724  -1.657  -4.641
  134    HZ2  TRP  16           HZ2      TRP  16   7.561  -3.822  -6.945
  135    HZ3  TRP  16           HZ3      TRP  16   4.718  -0.615  -6.659
  136    HH2  TRP  16           HH2      TRP  16   6.631  -1.691  -7.811
  137    H    PHE  17           H        PHE  17   3.836  -0.972  -2.293
  138    HA   PHE  17           HA       PHE  17   6.369  -0.357  -3.413
  139    HB2  PHE  17           HB2      PHE  17   4.411   0.876  -4.037
  140    HB3  PHE  17           HB3      PHE  17   4.056   1.295  -2.363
  141    HD1  PHE  17           HD1      PHE  17   6.870   1.634  -4.835
  142    HD2  PHE  17           HD2      PHE  17   4.623   3.433  -1.646
  143    HE1  PHE  17           HE2      PHE  17   8.208   3.709  -5.063
  144    HE2  PHE  17           HE1      PHE  17   5.961   5.507  -1.875
  145    HZ   PHE  17           HZ       PHE  17   7.753   5.646  -3.582
  146    H    TRP  18           H        TRP  18   4.999   0.816  -0.302
  147    HA   TRP  18           HA       TRP  18   7.423   2.046   0.627
  148    HB2  TRP  18           HB2      TRP  18   4.920   0.982   1.962
  149    HB3  TRP  18           HB3      TRP  18   6.178   1.827   2.860
  150    HD1  TRP  18           HD1      TRP  18   3.026   2.570   1.427
  151    HE1  TRP  18           HE1      TRP  18   2.816   5.028   0.673
  152    HE3  TRP  18           HE3      TRP  18   7.953   3.912   1.413
  153    HZ2  TRP  18           HZ2      TRP  18   4.514   7.266   0.139
  154    HZ3  TRP  18           HZ3      TRP  18   8.628   6.210   0.780
  155    HH2  TRP  18           HH2      TRP  18   6.916   7.887   0.143
  156    H    ASN  19           H        ASN  19   6.111  -1.248   0.969
  157    HA   ASN  19           HA       ASN  19   7.832  -2.280   2.965
  158    HB2  ASN  19           HB2      ASN  19   5.883  -3.443   2.033
  159    HB3  ASN  19           HB3      ASN  19   6.678  -3.561   0.464
  160   HD21  ASN  19          HD21      ASN  19   6.804  -4.759   3.824
  161   HD22  ASN  19          HD22      ASN  19   7.779  -6.105   3.477
  162    H    VAL  20           H        VAL  20   8.357  -2.236  -0.598
  163    HA   VAL  20           HA       VAL  20  11.118  -3.229  -0.246
  164    HB   VAL  20           HB       VAL  20  11.113  -3.132  -2.739
  165   HG11  VAL  20          HG11      VAL  20  10.146  -5.060  -1.398
  166   HG12  VAL  20          HG12      VAL  20   9.542  -4.915  -3.049
  167   HG13  VAL  20          HG13      VAL  20   8.553  -4.364  -1.697
  168   HG21  VAL  20          HG21      VAL  20   8.913  -1.330  -2.258
  169   HG22  VAL  20          HG22      VAL  20   8.357  -2.681  -3.242
  170   HG23  VAL  20          HG23      VAL  20   9.720  -1.699  -3.779
  171    H    THR  21           H        THR  21   9.517  -0.130  -0.739
  172    HA   THR  21           HA       THR  21  11.892   1.284  -1.669
  173    HB   THR  21           HB       THR  21   9.218   2.147  -0.524
  174    HG1  THR  21           HG1      THR  21   8.822   1.379  -2.476
  175   HG21  THR  21          HG21      THR  21  10.848   3.927  -0.145
  176   HG22  THR  21          HG22      THR  21   9.774   4.384  -1.469
  177   HG23  THR  21          HG23      THR  21  11.404   3.805  -1.815
  178    H    LEU  22           H        LEU  22  10.277   0.862   1.469
  179    HA   LEU  22           HA       LEU  22  12.256   2.550   2.861
  180    HB2  LEU  22           HB2      LEU  22   9.984   0.799   3.849
  181    HB3  LEU  22           HB3      LEU  22  10.860   1.977   4.825
  182    HG   LEU  22           HG       LEU  22   9.339   2.687   2.298
  183   HD11  LEU  22          HD11      LEU  22   7.772   1.881   3.995
  184   HD12  LEU  22          HD12      LEU  22   7.644   3.635   3.856
  185   HD13  LEU  22          HD13      LEU  22   8.521   2.920   5.209
  186   HD21  LEU  22          HD21      LEU  22  10.573   4.328   4.533
  187   HD22  LEU  22          HD22      LEU  22   9.548   4.994   3.263
  188   HD23  LEU  22          HD23      LEU  22  11.104   4.274   2.851
  189    H    ARG  23           H        ARG  23  12.115  -0.703   1.864
  190    HA   ARG  23           HA       ARG  23  13.273  -2.117   4.046
  191    HB2  ARG  23           HB2      ARG  23  12.672  -2.487   1.253
  192    HB3  ARG  23           HB3      ARG  23  14.275  -3.141   1.585
  193    HG2  ARG  23           HG2      ARG  23  12.611  -3.910   3.756
  194    HG3  ARG  23           HG3      ARG  23  11.711  -4.246   2.279
  195    HD2  ARG  23           HD2      ARG  23  12.974  -6.217   2.555
  196    HD3  ARG  23           HD3      ARG  23  13.999  -5.275   1.452
  197    HE   ARG  23           HE       ARG  23  15.241  -4.485   3.507
  198   HH11  ARG  23          HH11      ARG  23  15.779  -7.411   3.076
  199   HH12  ARG  23          HH12      ARG  23  15.500  -8.065   4.654
  200   HH21  ARG  23          HH21      ARG  23  13.783  -5.268   5.798
  201   HH22  ARG  23          HH22      ARG  23  14.365  -6.848   6.201
  202    HA   PRO  24           HA       PRO  24  17.583  -1.054   2.355
  203    HB2  PRO  24           HB2      PRO  24  17.846   0.557   0.163
  204    HB3  PRO  24           HB3      PRO  24  17.616  -1.197   0.048
  205    HG2  PRO  24           HG2      PRO  24  15.698   0.991  -0.444
  206    HG3  PRO  24           HG3      PRO  24  15.785  -0.623  -1.162
  207    HD2  PRO  24           HD2      PRO  24  14.028   0.200   0.854
  208    HD3  PRO  24           HD3      PRO  24  14.359  -1.473   0.365
  209    H    GLU  25           H        GLU  25  16.572   0.365   4.338
  210    HA   GLU  25           HA       GLU  25  16.992   3.278   3.805
  211    HB2  GLU  25           HB2      GLU  25  15.338   1.607   5.576
  212    HB3  GLU  25           HB3      GLU  25  16.091   2.969   6.405
  213    HG2  GLU  25           HG2      GLU  25  15.260   4.405   4.434
  214    HG3  GLU  25           HG3      GLU  25  14.237   3.029   4.022
  215    H    ARG  26           H        ARG  26  17.914   0.735   6.165
  216    HA   ARG  26           HA       ARG  26  19.833   0.500   7.510
  217    HB2  ARG  26           HB2      ARG  26  20.577   1.401   4.957
  218    HB3  ARG  26           HB3      ARG  26  21.482   2.427   6.070
  219    HG2  ARG  26           HG2      ARG  26  22.368   0.462   7.221
  220    HG3  ARG  26           HG3      ARG  26  21.395  -0.601   6.204
  221    HD2  ARG  26           HD2      ARG  26  23.412  -0.675   5.039
  222    HD3  ARG  26           HD3      ARG  26  22.671   0.730   4.250
  223    HE   ARG  26           HE       ARG  26  24.359   1.150   6.678
  224   HH11  ARG  26          HH11      ARG  26  26.049   0.732   4.272
  225   HH12  ARG  26          HH12      ARG  26  26.202   2.333   3.631
  226   HH21  ARG  26          HH21      ARG  26  23.523   3.599   5.452
  227   HH22  ARG  26          HH22      ARG  26  24.766   3.963   4.301
  Start of MODEL    4
    1    HA   ARG   1           HA       ARG   1 -11.413   4.555  -8.853
    2    HB2  ARG   1           HB2      ARG   1 -13.417   6.403 -10.117
    3    HB3  ARG   1           HB3      ARG   1 -13.187   6.469  -8.371
    4    HG2  ARG   1           HG2      ARG   1 -10.590   6.368  -9.458
    5    HG3  ARG   1           HG3      ARG   1 -11.479   7.504 -10.472
    6    HD2  ARG   1           HD2      ARG   1 -12.320   8.268  -7.971
    7    HD3  ARG   1           HD3      ARG   1 -10.644   7.775  -7.650
    8    HE   ARG   1           HE       ARG   1  -9.914   9.353  -9.399
    9   HH11  ARG   1          HH11      ARG   1 -11.283  11.158  -7.518
   10   HH12  ARG   1          HH12      ARG   1 -12.401  12.010  -8.530
   11   HH21  ARG   1          HH21      ARG   1 -12.199   9.713 -11.131
   12   HH22  ARG   1          HH22      ARG   1 -12.923  11.187 -10.584
   13    H    SER   2           H        SER   2 -12.355   3.910  -6.865
   14    HA   SER   2           HA       SER   2 -15.157   2.854  -6.943
   15    HB2  SER   2           HB2      SER   2 -12.709   1.378  -6.927
   16    HB3  SER   2           HB3      SER   2 -13.472   1.162  -5.355
   17    HG   SER   2           HG       SER   2 -15.052   0.094  -6.275
   18    H    ALA   3           H        ALA   3 -15.973   2.437  -4.663
   19    HA   ALA   3           HA       ALA   3 -14.836   4.474  -2.777
   20    HB1  ALA   3           HB1      ALA   3 -17.134   4.609  -1.936
   21    HB2  ALA   3           HB2      ALA   3 -17.612   3.264  -2.973
   22    HB3  ALA   3           HB3      ALA   3 -17.133   4.804  -3.689
   23    H    LEU   4           H        LEU   4 -16.381   1.226  -2.817
   24    HA   LEU   4           HA       LEU   4 -15.249   0.717  -0.096
   25    HB2  LEU   4           HB2      LEU   4 -17.556  -0.290  -1.736
   26    HB3  LEU   4           HB3      LEU   4 -16.913  -1.314  -0.452
   27    HG   LEU   4           HG       LEU   4 -17.071   0.956   0.941
   28   HD11  LEU   4          HD11      LEU   4 -17.855   2.388  -0.826
   29   HD12  LEU   4          HD12      LEU   4 -19.222   2.111   0.251
   30   HD13  LEU   4          HD13      LEU   4 -19.114   1.239  -1.279
   31   HD21  LEU   4          HD21      LEU   4 -19.363   0.217   1.650
   32   HD22  LEU   4          HD22      LEU   4 -18.202  -1.108   1.566
   33   HD23  LEU   4          HD23      LEU   4 -19.386  -0.890   0.277
   34    H    VAL   5           H        VAL   5 -14.027   0.374  -3.049
   35    HA   VAL   5           HA       VAL   5 -13.106  -2.456  -2.662
   36    HB   VAL   5           HB       VAL   5 -13.253  -0.658  -5.108
   37   HG11  VAL   5          HG11      VAL   5 -11.393  -2.056  -5.512
   38   HG12  VAL   5          HG12      VAL   5 -12.735  -2.923  -6.259
   39   HG13  VAL   5          HG13      VAL   5 -12.131  -3.426  -4.680
   40   HG21  VAL   5          HG21      VAL   5 -14.780  -3.174  -4.354
   41   HG22  VAL   5          HG22      VAL   5 -14.977  -2.256  -5.847
   42   HG23  VAL   5          HG23      VAL   5 -15.431  -1.536  -4.303
   43    H    ASN   6           H        ASN   6 -11.926   0.736  -3.828
   44    HA   ASN   6           HA       ASN   6  -9.129   0.035  -3.641
   45    HB2  ASN   6           HB2      ASN   6 -10.633   2.022  -4.773
   46    HB3  ASN   6           HB3      ASN   6  -9.926   2.876  -3.402
   47   HD21  ASN   6          HD21      ASN   6  -7.375   1.724  -3.219
   48   HD22  ASN   6          HD22      ASN   6  -6.511   2.008  -4.651
   49    H    SER   7           H        SER   7 -11.467   1.142  -1.281
   50    HA   SER   7           HA       SER   7  -9.897   2.463   0.647
   51    HB2  SER   7           HB2      SER   7 -11.601   1.374   2.232
   52    HB3  SER   7           HB3      SER   7 -12.273   2.281   0.882
   53    HG   SER   7           HG       SER   7 -13.313   0.382   0.780
   54    H    TYR   8           H        TYR   8 -10.166  -1.016  -0.015
   55    HA   TYR   8           HA       TYR   8  -8.238  -1.639   2.175
   56    HB2  TYR   8           HB2      TYR   8 -10.072  -3.090   2.260
   57    HB3  TYR   8           HB3      TYR   8 -10.269  -3.104   0.509
   58    HD1  TYR   8           HD1      TYR   8  -7.936  -4.211   3.223
   59    HD2  TYR   8           HD2      TYR   8  -9.383  -4.862  -0.768
   60    HE1  TYR   8           HE1      TYR   8  -6.617  -6.305   3.086
   61    HE2  TYR   8           HE2      TYR   8  -8.064  -6.956  -0.906
   62    HH   TYR   8           HH       TYR   8  -7.133  -8.669   1.004
   63    H    LEU   9           H        LEU   9  -8.599  -1.701  -1.355
   64    HA   LEU   9           HA       LEU   9  -6.207  -3.207  -1.942
   65    HB2  LEU   9           HB2      LEU   9  -8.313  -1.706  -3.313
   66    HB3  LEU   9           HB3      LEU   9  -6.749  -1.520  -4.102
   67    HG   LEU   9           HG       LEU   9  -7.971  -3.466  -5.001
   68   HD11  LEU   9          HD11      LEU   9  -5.778  -4.666  -3.350
   69   HD12  LEU   9          HD12      LEU   9  -5.373  -3.378  -4.484
   70   HD13  LEU   9          HD13      LEU   9  -6.121  -4.864  -5.068
   71   HD21  LEU   9          HD21      LEU   9  -9.114  -3.862  -2.700
   72   HD22  LEU   9          HD22      LEU   9  -7.662  -4.785  -2.306
   73   HD23  LEU   9          HD23      LEU   9  -8.679  -5.275  -3.662
   74    H    TRP  10           H        TRP  10  -6.851   0.272  -1.514
   75    HA   TRP  10           HA       TRP  10  -4.408   1.333  -2.497
   76    HB2  TRP  10           HB2      TRP  10  -6.170   2.824  -1.983
   77    HB3  TRP  10           HB3      TRP  10  -6.417   2.122  -0.386
   78    HD1  TRP  10           HD1      TRP  10  -3.704   4.118  -2.293
   79    HE1  TRP  10           HE1      TRP  10  -2.492   5.637  -0.598
   80    HE3  TRP  10           HE3      TRP  10  -6.032   2.665   2.011
   81    HZ2  TRP  10           HZ2      TRP  10  -2.510   6.165   2.214
   82    HZ3  TRP  10           HZ3      TRP  10  -5.418   3.690   4.181
   83    HH2  TRP  10           HH2      TRP  10  -3.661   5.437   4.289
   84    H    GLN  11           H        GLN  11  -5.220   0.291   0.842
   85    HA   GLN  11           HA       GLN  11  -2.710   0.850   2.053
   86    HB2  GLN  11           HB2      GLN  11  -5.111  -0.027   2.881
   87    HB3  GLN  11           HB3      GLN  11  -4.274  -1.578   2.840
   88    HG2  GLN  11           HG2      GLN  11  -3.286  -1.086   4.799
   89    HG3  GLN  11           HG3      GLN  11  -2.511   0.308   4.048
   90   HE21  GLN  11          HE21      GLN  11  -2.993   2.218   5.138
   91   HE22  GLN  11          HE22      GLN  11  -4.456   2.545   5.933
   92    H    ARG  12           H        ARG  12  -3.871  -2.198   0.540
   93    HA   ARG  12           HA       ARG  12  -1.407  -3.654   0.907
   94    HB2  ARG  12           HB2      ARG  12  -4.015  -3.937  -0.393
   95    HB3  ARG  12           HB3      ARG  12  -2.725  -4.685  -1.333
   96    HG2  ARG  12           HG2      ARG  12  -3.402  -6.400   0.138
   97    HG3  ARG  12           HG3      ARG  12  -1.966  -5.730   0.913
   98    HD2  ARG  12           HD2      ARG  12  -4.487  -4.373   1.662
   99    HD3  ARG  12           HD3      ARG  12  -4.368  -6.060   2.195
  100    HE   ARG  12           HE       ARG  12  -2.652  -3.854   3.097
  101   HH11  ARG  12          HH11      ARG  12  -3.798  -6.370   4.559
  102   HH12  ARG  12          HH12      ARG  12  -2.320  -7.190   4.941
  103   HH21  ARG  12          HH21      ARG  12  -0.392  -5.285   2.763
  104   HH22  ARG  12          HH22      ARG  12  -0.386  -6.574   3.919
  105    H    TRP  13           H        TRP  13  -2.665  -1.613  -1.727
  106    HA   TRP  13           HA       TRP  13  -0.713  -2.127  -3.734
  107    HB2  TRP  13           HB2      TRP  13  -2.883  -0.389  -3.236
  108    HB3  TRP  13           HB3      TRP  13  -1.515   0.667  -3.553
  109    HD1  TRP  13           HD1      TRP  13  -4.068   0.072  -5.498
  110    HE1  TRP  13           HE1      TRP  13  -3.574  -0.645  -7.929
  111    HE3  TRP  13           HE3      TRP  13   0.740  -1.553  -4.973
  112    HZ2  TRP  13           HZ2      TRP  13  -1.418  -1.757  -9.445
  113    HZ3  TRP  13           HZ3      TRP  13   1.991  -2.433  -6.922
  114    HH2  TRP  13           HH2      TRP  13   0.921  -2.535  -9.156
  115    H    GLU  14           H        GLU  14  -0.808   0.575  -1.404
  116    HA   GLU  14           HA       GLU  14   1.887   1.462  -1.960
  117    HB2  GLU  14           HB2      GLU  14   0.001   1.971   0.362
  118    HB3  GLU  14           HB3      GLU  14   1.403   2.956  -0.056
  119    HG2  GLU  14           HG2      GLU  14   0.134   2.901  -2.459
  120    HG3  GLU  14           HG3      GLU  14  -1.253   2.786  -1.381
  121    H    ASN  15           H        ASN  15   0.481  -0.775   0.406
  122    HA   ASN  15           HA       ASN  15   2.551  -0.933   2.319
  123    HB2  ASN  15           HB2      ASN  15   0.547  -2.131   2.711
  124    HB3  ASN  15           HB3      ASN  15   0.593  -2.897   1.125
  125   HD21  ASN  15          HD21      ASN  15   3.260  -2.681   3.548
  126   HD22  ASN  15          HD22      ASN  15   3.416  -4.361   3.732
  127    H    TRP  16           H        TRP  16   2.224  -2.774  -0.744
  128    HA   TRP  16           HA       TRP  16   4.795  -4.091  -0.527
  129    HB2  TRP  16           HB2      TRP  16   3.255  -5.137  -1.958
  130    HB3  TRP  16           HB3      TRP  16   2.698  -3.609  -2.636
  131    HD1  TRP  16           HD1      TRP  16   5.621  -6.085  -2.833
  132    HE1  TRP  16           HE1      TRP  16   6.892  -5.686  -5.040
  133    HE3  TRP  16           HE3      TRP  16   3.195  -1.912  -4.510
  134    HZ2  TRP  16           HZ2      TRP  16   6.883  -3.843  -7.224
  135    HZ3  TRP  16           HZ3      TRP  16   3.848  -0.857  -6.654
  136    HH2  TRP  16           HH2      TRP  16   5.686  -1.816  -8.014
  137    H    PHE  17           H        PHE  17   3.637  -1.187  -2.262
  138    HA   PHE  17           HA       PHE  17   6.024  -0.485  -3.620
  139    HB2  PHE  17           HB2      PHE  17   3.820   0.526  -4.009
  140    HB3  PHE  17           HB3      PHE  17   3.832   1.223  -2.390
  141    HD1  PHE  17           HD1      PHE  17   5.755   1.183  -5.600
  142    HD2  PHE  17           HD2      PHE  17   4.788   3.342  -2.013
  143    HE1  PHE  17           HE1      PHE  17   6.982   3.159  -6.457
  144    HE2  PHE  17           HE2      PHE  17   6.014   5.317  -2.872
  145    HZ   PHE  17           HZ       PHE  17   7.113   5.226  -5.094
  146    H    TRP  18           H        TRP  18   4.850   0.803  -0.475
  147    HA   TRP  18           HA       TRP  18   7.222   2.248   0.188
  148    HB2  TRP  18           HB2      TRP  18   5.023   0.963   1.834
  149    HB3  TRP  18           HB3      TRP  18   6.242   2.028   2.530
  150    HD1  TRP  18           HD1      TRP  18   2.886   2.322   1.667
  151    HE1  TRP  18           HE1      TRP  18   2.235   4.637   0.736
  152    HE3  TRP  18           HE3      TRP  18   7.514   4.127   0.473
  153    HZ2  TRP  18           HZ2      TRP  18   3.510   6.945  -0.364
  154    HZ3  TRP  18           HZ3      TRP  18   7.765   6.385  -0.513
  155    HH2  TRP  18           HH2      TRP  18   5.770   7.795  -0.934
  156    H    ASN  19           H        ASN  19   6.306  -1.149   0.722
  157    HA   ASN  19           HA       ASN  19   8.382  -1.895   2.531
  158    HB2  ASN  19           HB2      ASN  19   6.370  -3.225   1.934
  159    HB3  ASN  19           HB3      ASN  19   7.035  -3.485   0.321
  160   HD21  ASN  19          HD21      ASN  19   7.363  -4.386   3.729
  161   HD22  ASN  19          HD22      ASN  19   8.473  -5.642   3.470
  162    H    VAL  20           H        VAL  20   8.347  -1.859  -1.060
  163    HA   VAL  20           HA       VAL  20  11.202  -2.686  -1.106
  164    HB   VAL  20           HB       VAL  20  10.796  -2.891  -3.533
  165   HG11  VAL  20          HG11      VAL  20   9.510  -4.812  -3.378
  166   HG12  VAL  20          HG12      VAL  20   8.337  -4.068  -2.292
  167   HG13  VAL  20          HG13      VAL  20   9.914  -4.570  -1.678
  168   HG21  VAL  20          HG21      VAL  20   9.001  -0.892  -3.281
  169   HG22  VAL  20          HG22      VAL  20   7.898  -2.267  -3.221
  170   HG23  VAL  20          HG23      VAL  20   8.953  -2.044  -4.615
  171    H    THR  21           H        THR  21   9.431   0.251  -1.081
  172    HA   THR  21           HA       THR  21  11.469   1.731  -2.657
  173    HB   THR  21           HB       THR  21   8.836   2.492  -1.353
  174    HG1  THR  21           HG1      THR  21   8.333   1.423  -3.134
  175   HG21  THR  21          HG21      THR  21  10.679   4.138  -3.109
  176   HG22  THR  21          HG22      THR  21  10.342   4.431  -1.403
  177   HG23  THR  21          HG23      THR  21   9.061   4.620  -2.600
  178    H    LEU  22           H        LEU  22  10.197   1.513   0.655
  179    HA   LEU  22           HA       LEU  22  12.033   3.581   1.656
  180    HB2  LEU  22           HB2      LEU  22  10.138   1.642   3.016
  181    HB3  LEU  22           HB3      LEU  22  10.958   2.976   3.825
  182    HG   LEU  22           HG       LEU  22   9.214   3.415   1.394
  183   HD11  LEU  22          HD11      LEU  22   7.991   2.288   3.335
  184   HD12  LEU  22          HD12      LEU  22   7.342   3.842   2.812
  185   HD13  LEU  22          HD13      LEU  22   8.332   3.745   4.268
  186   HD21  LEU  22          HD21      LEU  22  10.340   5.153   3.605
  187   HD22  LEU  22          HD22      LEU  22   9.058   5.703   2.525
  188   HD23  LEU  22          HD23      LEU  22  10.642   5.280   1.872
  189    H    ARG  23           H        ARG  23  12.167   0.156   1.174
  190    HA   ARG  23           HA       ARG  23  13.955  -0.587   3.293
  191    HB2  ARG  23           HB2      ARG  23  12.667  -1.755   1.056
  192    HB3  ARG  23           HB3      ARG  23  14.387  -2.078   0.850
  193    HG2  ARG  23           HG2      ARG  23  13.456  -2.458   3.612
  194    HG3  ARG  23           HG3      ARG  23  12.681  -3.540   2.456
  195    HD2  ARG  23           HD2      ARG  23  14.809  -4.393   1.698
  196    HD3  ARG  23           HD3      ARG  23  15.690  -3.149   2.609
  197    HE   ARG  23           HE       ARG  23  13.906  -5.014   4.103
  198   HH11  ARG  23          HH11      ARG  23  15.802  -3.079   5.440
  199   HH12  ARG  23          HH12      ARG  23  17.123  -4.117   5.862
  200   HH21  ARG  23          HH21      ARG  23  16.138  -6.673   3.720
  201   HH22  ARG  23          HH22      ARG  23  17.316  -6.159   4.882
  202    HA   PRO  24           HA       PRO  24  17.521   0.210   0.186
  203    HB2  PRO  24           HB2      PRO  24  16.966   1.599  -2.107
  204    HB3  PRO  24           HB3      PRO  24  16.881  -0.171  -2.004
  205    HG2  PRO  24           HG2      PRO  24  14.687   1.837  -1.907
  206    HG3  PRO  24           HG3      PRO  24  14.730   0.249  -2.688
  207    HD2  PRO  24           HD2      PRO  24  13.491   0.719  -0.312
  208    HD3  PRO  24           HD3      PRO  24  14.174  -0.856  -0.764
  209    H    GLU  25           H        GLU  25  18.883   2.133   0.004
  210    HA   GLU  25           HA       GLU  25  17.777   4.462   1.472
  211    HB2  GLU  25           HB2      GLU  25  20.505   3.415   0.717
  212    HB3  GLU  25           HB3      GLU  25  20.313   5.049   1.351
  213    HG2  GLU  25           HG2      GLU  25  18.942   3.914   3.249
  214    HG3  GLU  25           HG3      GLU  25  19.721   2.426   2.711
  215    H    ARG  26           H        ARG  26  19.323   3.716  -1.662
  216    HA   ARG  26           HA       ARG  26  18.318   6.343  -2.696
  217    HB2  ARG  26           HB2      ARG  26  21.076   5.101  -2.922
  218    HB3  ARG  26           HB3      ARG  26  20.543   6.428  -3.952
  219    HG2  ARG  26           HG2      ARG  26  20.396   6.589  -0.935
  220    HG3  ARG  26           HG3      ARG  26  21.838   7.072  -1.827
  221    HD2  ARG  26           HD2      ARG  26  20.876   9.016  -2.527
  222    HD3  ARG  26           HD3      ARG  26  19.350   8.206  -2.933
  223    HE   ARG  26           HE       ARG  26  18.666   8.404  -0.605
  224   HH11  ARG  26          HH11      ARG  26  19.524  11.222  -1.184
  225   HH12  ARG  26          HH12      ARG  26  20.561  11.569   0.159
  226   HH21  ARG  26          HH21      ARG  26  20.950   8.233   1.057
  227   HH22  ARG  26          HH22      ARG  26  21.372   9.872   1.433
  Start of MODEL    5
    1    HA   ARG   1           HA       ARG   1 -11.662   4.148  -6.676
    2    HB2  ARG   1           HB2      ARG   1 -12.101   5.286  -8.990
    3    HB3  ARG   1           HB3      ARG   1 -13.542   5.943  -8.214
    4    HG2  ARG   1           HG2      ARG   1 -12.145   6.924  -6.435
    5    HG3  ARG   1           HG3      ARG   1 -10.700   6.260  -7.200
    6    HD2  ARG   1           HD2      ARG   1 -11.324   7.567  -9.291
    7    HD3  ARG   1           HD3      ARG   1 -12.560   8.385  -8.314
    8    HE   ARG   1           HE       ARG   1  -9.631   8.448  -7.682
    9   HH11  ARG   1          HH11      ARG   1 -11.442   9.088  -5.399
   10   HH12  ARG   1          HH12      ARG   1 -11.607  10.807  -5.522
   11   HH21  ARG   1          HH21      ARG   1 -10.430  10.945  -8.791
   12   HH22  ARG   1          HH22      ARG   1 -11.028  11.864  -7.450
   13    H    SER   2           H        SER   2 -13.057   2.918  -5.039
   14    HA   SER   2           HA       SER   2 -15.404   4.590  -4.178
   15    HB2  SER   2           HB2      SER   2 -15.320   1.927  -4.988
   16    HB3  SER   2           HB3      SER   2 -15.322   1.820  -3.231
   17    HG   SER   2           HG       SER   2 -17.322   2.449  -3.242
   18    H    ALA   3           H        ALA   3 -15.475   5.147  -1.991
   19    HA   ALA   3           HA       ALA   3 -13.015   5.102  -0.464
   20    HB1  ALA   3           HB1      ALA   3 -14.506   6.146   1.262
   21    HB2  ALA   3           HB2      ALA   3 -15.891   5.777   0.234
   22    HB3  ALA   3           HB3      ALA   3 -14.656   6.905  -0.322
   23    H    LEU   4           H        LEU   4 -15.950   3.100  -0.430
   24    HA   LEU   4           HA       LEU   4 -15.088   1.681   2.022
   25    HB2  LEU   4           HB2      LEU   4 -17.484   2.418   1.191
   26    HB3  LEU   4           HB3      LEU   4 -17.408   0.914   0.274
   27    HG   LEU   4           HG       LEU   4 -16.572   0.003   2.675
   28   HD11  LEU   4          HD11      LEU   4 -18.577   2.182   3.329
   29   HD12  LEU   4          HD12      LEU   4 -16.850   2.291   3.671
   30   HD13  LEU   4          HD13      LEU   4 -17.830   1.059   4.466
   31   HD21  LEU   4          HD21      LEU   4 -18.762  -0.929   2.925
   32   HD22  LEU   4          HD22      LEU   4 -18.529  -0.720   1.190
   33   HD23  LEU   4          HD23      LEU   4 -19.513   0.432   2.094
   34    H    VAL   5           H        VAL   5 -14.264   1.434  -1.214
   35    HA   VAL   5           HA       VAL   5 -13.822  -1.529  -0.985
   36    HB   VAL   5           HB       VAL   5 -14.418   0.198  -3.415
   37   HG11  VAL   5          HG11      VAL   5 -13.592  -2.670  -3.081
   38   HG12  VAL   5          HG12      VAL   5 -13.085  -1.499  -4.297
   39   HG13  VAL   5          HG13      VAL   5 -14.684  -2.234  -4.396
   40   HG21  VAL   5          HG21      VAL   5 -16.048  -1.981  -2.063
   41   HG22  VAL   5          HG22      VAL   5 -16.528  -1.061  -3.488
   42   HG23  VAL   5          HG23      VAL   5 -16.369  -0.252  -1.930
   43    H    ASN   6           H        ASN   6 -12.593   1.477  -2.516
   44    HA   ASN   6           HA       ASN   6 -10.042   0.368  -3.278
   45    HB2  ASN   6           HB2      ASN   6 -11.230   2.403  -4.201
   46    HB3  ASN   6           HB3      ASN   6 -10.774   3.257  -2.727
   47   HD21  ASN   6          HD21      ASN   6  -9.133   4.673  -3.480
   48   HD22  ASN   6          HD22      ASN   6  -7.738   4.148  -4.294
   49    H    SER   7           H        SER   7 -11.252   1.515  -0.205
   50    HA   SER   7           HA       SER   7  -8.962   2.536   1.073
   51    HB2  SER   7           HB2      SER   7 -11.367   2.236   1.911
   52    HB3  SER   7           HB3      SER   7 -10.922   0.577   2.301
   53    HG   SER   7           HG       SER   7 -10.632   2.025   4.068
   54    H    TYR   8           H        TYR   8  -9.972  -0.907   0.887
   55    HA   TYR   8           HA       TYR   8  -7.507  -1.904   2.077
   56    HB2  TYR   8           HB2      TYR   8  -9.560  -3.154   2.284
   57    HB3  TYR   8           HB3      TYR   8  -9.819  -3.130   0.540
   58    HD1  TYR   8           HD1      TYR   8  -7.607  -4.459   3.226
   59    HD2  TYR   8           HD2      TYR   8  -8.817  -4.753  -0.885
   60    HE1  TYR   8           HE2      TYR   8  -6.330  -6.572   3.000
   61    HE2  TYR   8           HE1      TYR   8  -7.541  -6.865  -1.110
   62    HH   TYR   8           HH       TYR   8  -5.253  -7.883   1.127
   63    H    LEU   9           H        LEU   9  -8.778  -1.604  -1.246
   64    HA   LEU   9           HA       LEU   9  -6.700  -2.945  -2.652
   65    HB2  LEU   9           HB2      LEU   9  -8.651  -0.726  -3.249
   66    HB3  LEU   9           HB3      LEU   9  -7.490  -1.233  -4.474
   67    HG   LEU   9           HG       LEU   9  -9.364  -3.137  -3.041
   68   HD11  LEU   9          HD11      LEU   9 -10.671  -1.576  -4.396
   69   HD12  LEU   9          HD12      LEU   9 -10.624  -3.149  -5.192
   70   HD13  LEU   9          HD13      LEU   9  -9.600  -1.836  -5.773
   71   HD21  LEU   9          HD21      LEU   9  -7.474  -3.376  -5.398
   72   HD22  LEU   9          HD22      LEU   9  -8.729  -4.568  -5.059
   73   HD23  LEU   9          HD23      LEU   9  -7.438  -4.291  -3.891
   74    H    TRP  10           H        TRP  10  -6.925   0.427  -1.512
   75    HA   TRP  10           HA       TRP  10  -4.534   1.388  -2.809
   76    HB2  TRP  10           HB2      TRP  10  -6.146   2.966  -2.051
   77    HB3  TRP  10           HB3      TRP  10  -6.237   2.227  -0.454
   78    HD1  TRP  10           HD1      TRP  10  -3.879   4.340  -2.626
   79    HE1  TRP  10           HE1      TRP  10  -2.258   5.614  -1.081
   80    HE3  TRP  10           HE3      TRP  10  -5.173   2.302   1.869
   81    HZ2  TRP  10           HZ2      TRP  10  -1.595   5.745   1.698
   82    HZ3  TRP  10           HZ3      TRP  10  -4.030   3.015   3.948
   83    HH2  TRP  10           HH2      TRP  10  -2.243   4.733   3.869
   84    H    GLN  11           H        GLN  11  -5.144   0.262   0.548
   85    HA   GLN  11           HA       GLN  11  -2.440   0.523   1.458
   86    HB2  GLN  11           HB2      GLN  11  -4.623   0.229   2.770
   87    HB3  GLN  11           HB3      GLN  11  -4.501  -1.492   2.399
   88    HG2  GLN  11           HG2      GLN  11  -1.952  -0.841   3.311
   89    HG3  GLN  11           HG3      GLN  11  -3.019   0.091   4.362
   90   HE21  GLN  11          HE21      GLN  11  -3.091  -1.175   6.261
   91   HE22  GLN  11          HE22      GLN  11  -3.529  -2.815   6.292
   92    H    ARG  12           H        ARG  12  -4.214  -2.257   0.053
   93    HA   ARG  12           HA       ARG  12  -2.130  -4.206   0.295
   94    HB2  ARG  12           HB2      ARG  12  -4.666  -4.329  -0.367
   95    HB3  ARG  12           HB3      ARG  12  -4.072  -4.069  -2.008
   96    HG2  ARG  12           HG2      ARG  12  -2.653  -6.138  -0.412
   97    HG3  ARG  12           HG3      ARG  12  -4.300  -6.528  -0.906
   98    HD2  ARG  12           HD2      ARG  12  -3.595  -5.775  -3.273
   99    HD3  ARG  12           HD3      ARG  12  -1.929  -5.878  -2.670
  100    HE   ARG  12           HE       ARG  12  -3.783  -8.152  -3.015
  101   HH11  ARG  12          HH11      ARG  12  -0.755  -7.784  -3.719
  102   HH12  ARG  12          HH12      ARG  12  -0.054  -8.918  -2.614
  103   HH21  ARG  12          HH21      ARG  12  -2.943  -9.252  -0.711
  104   HH22  ARG  12          HH22      ARG  12  -1.297  -9.754  -0.906
  105    H    TRP  13           H        TRP  13  -2.591  -1.546  -1.941
  106    HA   TRP  13           HA       TRP  13  -0.644  -2.524  -3.923
  107    HB2  TRP  13           HB2      TRP  13  -2.804  -0.760  -3.832
  108    HB3  TRP  13           HB3      TRP  13  -1.411   0.310  -3.950
  109    HD1  TRP  13           HD1      TRP  13  -3.539  -0.173  -6.288
  110    HE1  TRP  13           HE1      TRP  13  -2.696  -0.994  -8.585
  111    HE3  TRP  13           HE3      TRP  13   0.950  -2.162  -4.912
  112    HZ2  TRP  13           HZ2      TRP  13  -0.409  -2.318  -9.687
  113    HZ3  TRP  13           HZ3      TRP  13   2.443  -3.195  -6.598
  114    HH2  TRP  13           HH2      TRP  13   1.770  -3.273  -8.982
  115    H    GLU  14           H        GLU  14  -0.860   0.296  -1.736
  116    HA   GLU  14           HA       GLU  14   1.871   1.123  -2.118
  117    HB2  GLU  14           HB2      GLU  14  -0.168   1.705   0.048
  118    HB3  GLU  14           HB3      GLU  14   1.297   2.642  -0.246
  119    HG2  GLU  14           HG2      GLU  14   0.205   2.551  -2.762
  120    HG3  GLU  14           HG3      GLU  14  -1.243   2.602  -1.758
  121    H    ASN  15           H        ASN  15   0.395  -1.221   0.067
  122    HA   ASN  15           HA       ASN  15   2.239  -1.294   2.198
  123    HB2  ASN  15           HB2      ASN  15   0.268  -2.668   2.202
  124    HB3  ASN  15           HB3      ASN  15   0.731  -3.451   0.693
  125   HD21  ASN  15          HD21      ASN  15   2.929  -2.841   3.474
  126   HD22  ASN  15          HD22      ASN  15   3.195  -4.483   3.814
  127    H    TRP  16           H        TRP  16   2.427  -3.180  -0.860
  128    HA   TRP  16           HA       TRP  16   5.117  -4.134  -0.390
  129    HB2  TRP  16           HB2      TRP  16   3.911  -5.412  -1.925
  130    HB3  TRP  16           HB3      TRP  16   3.144  -4.002  -2.650
  131    HD1  TRP  16           HD1      TRP  16   6.419  -5.987  -2.690
  132    HE1  TRP  16           HE1      TRP  16   7.731  -5.379  -4.823
  133    HE3  TRP  16           HE3      TRP  16   3.494  -2.195  -4.473
  134    HZ2  TRP  16           HZ2      TRP  16   7.564  -3.529  -6.997
  135    HZ3  TRP  16           HZ3      TRP  16   4.096  -1.029  -6.575
  136    HH2  TRP  16           HH2      TRP  16   6.125  -1.690  -7.838
  137    H    PHE  17           H        PHE  17   3.759  -1.396  -2.226
  138    HA   PHE  17           HA       PHE  17   6.098  -0.426  -3.481
  139    HB2  PHE  17           HB2      PHE  17   3.972   0.455  -4.073
  140    HB3  PHE  17           HB3      PHE  17   3.572   0.827  -2.400
  141    HD1  PHE  17           HD1      PHE  17   6.158   1.679  -4.988
  142    HD2  PHE  17           HD2      PHE  17   3.796   3.024  -1.662
  143    HE1  PHE  17           HE2      PHE  17   7.058   3.971  -5.276
  144    HE2  PHE  17           HE1      PHE  17   4.696   5.317  -1.952
  145    HZ   PHE  17           HZ       PHE  17   6.327   5.790  -3.756
  146    H    TRP  18           H        TRP  18   4.726   0.666  -0.335
  147    HA   TRP  18           HA       TRP  18   6.900   2.377   0.376
  148    HB2  TRP  18           HB2      TRP  18   4.808   0.842   1.935
  149    HB3  TRP  18           HB3      TRP  18   5.934   1.944   2.722
  150    HD1  TRP  18           HD1      TRP  18   2.590   2.013   1.637
  151    HE1  TRP  18           HE1      TRP  18   1.806   4.349   0.874
  152    HE3  TRP  18           HE3      TRP  18   7.114   4.302   1.033
  153    HZ2  TRP  18           HZ2      TRP  18   2.950   6.857   0.116
  154    HZ3  TRP  18           HZ3      TRP  18   7.238   6.662   0.292
  155    HH2  TRP  18           HH2      TRP  18   5.164   7.942  -0.167
  156    H    ASN  19           H        ASN  19   6.332  -1.090   1.079
  157    HA   ASN  19           HA       ASN  19   8.458  -1.584   2.860
  158    HB2  ASN  19           HB2      ASN  19   6.818  -3.085   0.911
  159    HB3  ASN  19           HB3      ASN  19   8.343  -3.859   1.346
  160   HD21  ASN  19          HD21      ASN  19   5.270  -2.651   2.686
  161   HD22  ASN  19          HD22      ASN  19   5.401  -3.476   4.163
  162    H    VAL  20           H        VAL  20   8.583  -1.567  -0.731
  163    HA   VAL  20           HA       VAL  20  11.499  -2.083  -0.659
  164    HB   VAL  20           HB       VAL  20  11.233  -2.153  -3.122
  165   HG11  VAL  20          HG11      VAL  20  10.621  -4.097  -1.565
  166   HG12  VAL  20          HG12      VAL  20   9.961  -4.159  -3.199
  167   HG13  VAL  20          HG13      VAL  20   8.938  -3.655  -1.854
  168   HG21  VAL  20          HG21      VAL  20   9.407  -0.352  -3.121
  169   HG22  VAL  20          HG22      VAL  20   8.286  -1.632  -2.664
  170   HG23  VAL  20          HG23      VAL  20   9.144  -1.722  -4.200
  171    H    THR  21           H        THR  21   9.338   0.656  -0.954
  172    HA   THR  21           HA       THR  21  11.334   2.427  -2.175
  173    HB   THR  21           HB       THR  21   8.627   2.882  -0.876
  174    HG1  THR  21           HG1      THR  21   8.230   1.848  -2.707
  175   HG21  THR  21          HG21      THR  21  10.407   4.742  -2.472
  176   HG22  THR  21          HG22      THR  21   9.873   4.957  -0.805
  177   HG23  THR  21          HG23      THR  21   8.709   5.062  -2.125
  178    H    LEU  22           H        LEU  22  10.307   1.560   1.065
  179    HA   LEU  22           HA       LEU  22  11.621   3.846   2.356
  180    HB2  LEU  22           HB2      LEU  22  10.333   1.278   3.316
  181    HB3  LEU  22           HB3      LEU  22  10.994   2.487   4.416
  182    HG   LEU  22           HG       LEU  22   8.945   3.179   2.299
  183   HD11  LEU  22          HD11      LEU  22   7.193   2.775   3.796
  184   HD12  LEU  22          HD12      LEU  22   8.259   2.780   5.200
  185   HD13  LEU  22          HD13      LEU  22   8.257   1.403   4.100
  186   HD21  LEU  22          HD21      LEU  22   8.591   4.941   4.298
  187   HD22  LEU  22          HD22      LEU  22   9.781   5.200   3.024
  188   HD23  LEU  22          HD23      LEU  22  10.287   4.552   4.584
  189    H    ARG  23           H        ARG  23  12.649   0.799   1.153
  190    HA   ARG  23           HA       ARG  23  14.699   0.103   3.027
  191    HB2  ARG  23           HB2      ARG  23  14.094  -0.434   0.131
  192    HB3  ARG  23           HB3      ARG  23  15.626  -0.986   0.810
  193    HG2  ARG  23           HG2      ARG  23  13.454  -1.612   2.616
  194    HG3  ARG  23           HG3      ARG  23  13.116  -2.261   1.012
  195    HD2  ARG  23           HD2      ARG  23  15.012  -3.640   1.023
  196    HD3  ARG  23           HD3      ARG  23  15.852  -2.639   2.224
  197    HE   ARG  23           HE       ARG  23  14.625  -3.736   3.940
  198   HH11  ARG  23          HH11      ARG  23  14.670  -6.199   2.312
  199   HH12  ARG  23          HH12      ARG  23  12.994  -6.620   2.193
  200   HH21  ARG  23          HH21      ARG  23  11.868  -3.472   3.143
  201   HH22  ARG  23          HH22      ARG  23  11.402  -5.072   2.669
  202    HA   PRO  24           HA       PRO  24  17.729   2.587   0.248
  203    HB2  PRO  24           HB2      PRO  24  16.681   4.288  -1.623
  204    HB3  PRO  24           HB3      PRO  24  17.072   2.592  -1.968
  205    HG2  PRO  24           HG2      PRO  24  14.437   3.845  -1.380
  206    HG3  PRO  24           HG3      PRO  24  14.848   2.568  -2.535
  207    HD2  PRO  24           HD2      PRO  24  13.682   2.092  -0.124
  208    HD3  PRO  24           HD3      PRO  24  14.723   0.919  -0.958
  209    H    GLU  25           H        GLU  25  18.203   5.115  -0.014
  210    HA   GLU  25           HA       GLU  25  17.506   6.410   2.459
  211    HB2  GLU  25           HB2      GLU  25  19.267   6.746   0.232
  212    HB3  GLU  25           HB3      GLU  25  18.415   8.271   0.470
  213    HG2  GLU  25           HG2      GLU  25  19.562   6.823   2.842
  214    HG3  GLU  25           HG3      GLU  25  20.615   7.805   1.825
  215    H    ARG  26           H        ARG  26  16.493   8.667   2.500
  216    HA   ARG  26           HA       ARG  26  14.062   8.721   0.740
  217    HB2  ARG  26           HB2      ARG  26  14.657   9.392   3.608
  218    HB3  ARG  26           HB3      ARG  26  13.315  10.200   2.803
  219    HG2  ARG  26           HG2      ARG  26  12.214   8.336   3.624
  220    HG3  ARG  26           HG3      ARG  26  12.716   7.721   2.051
  221    HD2  ARG  26           HD2      ARG  26  13.393   6.014   3.555
  222    HD3  ARG  26           HD3      ARG  26  14.880   6.946   3.311
  223    HE   ARG  26           HE       ARG  26  13.242   6.927   5.760
  224   HH11  ARG  26          HH11      ARG  26  16.354   7.139   4.961
  225   HH12  ARG  26          HH12      ARG  26  16.722   8.622   5.775
  226   HH21  ARG  26          HH21      ARG  26  13.391   9.441   6.349
  227   HH22  ARG  26          HH22      ARG  26  15.038   9.928   6.569
  Start of MODEL    6
    1    HA   ARG   1           HA       ARG   1 -17.683  -1.316  -8.185
    2    HB2  ARG   1           HB2      ARG   1 -16.224   0.546  -7.644
    3    HB3  ARG   1           HB3      ARG   1 -17.192   1.013  -9.041
    4    HG2  ARG   1           HG2      ARG   1 -18.811   1.881  -7.037
    5    HG3  ARG   1           HG3      ARG   1 -17.236   2.073  -6.267
    6    HD2  ARG   1           HD2      ARG   1 -16.637   3.149  -8.662
    7    HD3  ARG   1           HD3      ARG   1 -18.374   3.511  -8.622
    8    HE   ARG   1           HE       ARG   1 -16.388   4.422  -6.589
    9   HH11  ARG   1          HH11      ARG   1 -17.897   6.385  -8.259
   10   HH12  ARG   1          HH12      ARG   1 -19.190   6.853  -7.207
   11   HH21  ARG   1          HH21      ARG   1 -18.774   4.149  -5.062
   12   HH22  ARG   1          HH22      ARG   1 -19.687   5.584  -5.388
   13    H    SER   2           H        SER   2 -16.674  -1.621  -6.023
   14    HA   SER   2           HA       SER   2 -18.717  -1.620  -3.871
   15    HB2  SER   2           HB2      SER   2 -17.143  -3.548  -4.616
   16    HB3  SER   2           HB3      SER   2 -15.885  -2.671  -3.745
   17    HG   SER   2           HG       SER   2 -17.542  -4.338  -2.708
   18    H    ALA   3           H        ALA   3 -17.492  -1.256  -1.572
   19    HA   ALA   3           HA       ALA   3 -16.125   1.414  -1.759
   20    HB1  ALA   3           HB1      ALA   3 -17.251   1.710   0.529
   21    HB2  ALA   3           HB2      ALA   3 -18.157   0.244   0.154
   22    HB3  ALA   3           HB3      ALA   3 -18.326   1.672  -0.867
   23    H    LEU   4           H        LEU   4 -16.417  -1.539   0.273
   24    HA   LEU   4           HA       LEU   4 -13.930  -0.880   1.718
   25    HB2  LEU   4           HB2      LEU   4 -16.115  -2.928   1.828
   26    HB3  LEU   4           HB3      LEU   4 -14.585  -3.294   2.626
   27    HG   LEU   4           HG       LEU   4 -15.673  -0.580   3.128
   28   HD11  LEU   4          HD11      LEU   4 -17.312  -1.363   4.760
   29   HD12  LEU   4          HD12      LEU   4 -16.936  -3.042   4.373
   30   HD13  LEU   4          HD13      LEU   4 -17.716  -2.013   3.172
   31   HD21  LEU   4          HD21      LEU   4 -14.851  -1.091   5.388
   32   HD22  LEU   4          HD22      LEU   4 -13.614  -1.482   4.194
   33   HD23  LEU   4          HD23      LEU   4 -14.573  -2.769   4.924
   34    H    VAL   5           H        VAL   5 -14.081  -1.746  -1.323
   35    HA   VAL   5           HA       VAL   5 -12.213  -4.077  -1.155
   36    HB   VAL   5           HB       VAL   5 -13.888  -2.895  -3.400
   37   HG11  VAL   5          HG11      VAL   5 -12.135  -3.829  -4.602
   38   HG12  VAL   5          HG12      VAL   5 -13.164  -5.247  -4.404
   39   HG13  VAL   5          HG13      VAL   5 -11.769  -5.015  -3.349
   40   HG21  VAL   5          HG21      VAL   5 -14.097  -5.423  -1.736
   41   HG22  VAL   5          HG22      VAL   5 -15.046  -5.133  -3.195
   42   HG23  VAL   5          HG23      VAL   5 -15.247  -4.086  -1.789
   43    H    ASN   6           H        ASN   6 -12.647  -1.070  -3.078
   44    HA   ASN   6           HA       ASN   6  -9.929  -0.979  -4.030
   45    HB2  ASN   6           HB2      ASN   6 -12.187   1.020  -3.758
   46    HB3  ASN   6           HB3      ASN   6 -10.644   1.450  -4.496
   47   HD21  ASN   6          HD21      ASN   6 -13.711   0.184  -5.202
   48   HD22  ASN   6          HD22      ASN   6 -13.344  -0.533  -6.695
   49    H    SER   7           H        SER   7 -11.560   0.546  -1.223
   50    HA   SER   7           HA       SER   7  -9.443   2.238  -0.358
   51    HB2  SER   7           HB2      SER   7 -11.888   1.915   0.482
   52    HB3  SER   7           HB3      SER   7 -11.219   0.644   1.501
   53    HG   SER   7           HG       SER   7  -9.794   2.202   2.372
   54    H    TYR   8           H        TYR   8 -10.168  -1.135   0.651
   55    HA   TYR   8           HA       TYR   8  -7.821  -1.541   2.236
   56    HB2  TYR   8           HB2      TYR   8  -9.607  -3.084   2.462
   57    HB3  TYR   8           HB3      TYR   8  -9.769  -3.287   0.719
   58    HD1  TYR   8           HD1      TYR   8  -7.314  -3.843   3.502
   59    HD2  TYR   8           HD2      TYR   8  -8.779  -5.137  -0.323
   60    HE1  TYR   8           HE1      TYR   8  -5.801  -5.806   3.586
   61    HE2  TYR   8           HE2      TYR   8  -7.267  -7.101  -0.238
   62    HH   TYR   8           HH       TYR   8  -5.901  -8.253   2.426
   63    H    LEU   9           H        LEU   9  -8.495  -2.188  -1.214
   64    HA   LEU   9           HA       LEU   9  -6.012  -3.373  -1.938
   65    HB2  LEU   9           HB2      LEU   9  -8.285  -1.956  -3.238
   66    HB3  LEU   9           HB3      LEU   9  -6.802  -2.056  -4.184
   67    HG   LEU   9           HG       LEU   9  -8.120  -4.443  -2.861
   68   HD11  LEU   9          HD11      LEU   9  -8.176  -3.670  -5.791
   69   HD12  LEU   9          HD12      LEU   9  -9.508  -3.356  -4.676
   70   HD13  LEU   9          HD13      LEU   9  -9.021  -5.016  -5.025
   71   HD21  LEU   9          HD21      LEU   9  -5.869  -5.001  -3.226
   72   HD22  LEU   9          HD22      LEU   9  -5.762  -4.020  -4.687
   73   HD23  LEU   9          HD23      LEU   9  -6.636  -5.552  -4.715
   74    H    TRP  10           H        TRP  10  -6.999   0.059  -1.839
   75    HA   TRP  10           HA       TRP  10  -4.614   1.193  -2.940
   76    HB2  TRP  10           HB2      TRP  10  -6.647   2.465  -2.741
   77    HB3  TRP  10           HB3      TRP  10  -6.743   2.159  -1.010
   78    HD1  TRP  10           HD1      TRP  10  -4.287   3.855  -3.479
   79    HE1  TRP  10           HE1      TRP  10  -3.278   5.920  -2.312
   80    HE3  TRP  10           HE3      TRP  10  -6.483   3.429   1.106
   81    HZ2  TRP  10           HZ2      TRP  10  -3.388   7.216   0.236
   82    HZ3  TRP  10           HZ3      TRP  10  -6.014   5.088   2.885
   83    HH2  TRP  10           HH2      TRP  10  -4.470   6.981   2.455
   84    H    GLN  11           H        GLN  11  -5.560   0.652   0.482
   85    HA   GLN  11           HA       GLN  11  -3.207   1.675   1.702
   86    HB2  GLN  11           HB2      GLN  11  -5.204  -0.481   2.437
   87    HB3  GLN  11           HB3      GLN  11  -3.933   0.035   3.546
   88    HG2  GLN  11           HG2      GLN  11  -4.803   2.214   3.730
   89    HG3  GLN  11           HG3      GLN  11  -5.743   2.063   2.247
   90   HE21  GLN  11          HE21      GLN  11  -5.798   1.538   5.689
   91   HE22  GLN  11          HE22      GLN  11  -7.354   0.867   5.767
   92    H    ARG  12           H        ARG  12  -3.892  -1.545   0.349
   93    HA   ARG  12           HA       ARG  12  -1.456  -2.811   1.266
   94    HB2  ARG  12           HB2      ARG  12  -3.777  -3.681   0.280
   95    HB3  ARG  12           HB3      ARG  12  -2.885  -3.625  -1.240
   96    HG2  ARG  12           HG2      ARG  12  -1.102  -5.024  -0.230
   97    HG3  ARG  12           HG3      ARG  12  -2.038  -5.113   1.263
   98    HD2  ARG  12           HD2      ARG  12  -3.952  -5.937  -0.429
   99    HD3  ARG  12           HD3      ARG  12  -2.534  -6.455  -1.362
  100    HE   ARG  12           HE       ARG  12  -2.573  -7.141   1.527
  101   HH11  ARG  12          HH11      ARG  12  -0.720  -8.434  -0.450
  102   HH12  ARG  12          HH12      ARG  12  -1.498  -9.955  -0.734
  103   HH21  ARG  12          HH21      ARG  12  -4.547  -8.939   0.598
  104   HH22  ARG  12          HH22      ARG  12  -3.674 -10.244  -0.138
  105    H    TRP  13           H        TRP  13  -2.369  -1.075  -1.722
  106    HA   TRP  13           HA       TRP  13  -0.048  -1.641  -3.271
  107    HB2  TRP  13           HB2      TRP  13  -1.281  -0.392  -4.703
  108    HB3  TRP  13           HB3      TRP  13  -2.400  -0.055  -3.391
  109    HD1  TRP  13           HD1      TRP  13  -2.696   2.397  -2.831
  110    HE1  TRP  13           HE1      TRP  13  -1.363   4.564  -3.226
  111    HE3  TRP  13           HE3      TRP  13   1.489   0.470  -5.023
  112    HZ2  TRP  13           HZ2      TRP  13   1.145   5.377  -4.337
  113    HZ3  TRP  13           HZ3      TRP  13   3.332   1.960  -5.746
  114    HH2  TRP  13           HH2      TRP  13   3.165   4.410  -5.405
  115    H    GLU  14           H        GLU  14  -0.665   0.920  -0.862
  116    HA   GLU  14           HA       GLU  14   1.879   2.257  -1.157
  117    HB2  GLU  14           HB2      GLU  14  -0.083   2.031   1.152
  118    HB3  GLU  14           HB3      GLU  14   1.228   3.208   1.066
  119    HG2  GLU  14           HG2      GLU  14   0.271   4.237  -0.896
  120    HG3  GLU  14           HG3      GLU  14  -0.940   2.962  -1.033
  121    H    ASN  15           H        ASN  15   0.682  -0.183   1.178
  122    HA   ASN  15           HA       ASN  15   3.048  -0.527   2.702
  123    HB2  ASN  15           HB2      ASN  15   1.087  -1.542   3.512
  124    HB3  ASN  15           HB3      ASN  15   0.679  -2.226   1.940
  125   HD21  ASN  15          HD21      ASN  15   3.751  -2.438   3.839
  126   HD22  ASN  15          HD22      ASN  15   3.771  -4.135   3.879
  127    H    TRP  16           H        TRP  16   1.971  -2.313  -0.224
  128    HA   TRP  16           HA       TRP  16   4.299  -3.967  -0.481
  129    HB2  TRP  16           HB2      TRP  16   2.437  -4.630  -1.742
  130    HB3  TRP  16           HB3      TRP  16   2.075  -2.982  -2.254
  131    HD1  TRP  16           HD1      TRP  16   4.594  -5.817  -2.927
  132    HE1  TRP  16           HE1      TRP  16   5.576  -5.490  -5.287
  133    HE3  TRP  16           HE3      TRP  16   2.450  -1.350  -4.168
  134    HZ2  TRP  16           HZ2      TRP  16   5.468  -3.586  -7.419
  135    HZ3  TRP  16           HZ3      TRP  16   2.908  -0.304  -6.366
  136    HH2  TRP  16           HH2      TRP  16   4.413  -1.416  -7.992
  137    H    PHE  17           H        PHE  17   3.458  -0.823  -1.982
  138    HA   PHE  17           HA       PHE  17   5.805  -0.448  -3.536
  139    HB2  PHE  17           HB2      PHE  17   3.713   0.890  -3.636
  140    HB3  PHE  17           HB3      PHE  17   4.089   1.576  -2.056
  141    HD1  PHE  17           HD1      PHE  17   5.533   1.158  -5.489
  142    HD2  PHE  17           HD2      PHE  17   5.389   3.522  -1.905
  143    HE1  PHE  17           HE1      PHE  17   6.939   2.888  -6.574
  144    HE2  PHE  17           HE2      PHE  17   6.795   5.251  -2.990
  145    HZ   PHE  17           HZ       PHE  17   7.570   4.935  -5.325
  146    H    TRP  18           H        TRP  18   5.101   0.718  -0.213
  147    HA   TRP  18           HA       TRP  18   7.700   1.823   0.275
  148    HB2  TRP  18           HB2      TRP  18   5.499   0.751   2.061
  149    HB3  TRP  18           HB3      TRP  18   6.915   1.592   2.687
  150    HD1  TRP  18           HD1      TRP  18   3.678   2.529   2.491
  151    HE1  TRP  18           HE1      TRP  18   3.249   4.914   1.625
  152    HE3  TRP  18           HE3      TRP  18   8.137   3.455   0.164
  153    HZ2  TRP  18           HZ2      TRP  18   4.605   6.945   0.146
  154    HZ3  TRP  18           HZ3      TRP  18   8.536   5.621  -0.963
  155    HH2  TRP  18           HH2      TRP  18   6.778   7.368  -0.975
  156    H    ASN  19           H        ASN  19   6.441  -1.477   0.562
  157    HA   ASN  19           HA       ASN  19   8.621  -2.532   2.149
  158    HB2  ASN  19           HB2      ASN  19   6.189  -3.412   0.902
  159    HB3  ASN  19           HB3      ASN  19   7.479  -4.524   0.450
  160   HD21  ASN  19          HD21      ASN  19   8.685  -5.592   2.247
  161   HD22  ASN  19          HD22      ASN  19   7.966  -5.732   3.779
  162    H    VAL  20           H        VAL  20   8.032  -2.345  -1.383
  163    HA   VAL  20           HA       VAL  20  10.632  -3.641  -1.947
  164    HB   VAL  20           HB       VAL  20   9.890  -3.463  -4.285
  165   HG11  VAL  20          HG11      VAL  20   8.963  -5.256  -2.769
  166   HG12  VAL  20          HG12      VAL  20   7.935  -4.866  -4.147
  167   HG13  VAL  20          HG13      VAL  20   7.537  -4.244  -2.546
  168   HG21  VAL  20          HG21      VAL  20   7.533  -1.905  -3.172
  169   HG22  VAL  20          HG22      VAL  20   7.756  -2.387  -4.853
  170   HG23  VAL  20          HG23      VAL  20   8.849  -1.214  -4.121
  171    H    THR  21           H        THR  21   9.277  -0.384  -1.847
  172    HA   THR  21           HA       THR  21  11.535   0.816  -3.299
  173    HB   THR  21           HB       THR  21   9.239   2.004  -1.707
  174    HG1  THR  21           HG1      THR  21   8.274   1.115  -3.384
  175   HG21  THR  21          HG21      THR  21   9.756   4.003  -3.221
  176   HG22  THR  21          HG22      THR  21  11.293   3.207  -3.567
  177   HG23  THR  21          HG23      THR  21  10.902   3.693  -1.916
  178    H    LEU  22           H        LEU  22  10.328   0.864   0.070
  179    HA   LEU  22           HA       LEU  22  12.821   2.166   0.991
  180    HB2  LEU  22           HB2      LEU  22  10.366   1.183   2.483
  181    HB3  LEU  22           HB3      LEU  22  11.628   2.212   3.153
  182    HG   LEU  22           HG       LEU  22   9.996   2.989   0.724
  183   HD11  LEU  22          HD11      LEU  22   9.543   3.589   3.660
  184   HD12  LEU  22          HD12      LEU  22   8.441   2.759   2.562
  185   HD13  LEU  22          HD13      LEU  22   8.769   4.479   2.348
  186   HD21  LEU  22          HD21      LEU  22  12.046   4.230   0.874
  187   HD22  LEU  22          HD22      LEU  22  11.867   4.441   2.616
  188   HD23  LEU  22          HD23      LEU  22  10.786   5.288   1.509
  189    H    ARG  23           H        ARG  23  11.087  -0.907   1.454
  190    HA   ARG  23           HA       ARG  23  11.809  -2.994   2.288
  191    HB2  ARG  23           HB2      ARG  23  13.351  -2.170   0.212
  192    HB3  ARG  23           HB3      ARG  23  14.593  -2.370   1.447
  193    HG2  ARG  23           HG2      ARG  23  14.432  -4.625   1.391
  194    HG3  ARG  23           HG3      ARG  23  12.668  -4.578   1.415
  195    HD2  ARG  23           HD2      ARG  23  12.505  -4.465  -0.920
  196    HD3  ARG  23           HD3      ARG  23  14.144  -3.808  -1.099
  197    HE   ARG  23           HE       ARG  23  15.041  -6.025  -0.624
  198   HH11  ARG  23          HH11      ARG  23  12.894  -6.510  -2.745
  199   HH12  ARG  23          HH12      ARG  23  12.088  -7.896  -2.092
  200   HH21  ARG  23          HH21      ARG  23  13.451  -7.515   1.085
  201   HH22  ARG  23          HH22      ARG  23  12.406  -8.469   0.086
  202    HA   PRO  24           HA       PRO  24  13.829  -0.919   5.967
  203    HB2  PRO  24           HB2      PRO  24  11.834  -1.467   7.761
  204    HB3  PRO  24           HB3      PRO  24  11.864   0.002   6.764
  205    HG2  PRO  24           HG2      PRO  24  10.314  -2.511   6.386
  206    HG3  PRO  24           HG3      PRO  24   9.826  -0.831   6.111
  207    HD2  PRO  24           HD2      PRO  24  10.555  -2.528   4.108
  208    HD3  PRO  24           HD3      PRO  24  10.756  -0.765   4.022
  209    H    GLU  25           H        GLU  25  14.541  -2.066   7.968
  210    HA   GLU  25           HA       GLU  25  14.570  -5.034   7.568
  211    HB2  GLU  25           HB2      GLU  25  16.697  -4.899   8.852
  212    HB3  GLU  25           HB3      GLU  25  16.732  -3.869   7.423
  213    HG2  GLU  25           HG2      GLU  25  16.288  -1.895   8.759
  214    HG3  GLU  25           HG3      GLU  25  16.023  -2.876  10.201
  215    H    ARG  26           H        ARG  26  12.307  -3.862   8.841
  216    HA   ARG  26           HA       ARG  26  10.982  -4.075  10.773
  217    HB2  ARG  26           HB2      ARG  26  13.013  -6.274  10.839
  218    HB3  ARG  26           HB3      ARG  26  11.999  -6.051  12.262
  219    HG2  ARG  26           HG2      ARG  26  10.735  -6.110   9.535
  220    HG3  ARG  26           HG3      ARG  26  11.174  -7.623  10.328
  221    HD2  ARG  26           HD2      ARG  26   9.154  -7.462  11.374
  222    HD3  ARG  26           HD3      ARG  26   9.906  -6.190  12.356
  223    HE   ARG  26           HE       ARG  26   9.137  -4.569  10.562
  224   HH11  ARG  26          HH11      ARG  26   8.211  -6.632   8.587
  225   HH12  ARG  26          HH12      ARG  26   6.499  -6.640   8.850
  226   HH21  ARG  26          HH21      ARG  26   6.701  -5.016  11.918
  227   HH22  ARG  26          HH22      ARG  26   5.640  -5.722  10.745
  Start of MODEL    7
    1    HA   ARG   1           HA       ARG   1 -16.788  -3.620  -3.985
    2    HB2  ARG   1           HB2      ARG   1 -16.098  -1.990  -5.638
    3    HB3  ARG   1           HB3      ARG   1 -16.821  -3.345  -6.500
    4    HG2  ARG   1           HG2      ARG   1 -18.120  -1.803  -7.527
    5    HG3  ARG   1           HG3      ARG   1 -18.997  -1.692  -6.001
    6    HD2  ARG   1           HD2      ARG   1 -17.029  -0.011  -5.370
    7    HD3  ARG   1           HD3      ARG   1 -16.933   0.165  -7.134
    8    HE   ARG   1           HE       ARG   1 -19.424   0.643  -5.539
    9   HH11  ARG   1          HH11      ARG   1 -17.855   2.941  -6.701
   10   HH12  ARG   1          HH12      ARG   1 -18.713   3.250  -8.173
   11   HH21  ARG   1          HH21      ARG   1 -20.370   0.193  -8.152
   12   HH22  ARG   1          HH22      ARG   1 -20.144   1.686  -8.997
   13    H    SER   2           H        SER   2 -16.371  -1.813  -2.622
   14    HA   SER   2           HA       SER   2 -18.515   0.220  -2.266
   15    HB2  SER   2           HB2      SER   2 -18.981  -1.803  -0.838
   16    HB3  SER   2           HB3      SER   2 -17.441  -1.529  -0.029
   17    HG   SER   2           HG       SER   2 -19.656  -0.519   0.700
   18    H    ALA   3           H        ALA   3 -17.735   1.815  -0.450
   19    HA   ALA   3           HA       ALA   3 -15.215   2.960  -1.206
   20    HB1  ALA   3           HB1      ALA   3 -17.137   4.187  -0.251
   21    HB2  ALA   3           HB2      ALA   3 -15.688   4.450   0.720
   22    HB3  ALA   3           HB3      ALA   3 -16.930   3.327   1.275
   23    H    LEU   4           H        LEU   4 -16.118   0.709   1.380
   24    HA   LEU   4           HA       LEU   4 -13.612   0.920   2.842
   25    HB2  LEU   4           HB2      LEU   4 -16.116  -0.665   2.865
   26    HB3  LEU   4           HB3      LEU   4 -14.708  -1.496   3.520
   27    HG   LEU   4           HG       LEU   4 -15.943  -0.256   5.277
   28   HD11  LEU   4          HD11      LEU   4 -14.035   0.558   6.341
   29   HD12  LEU   4          HD12      LEU   4 -13.376   1.244   4.857
   30   HD13  LEU   4          HD13      LEU   4 -13.331  -0.500   5.119
   31   HD21  LEU   4          HD21      LEU   4 -15.082   2.257   3.820
   32   HD22  LEU   4          HD22      LEU   4 -16.121   2.138   5.240
   33   HD23  LEU   4          HD23      LEU   4 -16.701   1.573   3.675
   34    H    VAL   5           H        VAL   5 -14.833  -1.137   0.243
   35    HA   VAL   5           HA       VAL   5 -12.759  -3.128   0.283
   36    HB   VAL   5           HB       VAL   5 -14.565  -2.060  -1.915
   37   HG11  VAL   5          HG11      VAL   5 -12.826  -4.540  -1.798
   38   HG12  VAL   5          HG12      VAL   5 -12.720  -3.220  -2.963
   39   HG13  VAL   5          HG13      VAL   5 -14.113  -4.302  -2.980
   40   HG21  VAL   5          HG21      VAL   5 -14.769  -4.472  -0.080
   41   HG22  VAL   5          HG22      VAL   5 -15.894  -4.094  -1.384
   42   HG23  VAL   5          HG23      VAL   5 -15.765  -3.019   0.008
   43    H    ASN   6           H        ASN   6 -13.144  -0.177  -1.738
   44    HA   ASN   6           HA       ASN   6 -10.652  -0.414  -3.134
   45    HB2  ASN   6           HB2      ASN   6 -12.868   1.210  -3.193
   46    HB3  ASN   6           HB3      ASN   6 -11.649   2.306  -2.543
   47   HD21  ASN   6          HD21      ASN   6 -12.961   1.405  -5.437
   48   HD22  ASN   6          HD22      ASN   6 -11.624   1.649  -6.453
   49    H    SER   7           H        SER   7 -11.478   1.146  -0.022
   50    HA   SER   7           HA       SER   7  -9.028   2.527   0.440
   51    HB2  SER   7           HB2      SER   7 -11.269   2.530   1.725
   52    HB3  SER   7           HB3      SER   7 -10.668   1.089   2.542
   53    HG   SER   7           HG       SER   7  -8.842   2.336   3.178
   54    H    TYR   8           H        TYR   8  -9.989  -0.813   1.302
   55    HA   TYR   8           HA       TYR   8  -7.465  -1.562   2.490
   56    HB2  TYR   8           HB2      TYR   8  -9.390  -2.842   3.032
   57    HB3  TYR   8           HB3      TYR   8  -9.880  -2.977   1.345
   58    HD1  TYR   8           HD1      TYR   8  -6.981  -3.872   3.563
   59    HD2  TYR   8           HD2      TYR   8  -9.457  -4.979   0.232
   60    HE1  TYR   8           HE1      TYR   8  -5.776  -6.031   3.385
   61    HE2  TYR   8           HE2      TYR   8  -8.251  -7.139   0.055
   62    HH   TYR   8           HH       TYR   8  -6.562  -8.492   2.326
   63    H    LEU   9           H        LEU   9  -8.861  -1.974  -0.773
   64    HA   LEU   9           HA       LEU   9  -6.725  -3.442  -1.960
   65    HB2  LEU   9           HB2      LEU   9  -9.116  -1.935  -2.734
   66    HB3  LEU   9           HB3      LEU   9  -7.845  -1.834  -3.948
   67    HG   LEU   9           HG       LEU   9  -9.291  -3.776  -4.378
   68   HD11  LEU   9          HD11      LEU   9  -6.691  -4.846  -3.282
   69   HD12  LEU   9          HD12      LEU   9  -6.730  -3.817  -4.714
   70   HD13  LEU   9          HD13      LEU   9  -7.573  -5.365  -4.717
   71   HD21  LEU   9          HD21      LEU   9 -10.140  -4.315  -2.217
   72   HD22  LEU   9          HD22      LEU   9  -8.521  -4.486  -1.542
   73   HD23  LEU   9          HD23      LEU   9  -9.133  -5.687  -2.677
   74    H    TRP  10           H        TRP  10  -7.309   0.085  -1.793
   75    HA   TRP  10           HA       TRP  10  -5.030   0.923  -3.297
   76    HB2  TRP  10           HB2      TRP  10  -6.707   2.525  -2.874
   77    HB3  TRP  10           HB3      TRP  10  -6.807   2.105  -1.165
   78    HD1  TRP  10           HD1      TRP  10  -4.336   3.760  -3.633
   79    HE1  TRP  10           HE1      TRP  10  -2.937   5.492  -2.332
   80    HE3  TRP  10           HE3      TRP  10  -6.107   2.952   1.084
   81    HZ2  TRP  10           HZ2      TRP  10  -2.615   6.411   0.358
   82    HZ3  TRP  10           HZ3      TRP  10  -5.237   4.266   2.996
   83    HH2  TRP  10           HH2      TRP  10  -3.495   5.993   2.640
   84    H    GLN  11           H        GLN  11  -5.426   0.255   0.197
   85    HA   GLN  11           HA       GLN  11  -2.890   1.133   1.117
   86    HB2  GLN  11           HB2      GLN  11  -4.849  -1.012   1.941
   87    HB3  GLN  11           HB3      GLN  11  -3.349  -0.777   2.839
   88    HG2  GLN  11           HG2      GLN  11  -4.583   1.782   2.361
   89    HG3  GLN  11           HG3      GLN  11  -5.762   0.695   3.092
   90   HE21  GLN  11          HE21      GLN  11  -4.518  -0.759   4.949
   91   HE22  GLN  11          HE22      GLN  11  -3.627   0.184   6.042
   92    H    ARG  12           H        ARG  12  -3.860  -2.076  -0.150
   93    HA   ARG  12           HA       ARG  12  -1.431  -3.485   0.168
   94    HB2  ARG  12           HB2      ARG  12  -3.595  -3.524  -1.953
   95    HB3  ARG  12           HB3      ARG  12  -2.316  -4.734  -1.883
   96    HG2  ARG  12           HG2      ARG  12  -3.115  -5.674   0.076
   97    HG3  ARG  12           HG3      ARG  12  -3.849  -4.167   0.623
   98    HD2  ARG  12           HD2      ARG  12  -5.703  -5.529   0.001
   99    HD3  ARG  12           HD3      ARG  12  -5.463  -4.467  -1.397
  100    HE   ARG  12           HE       ARG  12  -4.353  -6.303  -2.555
  101   HH11  ARG  12          HH11      ARG  12  -3.248  -7.719  -0.139
  102   HH12  ARG  12          HH12      ARG  12  -4.244  -9.135  -0.064
  103   HH21  ARG  12          HH21      ARG  12  -6.682  -7.849  -2.183
  104   HH22  ARG  12          HH22      ARG  12  -6.195  -9.208  -1.227
  105    H    TRP  13           H        TRP  13  -2.452  -1.335  -2.491
  106    HA   TRP  13           HA       TRP  13  -0.315  -1.681  -4.300
  107    HB2  TRP  13           HB2      TRP  13  -2.542  -0.062  -3.985
  108    HB3  TRP  13           HB3      TRP  13  -1.218   1.095  -3.890
  109    HD1  TRP  13           HD1      TRP  13  -3.265   0.903  -6.324
  110    HE1  TRP  13           HE1      TRP  13  -2.346   0.525  -8.707
  111    HE3  TRP  13           HE3      TRP  13   1.302  -1.077  -5.203
  112    HZ2  TRP  13           HZ2      TRP  13   0.016  -0.483  -9.963
  113    HZ3  TRP  13           HZ3      TRP  13   2.866  -1.736  -7.005
  114    HH2  TRP  13           HH2      TRP  13   2.231  -1.440  -9.382
  115    H    GLU  14           H        GLU  14  -0.585   0.925  -1.860
  116    HA   GLU  14           HA       GLU  14   2.165   1.755  -2.096
  117    HB2  GLU  14           HB2      GLU  14   0.040   2.155   0.033
  118    HB3  GLU  14           HB3      GLU  14   1.548   3.065  -0.055
  119    HG2  GLU  14           HG2      GLU  14   0.675   3.372  -2.606
  120    HG3  GLU  14           HG3      GLU  14  -0.873   3.252  -1.767
  121    H    ASN  15           H        ASN  15   0.501  -0.585  -0.006
  122    HA   ASN  15           HA       ASN  15   2.410  -0.968   2.038
  123    HB2  ASN  15           HB2      ASN  15   0.061  -2.097   1.342
  124    HB3  ASN  15           HB3      ASN  15   1.149  -3.363   0.774
  125   HD21  ASN  15          HD21      ASN  15   3.177  -3.335   2.714
  126   HD22  ASN  15          HD22      ASN  15   2.518  -3.700   4.234
  127    H    TRP  16           H        TRP  16   2.316  -2.403  -1.243
  128    HA   TRP  16           HA       TRP  16   4.737  -3.963  -0.944
  129    HB2  TRP  16           HB2      TRP  16   3.293  -4.631  -2.681
  130    HB3  TRP  16           HB3      TRP  16   2.992  -2.971  -3.195
  131    HD1  TRP  16           HD1      TRP  16   5.683  -5.705  -3.347
  132    HE1  TRP  16           HE1      TRP  16   7.281  -5.178  -5.300
  133    HE3  TRP  16           HE3      TRP  16   3.877  -1.141  -4.760
  134    HZ2  TRP  16           HZ2      TRP  16   7.733  -3.097  -7.208
  135    HZ3  TRP  16           HZ3      TRP  16   4.910   0.091  -6.646
  136    HH2  TRP  16           HH2      TRP  16   6.834  -0.881  -7.872
  137    H    PHE  17           H        PHE  17   4.035  -0.781  -2.431
  138    HA   PHE  17           HA       PHE  17   6.654  -0.114  -3.292
  139    HB2  PHE  17           HB2      PHE  17   4.511   1.065  -3.822
  140    HB3  PHE  17           HB3      PHE  17   4.472   1.681  -2.170
  141    HD1  PHE  17           HD1      PHE  17   6.682   1.551  -5.194
  142    HD2  PHE  17           HD2      PHE  17   5.545   3.700  -1.653
  143    HE1  PHE  17           HE1      PHE  17   8.161   3.427  -5.858
  144    HE2  PHE  17           HE2      PHE  17   7.024   5.577  -2.318
  145    HZ   PHE  17           HZ       PHE  17   8.333   5.440  -4.419
  146    H    TRP  18           H        TRP  18   5.031   0.738  -0.202
  147    HA   TRP  18           HA       TRP  18   7.320   1.960   1.018
  148    HB2  TRP  18           HB2      TRP  18   4.866   0.573   2.145
  149    HB3  TRP  18           HB3      TRP  18   5.976   1.542   3.113
  150    HD1  TRP  18           HD1      TRP  18   2.788   2.093   2.134
  151    HE1  TRP  18           HE1      TRP  18   2.283   4.456   1.241
  152    HE3  TRP  18           HE3      TRP  18   7.527   3.664   1.031
  153    HZ2  TRP  18           HZ2      TRP  18   3.694   6.710   0.200
  154    HZ3  TRP  18           HZ3      TRP  18   7.914   5.920   0.093
  155    HH2  TRP  18           HH2      TRP  18   6.006   7.446  -0.324
  156    H    ASN  19           H        ASN  19   6.233  -1.414   0.848
  157    HA   ASN  19           HA       ASN  19   7.985  -2.505   2.839
  158    HB2  ASN  19           HB2      ASN  19   6.319  -3.435   0.569
  159    HB3  ASN  19           HB3      ASN  19   7.625  -4.522   1.034
  160   HD21  ASN  19          HD21      ASN  19   5.672  -5.931   1.733
  161   HD22  ASN  19          HD22      ASN  19   5.057  -5.684   3.296
  162    H    VAL  20           H        VAL  20   8.441  -1.982  -0.681
  163    HA   VAL  20           HA       VAL  20  11.224  -3.005  -0.487
  164    HB   VAL  20           HB       VAL  20  11.156  -2.737  -2.964
  165   HG11  VAL  20          HG11      VAL  20  10.416  -4.849  -2.098
  166   HG12  VAL  20          HG12      VAL  20   9.262  -4.379  -3.345
  167   HG13  VAL  20          HG13      VAL  20   8.848  -4.183  -1.641
  168   HG21  VAL  20          HG21      VAL  20   9.134  -0.883  -2.416
  169   HG22  VAL  20          HG22      VAL  20   8.282  -2.251  -3.130
  170   HG23  VAL  20          HG23      VAL  20   9.599  -1.476  -4.009
  171    H    THR  21           H        THR  21   9.553   0.060  -0.503
  172    HA   THR  21           HA       THR  21  11.966   1.559  -1.348
  173    HB   THR  21           HB       THR  21   9.176   2.401  -0.494
  174    HG1  THR  21           HG1      THR  21   8.912   1.534  -2.424
  175   HG21  THR  21          HG21      THR  21   9.959   4.532  -1.785
  176   HG22  THR  21          HG22      THR  21  11.583   3.941  -1.434
  177   HG23  THR  21          HG23      THR  21  10.475   4.313  -0.112
  178    H    LEU  22           H        LEU  22   9.796   1.483   1.494
  179    HA   LEU  22           HA       LEU  22  11.752   2.933   3.143
  180    HB2  LEU  22           HB2      LEU  22   9.072   1.625   3.703
  181    HB3  LEU  22           HB3      LEU  22   9.965   2.584   4.881
  182    HG   LEU  22           HG       LEU  22   9.168   3.647   2.160
  183   HD11  LEU  22          HD11      LEU  22   7.346   4.827   3.374
  184   HD12  LEU  22          HD12      LEU  22   7.753   3.920   4.830
  185   HD13  LEU  22          HD13      LEU  22   7.138   3.077   3.409
  186   HD21  LEU  22          HD21      LEU  22  10.279   4.834   4.709
  187   HD22  LEU  22          HD22      LEU  22   9.463   5.832   3.505
  188   HD23  LEU  22          HD23      LEU  22  10.931   4.952   3.075
  189    H    ARG  23           H        ARG  23  11.071  -0.363   2.377
  190    HA   ARG  23           HA       ARG  23  11.859  -2.409   3.243
  191    HB2  ARG  23           HB2      ARG  23  13.996  -0.352   3.784
  192    HB3  ARG  23           HB3      ARG  23  14.239  -2.028   4.275
  193    HG2  ARG  23           HG2      ARG  23  14.531  -2.739   2.140
  194    HG3  ARG  23           HG3      ARG  23  13.211  -1.738   1.532
  195    HD2  ARG  23           HD2      ARG  23  14.618  -0.040   0.939
  196    HD3  ARG  23           HD3      ARG  23  15.584  -0.207   2.420
  197    HE   ARG  23           HE       ARG  23  15.907  -1.899  -0.025
  198   HH11  ARG  23          HH11      ARG  23  18.081  -0.042   0.849
  199   HH12  ARG  23          HH12      ARG  23  19.135  -1.094   1.733
  200   HH21  ARG  23          HH21      ARG  23  16.758  -3.608   2.081
  201   HH22  ARG  23          HH22      ARG  23  18.383  -3.122   2.433
  202    HA   PRO  24           HA       PRO  24  10.565  -1.161   7.592
  203    HB2  PRO  24           HB2      PRO  24   8.073  -2.289   7.571
  204    HB3  PRO  24           HB3      PRO  24   8.380  -0.615   7.065
  205    HG2  PRO  24           HG2      PRO  24   7.961  -3.047   5.406
  206    HG3  PRO  24           HG3      PRO  24   7.413  -1.386   5.135
  207    HD2  PRO  24           HD2      PRO  24   9.558  -2.505   3.864
  208    HD3  PRO  24           HD3      PRO  24   9.375  -0.762   4.152
  209    H    GLU  25           H        GLU  25  10.416  -2.685   9.367
  210    HA   GLU  25           HA       GLU  25  11.399  -5.395   8.695
  211    HB2  GLU  25           HB2      GLU  25  12.055  -3.581  10.591
  212    HB3  GLU  25           HB3      GLU  25  10.867  -4.521  11.494
  213    HG2  GLU  25           HG2      GLU  25  12.515  -6.007  11.903
  214    HG3  GLU  25           HG3      GLU  25  12.422  -6.449  10.199
  215    H    ARG  26           H        ARG  26  10.309  -7.323   9.362
  216    HA   ARG  26           HA       ARG  26   7.639  -7.130  10.620
  217    HB2  ARG  26           HB2      ARG  26   6.553  -8.217   8.671
  218    HB3  ARG  26           HB3      ARG  26   7.252  -6.661   8.230
  219    HG2  ARG  26           HG2      ARG  26   9.020  -7.639   7.046
  220    HG3  ARG  26           HG3      ARG  26   8.880  -9.172   7.908
  221    HD2  ARG  26           HD2      ARG  26   6.524  -8.296   6.280
  222    HD3  ARG  26           HD3      ARG  26   7.945  -8.912   5.415
  223    HE   ARG  26           HE       ARG  26   7.740 -11.007   6.665
  224   HH11  ARG  26          HH11      ARG  26   4.995 -10.705   5.515
  225   HH12  ARG  26          HH12      ARG  26   3.986 -10.953   6.900
  226   HH21  ARG  26          HH21      ARG  26   6.556 -10.447   9.189
  227   HH22  ARG  26          HH22      ARG  26   4.873 -10.806   8.989
  Start of MODEL    8
    1    HA   ARG   1           HA       ARG   1 -19.519   1.432  -5.828
    2    HB2  ARG   1           HB2      ARG   1 -20.778  -0.625  -6.536
    3    HB3  ARG   1           HB3      ARG   1 -19.956   0.176  -7.873
    4    HG2  ARG   1           HG2      ARG   1 -18.447  -1.533  -8.153
    5    HG3  ARG   1           HG3      ARG   1 -18.405  -1.919  -6.433
    6    HD2  ARG   1           HD2      ARG   1 -21.027  -2.424  -7.701
    7    HD3  ARG   1           HD3      ARG   1 -19.708  -3.444  -8.311
    8    HE   ARG   1           HE       ARG   1 -20.673  -3.364  -5.511
    9   HH11  ARG   1          HH11      ARG   1 -20.145  -5.804  -7.334
   10   HH12  ARG   1          HH12      ARG   1 -18.728  -6.456  -6.584
   11   HH21  ARG   1          HH21      ARG   1 -18.057  -3.587  -4.741
   12   HH22  ARG   1          HH22      ARG   1 -17.543  -5.199  -5.109
   13    H    SER   2           H        SER   2 -17.351   0.889  -4.053
   14    HA   SER   2           HA       SER   2 -18.732  -0.646  -1.978
   15    HB2  SER   2           HB2      SER   2 -16.582  -1.793  -3.680
   16    HB3  SER   2           HB3      SER   2 -16.431  -2.093  -1.953
   17    HG   SER   2           HG       SER   2 -18.930  -2.450  -3.185
   18    H    ALA   3           H        ALA   3 -17.783  -0.272   0.091
   19    HA   ALA   3           HA       ALA   3 -15.848   1.982   0.175
   20    HB1  ALA   3           HB1      ALA   3 -17.944   2.136   1.422
   21    HB2  ALA   3           HB2      ALA   3 -16.601   2.043   2.561
   22    HB3  ALA   3           HB3      ALA   3 -17.594   0.619   2.250
   23    H    LEU   4           H        LEU   4 -16.051  -1.453   0.989
   24    HA   LEU   4           HA       LEU   4 -13.340  -1.296   2.262
   25    HB2  LEU   4           HB2      LEU   4 -15.780  -3.011   2.561
   26    HB3  LEU   4           HB3      LEU   4 -14.211  -3.725   2.935
   27    HG   LEU   4           HG       LEU   4 -14.158  -1.186   4.139
   28   HD11  LEU   4          HD11      LEU   4 -16.592  -1.028   3.876
   29   HD12  LEU   4          HD12      LEU   4 -16.183  -1.252   5.576
   30   HD13  LEU   4          HD13      LEU   4 -16.794  -2.610   4.631
   31   HD21  LEU   4          HD21      LEU   4 -14.674  -3.962   5.252
   32   HD22  LEU   4          HD22      LEU   4 -14.269  -2.564   6.246
   33   HD23  LEU   4          HD23      LEU   4 -13.109  -3.170   5.064
   34    H    VAL   5           H        VAL   5 -14.142  -1.523  -0.745
   35    HA   VAL   5           HA       VAL   5 -12.701  -4.085  -1.345
   36    HB   VAL   5           HB       VAL   5 -14.727  -2.404  -2.849
   37   HG11  VAL   5          HG11      VAL   5 -13.086  -4.759  -3.835
   38   HG12  VAL   5          HG12      VAL   5 -13.080  -3.122  -4.490
   39   HG13  VAL   5          HG13      VAL   5 -14.515  -4.134  -4.658
   40   HG21  VAL   5          HG21      VAL   5 -15.641  -3.953  -1.190
   41   HG22  VAL   5          HG22      VAL   5 -14.680  -5.273  -1.857
   42   HG23  VAL   5          HG23      VAL   5 -15.984  -4.563  -2.808
   43    H    ASN   6           H        ASN   6 -12.857  -0.605  -2.088
   44    HA   ASN   6           HA       ASN   6 -10.373  -0.813  -3.719
   45    HB2  ASN   6           HB2      ASN   6 -12.675   0.545  -4.107
   46    HB3  ASN   6           HB3      ASN   6 -11.773   1.770  -3.213
   47   HD21  ASN   6          HD21      ASN   6 -11.784  -0.161  -6.200
   48   HD22  ASN   6          HD22      ASN   6 -10.600   0.757  -6.996
   49    H    SER   7           H        SER   7 -11.643   0.668  -0.742
   50    HA   SER   7           HA       SER   7  -9.449   2.316  -0.033
   51    HB2  SER   7           HB2      SER   7 -11.416   0.697   1.615
   52    HB3  SER   7           HB3      SER   7 -10.375   1.948   2.287
   53    HG   SER   7           HG       SER   7 -11.758   3.351   1.573
   54    H    TYR   8           H        TYR   8 -10.069  -1.085   0.998
   55    HA   TYR   8           HA       TYR   8  -7.537  -1.383   2.338
   56    HB2  TYR   8           HB2      TYR   8  -8.390  -3.453   2.851
   57    HB3  TYR   8           HB3      TYR   8  -9.881  -2.734   2.260
   58    HD1  TYR   8           HD1      TYR   8 -10.720  -3.264  -0.015
   59    HD2  TYR   8           HD2      TYR   8  -7.224  -5.165   1.602
   60    HE1  TYR   8           HE1      TYR   8 -10.876  -5.031  -1.748
   61    HE2  TYR   8           HE2      TYR   8  -7.379  -6.928  -0.133
   62    HH   TYR   8           HH       TYR   8  -9.962  -7.649  -1.792
   63    H    LEU   9           H        LEU   9  -8.518  -1.735  -1.022
   64    HA   LEU   9           HA       LEU   9  -6.207  -3.232  -1.934
   65    HB2  LEU   9           HB2      LEU   9  -8.656  -2.323  -2.927
   66    HB3  LEU   9           HB3      LEU   9  -7.469  -1.406  -3.849
   67    HG   LEU   9           HG       LEU   9  -6.387  -3.415  -4.614
   68   HD11  LEU   9          HD11      LEU   9  -7.717  -4.558  -2.278
   69   HD12  LEU   9          HD12      LEU   9  -6.309  -5.147  -3.161
   70   HD13  LEU   9          HD13      LEU   9  -7.933  -5.557  -3.715
   71   HD21  LEU   9          HD21      LEU   9  -8.314  -4.599  -5.717
   72   HD22  LEU   9          HD22      LEU   9  -8.377  -2.844  -5.880
   73   HD23  LEU   9          HD23      LEU   9  -9.409  -3.659  -4.702
   74    H    TRP  10           H        TRP  10  -7.027   0.242  -1.762
   75    HA   TRP  10           HA       TRP  10  -4.700   1.278  -3.059
   76    HB2  TRP  10           HB2      TRP  10  -6.533   2.735  -2.668
   77    HB3  TRP  10           HB3      TRP  10  -6.644   2.277  -0.969
   78    HD1  TRP  10           HD1      TRP  10  -4.173   4.082  -3.336
   79    HE1  TRP  10           HE1      TRP  10  -2.933   5.889  -1.978
   80    HE3  TRP  10           HE3      TRP  10  -6.119   3.188   1.297
   81    HZ2  TRP  10           HZ2      TRP  10  -2.788   6.828   0.719
   82    HZ3  TRP  10           HZ3      TRP  10  -5.413   4.552   3.242
   83    HH2  TRP  10           HH2      TRP  10  -3.750   6.369   2.958
   84    H    GLN  11           H        GLN  11  -5.344   0.642   0.414
   85    HA   GLN  11           HA       GLN  11  -2.806   1.466   1.424
   86    HB2  GLN  11           HB2      GLN  11  -5.166  -0.060   2.271
   87    HB3  GLN  11           HB3      GLN  11  -3.682  -0.630   3.036
   88    HG2  GLN  11           HG2      GLN  11  -3.255   1.433   4.053
   89    HG3  GLN  11           HG3      GLN  11  -4.257   2.319   2.903
   90   HE21  GLN  11          HE21      GLN  11  -4.421   0.114   5.717
   91   HE22  GLN  11          HE22      GLN  11  -6.021   0.503   6.126
   92    H    ARG  12           H        ARG  12  -3.900  -1.639   0.072
   93    HA   ARG  12           HA       ARG  12  -1.586  -3.205   0.710
   94    HB2  ARG  12           HB2      ARG  12  -3.845  -3.267  -1.260
   95    HB3  ARG  12           HB3      ARG  12  -2.502  -4.384  -1.500
   96    HG2  ARG  12           HG2      ARG  12  -2.794  -5.289   0.746
   97    HG3  ARG  12           HG3      ARG  12  -4.053  -4.104   1.091
   98    HD2  ARG  12           HD2      ARG  12  -5.168  -6.174   0.500
   99    HD3  ARG  12           HD3      ARG  12  -5.349  -5.081  -0.886
  100    HE   ARG  12           HE       ARG  12  -3.672  -6.352  -2.071
  101   HH11  ARG  12          HH11      ARG  12  -5.345  -8.487  -0.537
  102   HH12  ARG  12          HH12      ARG  12  -4.076  -9.542  -0.009
  103   HH21  ARG  12          HH21      ARG  12  -1.543  -7.253  -0.665
  104   HH22  ARG  12          HH22      ARG  12  -1.916  -8.840  -0.081
  105    H    TRP  13           H        TRP  13  -2.357  -1.113  -2.081
  106    HA   TRP  13           HA       TRP  13  -0.058  -1.760  -3.668
  107    HB2  TRP  13           HB2      TRP  13  -1.302  -0.463  -5.044
  108    HB3  TRP  13           HB3      TRP  13  -2.331  -0.008  -3.694
  109    HD1  TRP  13           HD1      TRP  13  -2.393   2.472  -3.210
  110    HE1  TRP  13           HE1      TRP  13  -0.858   4.494  -3.660
  111    HE3  TRP  13           HE3      TRP  13   1.571   0.105  -5.385
  112    HZ2  TRP  13           HZ2      TRP  13   1.713   5.034  -4.793
  113    HZ3  TRP  13           HZ3      TRP  13   3.549   1.393  -6.141
  114    HH2  TRP  13           HH2      TRP  13   3.625   3.853  -5.847
  115    H    GLU  14           H        GLU  14  -0.615   0.863  -1.281
  116    HA   GLU  14           HA       GLU  14   2.069   1.942  -1.489
  117    HB2  GLU  14           HB2      GLU  14  -0.288   2.174   0.365
  118    HB3  GLU  14           HB3      GLU  14   1.253   2.896   0.832
  119    HG2  GLU  14           HG2      GLU  14   1.087   3.745  -1.744
  120    HG3  GLU  14           HG3      GLU  14  -0.624   3.681  -1.325
  121    H    ASN  15           H        ASN  15   0.509  -0.474   0.612
  122    HA   ASN  15           HA       ASN  15   2.583  -0.846   2.528
  123    HB2  ASN  15           HB2      ASN  15   0.160  -1.823   2.286
  124    HB3  ASN  15           HB3      ASN  15   0.945  -3.100   1.357
  125   HD21  ASN  15          HD21      ASN  15   3.121  -3.894   2.619
  126   HD22  ASN  15          HD22      ASN  15   2.876  -4.212   4.267
  127    H    TRP  16           H        TRP  16   2.029  -2.498  -0.611
  128    HA   TRP  16           HA       TRP  16   4.492  -4.027  -0.533
  129    HB2  TRP  16           HB2      TRP  16   2.824  -4.888  -1.946
  130    HB3  TRP  16           HB3      TRP  16   2.381  -3.293  -2.554
  131    HD1  TRP  16           HD1      TRP  16   5.155  -5.937  -2.870
  132    HE1  TRP  16           HE1      TRP  16   6.373  -5.583  -5.112
  133    HE3  TRP  16           HE3      TRP  16   2.871  -1.645  -4.442
  134    HZ2  TRP  16           HZ2      TRP  16   6.380  -3.726  -7.284
  135    HZ3  TRP  16           HZ3      TRP  16   3.506  -0.607  -6.601
  136    HH2  TRP  16           HH2      TRP  16   5.255  -1.640  -8.023
  137    H    PHE  17           H        PHE  17   3.516  -0.939  -2.038
  138    HA   PHE  17           HA       PHE  17   5.855  -0.341  -3.509
  139    HB2  PHE  17           HB2      PHE  17   3.844   0.972  -3.703
  140    HB3  PHE  17           HB3      PHE  17   3.846   1.343  -1.981
  141    HD1  PHE  17           HD1      PHE  17   5.905   1.783  -5.081
  142    HD2  PHE  17           HD2      PHE  17   4.856   3.310  -1.206
  143    HE1  PHE  17           HE1      PHE  17   7.253   3.817  -5.517
  144    HE2  PHE  17           HE2      PHE  17   6.203   5.344  -1.643
  145    HZ   PHE  17           HZ       PHE  17   7.401   5.600  -3.798
  146    H    TRP  18           H        TRP  18   5.066   0.810  -0.194
  147    HA   TRP  18           HA       TRP  18   7.668   1.837   0.397
  148    HB2  TRP  18           HB2      TRP  18   5.336   0.838   2.047
  149    HB3  TRP  18           HB3      TRP  18   6.778   1.525   2.796
  150    HD1  TRP  18           HD1      TRP  18   3.524   2.608   1.945
  151    HE1  TRP  18           HE1      TRP  18   3.410   5.116   1.358
  152    HE3  TRP  18           HE3      TRP  18   8.482   3.556   1.161
  153    HZ2  TRP  18           HZ2      TRP  18   5.188   7.242   0.654
  154    HZ3  TRP  18           HZ3      TRP  18   9.242   5.829   0.534
  155    HH2  TRP  18           HH2      TRP  18   7.603   7.671   0.279
  156    H    ASN  19           H        ASN  19   6.285  -1.423   0.724
  157    HA   ASN  19           HA       ASN  19   8.203  -2.663   2.387
  158    HB2  ASN  19           HB2      ASN  19   6.030  -3.552   1.361
  159    HB3  ASN  19           HB3      ASN  19   6.965  -3.875  -0.098
  160   HD21  ASN  19          HD21      ASN  19   8.817  -5.432   0.124
  161   HD22  ASN  19          HD22      ASN  19   8.776  -6.598   1.357
  162    H    VAL  20           H        VAL  20   8.373  -1.941  -1.103
  163    HA   VAL  20           HA       VAL  20  11.145  -3.057  -1.194
  164    HB   VAL  20           HB       VAL  20  10.789  -2.888  -3.667
  165   HG11  VAL  20          HG11      VAL  20   8.512  -4.285  -2.233
  166   HG12  VAL  20          HG12      VAL  20  10.150  -4.926  -2.366
  167   HG13  VAL  20          HG13      VAL  20   9.172  -4.696  -3.816
  168   HG21  VAL  20          HG21      VAL  20   7.943  -2.109  -2.969
  169   HG22  VAL  20          HG22      VAL  20   8.659  -2.232  -4.574
  170   HG23  VAL  20          HG23      VAL  20   9.160  -0.941  -3.484
  171    H    THR  21           H        THR  21   9.337  -0.035  -1.463
  172    HA   THR  21           HA       THR  21  11.475   1.532  -2.640
  173    HB   THR  21           HB       THR  21   9.015   2.281  -1.029
  174    HG1  THR  21           HG1      THR  21   9.520   2.049  -3.811
  175   HG21  THR  21          HG21      THR  21  10.031   4.317  -1.020
  176   HG22  THR  21          HG22      THR  21   9.495   4.380  -2.698
  177   HG23  THR  21          HG23      THR  21  11.143   3.880  -2.316
  178    H    LEU  22           H        LEU  22  10.394   0.949   0.701
  179    HA   LEU  22           HA       LEU  22  12.086   2.852   1.998
  180    HB2  LEU  22           HB2      LEU  22  10.787   0.249   2.802
  181    HB3  LEU  22           HB3      LEU  22  11.746   1.180   3.949
  182    HG   LEU  22           HG       LEU  22   9.389   2.291   2.394
  183   HD11  LEU  22          HD11      LEU  22   8.177   2.173   4.533
  184   HD12  LEU  22          HD12      LEU  22   9.579   1.424   5.297
  185   HD13  LEU  22          HD13      LEU  22   8.699   0.564   4.032
  186   HD21  LEU  22          HD21      LEU  22  11.122   3.376   4.636
  187   HD22  LEU  22          HD22      LEU  22   9.595   4.110   4.145
  188   HD23  LEU  22          HD23      LEU  22  10.943   4.038   3.011
  189    H    ARG  23           H        ARG  23  12.709  -0.478   0.950
  190    HA   ARG  23           HA       ARG  23  15.569  -0.124   1.794
  191    HB2  ARG  23           HB2      ARG  23  13.583  -2.327   2.044
  192    HB3  ARG  23           HB3      ARG  23  15.232  -2.813   1.650
  193    HG2  ARG  23           HG2      ARG  23  15.578  -0.904   3.647
  194    HG3  ARG  23           HG3      ARG  23  14.152  -1.799   4.172
  195    HD2  ARG  23           HD2      ARG  23  15.553  -3.929   3.597
  196    HD3  ARG  23           HD3      ARG  23  16.945  -2.831   3.682
  197    HE   ARG  23           HE       ARG  23  14.999  -3.210   5.934
  198   HH11  ARG  23          HH11      ARG  23  18.025  -4.173   5.362
  199   HH12  ARG  23          HH12      ARG  23  18.818  -3.231   6.580
  200   HH21  ARG  23          HH21      ARG  23  16.042  -1.238   7.218
  201   HH22  ARG  23          HH22      ARG  23  17.691  -1.564   7.635
  202    HA   PRO  24           HA       PRO  24  15.451  -0.663  -2.797
  203    HB2  PRO  24           HB2      PRO  24  17.144   1.406  -3.378
  204    HB3  PRO  24           HB3      PRO  24  15.395   1.620  -3.176
  205    HG2  PRO  24           HG2      PRO  24  17.604   2.252  -1.305
  206    HG3  PRO  24           HG3      PRO  24  16.064   3.083  -1.560
  207    HD2  PRO  24           HD2      PRO  24  16.616   1.374   0.543
  208    HD3  PRO  24           HD3      PRO  24  14.990   1.805  -0.024
  209    H    GLU  25           H        GLU  25  16.730  -2.587  -1.733
  210    HA   GLU  25           HA       GLU  25  19.675  -2.240  -2.200
  211    HB2  GLU  25           HB2      GLU  25  19.985  -3.872  -0.463
  212    HB3  GLU  25           HB3      GLU  25  18.762  -2.752   0.135
  213    HG2  GLU  25           HG2      GLU  25  17.080  -4.456  -0.972
  214    HG3  GLU  25           HG3      GLU  25  18.432  -5.579  -0.828
  215    H    ARG  26           H        ARG  26  20.369  -4.936  -2.332
  216    HA   ARG  26           HA       ARG  26  18.929  -5.866  -4.797
  217    HB2  ARG  26           HB2      ARG  26  21.509  -5.017  -4.545
  218    HB3  ARG  26           HB3      ARG  26  21.709  -6.744  -4.247
  219    HG2  ARG  26           HG2      ARG  26  21.912  -6.593  -6.583
  220    HG3  ARG  26           HG3      ARG  26  20.221  -7.046  -6.365
  221    HD2  ARG  26           HD2      ARG  26  19.666  -4.551  -6.421
  222    HD3  ARG  26           HD3      ARG  26  21.332  -4.291  -6.974
  223    HE   ARG  26           HE       ARG  26  20.833  -5.714  -8.930
  224   HH11  ARG  26          HH11      ARG  26  18.563  -7.321  -7.992
  225   HH12  ARG  26          HH12      ARG  26  17.195  -6.541  -8.711
  226   HH21  ARG  26          HH21      ARG  26  18.911  -3.598  -9.406
  227   HH22  ARG  26          HH22      ARG  26  17.393  -4.423  -9.511
  Start of MODEL    9
    1    HA   ARG   1           HA       ARG   1 -20.544   2.461  -5.034
    2    HB2  ARG   1           HB2      ARG   1 -22.435   1.045  -6.067
    3    HB3  ARG   1           HB3      ARG   1 -21.972  -0.207  -4.915
    4    HG2  ARG   1           HG2      ARG   1 -22.677   1.022  -3.079
    5    HG3  ARG   1           HG3      ARG   1 -22.424   2.570  -3.887
    6    HD2  ARG   1           HD2      ARG   1 -24.751   2.457  -3.957
    7    HD3  ARG   1           HD3      ARG   1 -24.369   1.633  -5.481
    8    HE   ARG   1           HE       ARG   1 -25.102   0.269  -2.930
    9   HH11  ARG   1          HH11      ARG   1 -26.732   0.026  -5.454
   10   HH12  ARG   1          HH12      ARG   1 -26.214  -1.509  -6.068
   11   HH21  ARG   1          HH21      ARG   1 -23.370  -1.640  -4.070
   12   HH22  ARG   1          HH22      ARG   1 -24.303  -2.456  -5.281
   13    H    SER   2           H        SER   2 -18.208   2.024  -4.265
   14    HA   SER   2           HA       SER   2 -18.312   0.200  -1.904
   15    HB2  SER   2           HB2      SER   2 -16.574   0.066  -4.314
   16    HB3  SER   2           HB3      SER   2 -15.789  -0.228  -2.767
   17    HG   SER   2           HG       SER   2 -16.625  -2.156  -3.601
   18    H    ALA   3           H        ALA   3 -17.510   1.231  -0.130
   19    HA   ALA   3           HA       ALA   3 -15.964   3.765  -0.533
   20    HB1  ALA   3           HB1      ALA   3 -18.108   3.919   0.647
   21    HB2  ALA   3           HB2      ALA   3 -16.791   4.243   1.773
   22    HB3  ALA   3           HB3      ALA   3 -17.594   2.673   1.785
   23    H    LEU   4           H        LEU   4 -15.935   0.654   1.198
   24    HA   LEU   4           HA       LEU   4 -13.231   1.300   2.293
   25    HB2  LEU   4           HB2      LEU   4 -13.722  -0.468   3.898
   26    HB3  LEU   4           HB3      LEU   4 -15.100   0.628   3.817
   27    HG   LEU   4           HG       LEU   4 -15.421  -1.419   1.820
   28   HD11  LEU   4          HD11      LEU   4 -13.938  -2.774   3.250
   29   HD12  LEU   4          HD12      LEU   4 -15.593  -3.383   3.307
   30   HD13  LEU   4          HD13      LEU   4 -14.959  -2.424   4.645
   31   HD21  LEU   4          HD21      LEU   4 -17.312  -0.249   2.686
   32   HD22  LEU   4          HD22      LEU   4 -16.860  -0.603   4.353
   33   HD23  LEU   4          HD23      LEU   4 -17.457  -1.892   3.309
   34    H    VAL   5           H        VAL   5 -14.752  -0.566  -0.164
   35    HA   VAL   5           HA       VAL   5 -12.956  -2.824  -0.255
   36    HB   VAL   5           HB       VAL   5 -14.596  -1.472  -2.429
   37   HG11  VAL   5          HG11      VAL   5 -13.421  -4.259  -2.202
   38   HG12  VAL   5          HG12      VAL   5 -12.989  -3.026  -3.387
   39   HG13  VAL   5          HG13      VAL   5 -14.586  -3.771  -3.432
   40   HG21  VAL   5          HG21      VAL   5 -16.158  -2.047  -0.767
   41   HG22  VAL   5          HG22      VAL   5 -15.244  -3.469  -0.266
   42   HG23  VAL   5          HG23      VAL   5 -16.142  -3.487  -1.784
   43    H    ASN   6           H        ASN   6 -13.034   0.234  -2.148
   44    HA   ASN   6           HA       ASN   6 -10.586  -0.248  -3.586
   45    HB2  ASN   6           HB2      ASN   6 -12.555   1.445  -3.924
   46    HB3  ASN   6           HB3      ASN   6 -11.643   2.475  -2.820
   47   HD21  ASN   6          HD21      ASN   6 -11.701   1.131  -6.075
   48   HD22  ASN   6          HD22      ASN   6 -10.335   1.965  -6.643
   49    H    SER   7           H        SER   7 -11.277   1.367  -0.473
   50    HA   SER   7           HA       SER   7  -8.666   2.440   0.013
   51    HB2  SER   7           HB2      SER   7 -10.854   1.428   1.859
   52    HB3  SER   7           HB3      SER   7  -9.474   2.381   2.396
   53    HG   SER   7           HG       SER   7 -11.737   3.277   1.452
   54    H    TYR   8           H        TYR   8 -10.125  -0.711   0.883
   55    HA   TYR   8           HA       TYR   8  -7.895  -1.807   2.300
   56    HB2  TYR   8           HB2      TYR   8  -9.997  -2.885   2.474
   57    HB3  TYR   8           HB3      TYR   8 -10.247  -2.874   0.732
   58    HD1  TYR   8           HD1      TYR   8  -8.059  -4.334   3.393
   59    HD2  TYR   8           HD2      TYR   8  -9.666  -4.748  -0.568
   60    HE1  TYR   8           HE2      TYR   8  -7.104  -6.618   3.244
   61    HE2  TYR   8           HE1      TYR   8  -8.713  -7.031  -0.717
   62    HH   TYR   8           HH       TYR   8  -7.970  -8.858   1.522
   63    H    LEU   9           H        LEU   9  -8.767  -1.845  -1.155
   64    HA   LEU   9           HA       LEU   9  -6.525  -3.469  -2.017
   65    HB2  LEU   9           HB2      LEU   9  -8.899  -2.313  -3.054
   66    HB3  LEU   9           HB3      LEU   9  -7.583  -1.667  -4.029
   67    HG   LEU   9           HG       LEU   9  -8.510  -3.818  -4.918
   68   HD11  LEU   9          HD11      LEU   9  -6.276  -4.956  -5.133
   69   HD12  LEU   9          HD12      LEU   9  -5.642  -3.820  -3.942
   70   HD13  LEU   9          HD13      LEU   9  -6.235  -3.230  -5.494
   71   HD21  LEU   9          HD21      LEU   9  -8.864  -4.688  -2.487
   72   HD22  LEU   9          HD22      LEU   9  -7.173  -5.181  -2.584
   73   HD23  LEU   9          HD23      LEU   9  -8.349  -5.839  -3.721
   74    H    TRP  10           H        TRP  10  -7.133   0.039  -1.817
   75    HA   TRP  10           HA       TRP  10  -4.725   0.911  -3.114
   76    HB2  TRP  10           HB2      TRP  10  -6.442   2.502  -2.868
   77    HB3  TRP  10           HB3      TRP  10  -6.739   2.062  -1.188
   78    HD1  TRP  10           HD1      TRP  10  -4.062   3.818  -3.345
   79    HE1  TRP  10           HE1      TRP  10  -2.817   5.521  -1.859
   80    HE3  TRP  10           HE3      TRP  10  -6.244   2.812   1.158
   81    HZ2  TRP  10           HZ2      TRP  10  -2.761   6.344   0.880
   82    HZ3  TRP  10           HZ3      TRP  10  -5.578   4.069   3.187
   83    HH2  TRP  10           HH2      TRP  10  -3.841   5.831   3.054
   84    H    GLN  11           H        GLN  11  -5.492   0.445   0.370
   85    HA   GLN  11           HA       GLN  11  -3.014   1.251   1.471
   86    HB2  GLN  11           HB2      GLN  11  -5.386  -0.216   2.236
   87    HB3  GLN  11           HB3      GLN  11  -3.964  -0.987   2.935
   88    HG2  GLN  11           HG2      GLN  11  -4.214   1.999   3.081
   89    HG3  GLN  11           HG3      GLN  11  -5.144   1.007   4.203
   90   HE21  GLN  11          HE21      GLN  11  -2.010   2.325   3.583
   91   HE22  GLN  11          HE22      GLN  11  -1.181   1.498   4.813
   92    H    ARG  12           H        ARG  12  -3.957  -1.926   0.141
   93    HA   ARG  12           HA       ARG  12  -1.521  -3.309   0.819
   94    HB2  ARG  12           HB2      ARG  12  -3.888  -3.672  -0.968
   95    HB3  ARG  12           HB3      ARG  12  -2.471  -4.667  -1.305
   96    HG2  ARG  12           HG2      ARG  12  -2.521  -5.678   0.830
   97    HG3  ARG  12           HG3      ARG  12  -3.568  -4.423   1.495
   98    HD2  ARG  12           HD2      ARG  12  -5.454  -5.482   0.786
   99    HD3  ARG  12           HD3      ARG  12  -4.757  -5.822  -0.811
  100    HE   ARG  12           HE       ARG  12  -4.103  -7.438   1.632
  101   HH11  ARG  12          HH11      ARG  12  -2.270  -7.812  -0.671
  102   HH12  ARG  12          HH12      ARG  12  -3.001  -9.126  -1.532
  103   HH21  ARG  12          HH21      ARG  12  -6.078  -8.792   0.060
  104   HH22  ARG  12          HH22      ARG  12  -5.169  -9.685  -1.115
  105    H    TRP  13           H        TRP  13  -2.556  -1.541  -2.124
  106    HA   TRP  13           HA       TRP  13  -0.284  -2.138  -3.745
  107    HB2  TRP  13           HB2      TRP  13  -1.602  -0.955  -5.154
  108    HB3  TRP  13           HB3      TRP  13  -2.644  -0.538  -3.802
  109    HD1  TRP  13           HD1      TRP  13  -2.868   1.941  -3.337
  110    HE1  TRP  13           HE1      TRP  13  -1.523   4.065  -3.905
  111    HE3  TRP  13           HE3      TRP  13   1.169  -0.164  -5.648
  112    HZ2  TRP  13           HZ2      TRP  13   0.939   4.776  -5.174
  113    HZ3  TRP  13           HZ3      TRP  13   2.995   1.259  -6.531
  114    HH2  TRP  13           HH2      TRP  13   2.887   3.725  -6.296
  115    H    GLU  14           H        GLU  14  -0.858   0.600  -1.502
  116    HA   GLU  14           HA       GLU  14   1.764   1.778  -1.888
  117    HB2  GLU  14           HB2      GLU  14  -0.614   2.087  -0.124
  118    HB3  GLU  14           HB3      GLU  14   0.908   2.721   0.505
  119    HG2  GLU  14           HG2      GLU  14   1.055   3.662  -2.022
  120    HG3  GLU  14           HG3      GLU  14  -0.698   3.626  -1.827
  121    H    ASN  15           H        ASN  15   0.387  -0.515   0.469
  122    HA   ASN  15           HA       ASN  15   2.496  -0.653   2.347
  123    HB2  ASN  15           HB2      ASN  15   0.571  -1.855   2.894
  124    HB3  ASN  15           HB3      ASN  15   0.396  -2.508   1.269
  125   HD21  ASN  15          HD21      ASN  15   3.185  -2.627   3.583
  126   HD22  ASN  15          HD22      ASN  15   3.308  -4.319   3.556
  127    H    TRP  16           H        TRP  16   2.102  -2.489  -0.715
  128    HA   TRP  16           HA       TRP  16   4.577  -3.943  -0.532
  129    HB2  TRP  16           HB2      TRP  16   3.007  -4.766  -2.079
  130    HB3  TRP  16           HB3      TRP  16   2.629  -3.157  -2.696
  131    HD1  TRP  16           HD1      TRP  16   5.439  -5.792  -2.792
  132    HE1  TRP  16           HE1      TRP  16   6.822  -5.430  -4.937
  133    HE3  TRP  16           HE3      TRP  16   3.230  -1.538  -4.558
  134    HZ2  TRP  16           HZ2      TRP  16   6.972  -3.580  -7.113
  135    HZ3  TRP  16           HZ3      TRP  16   4.015  -0.497  -6.665
  136    HH2  TRP  16           HH2      TRP  16   5.881  -1.511  -7.944
  137    H    PHE  17           H        PHE  17   3.707  -0.878  -2.173
  138    HA   PHE  17           HA       PHE  17   6.165  -0.239  -3.388
  139    HB2  PHE  17           HB2      PHE  17   4.124   1.039  -3.721
  140    HB3  PHE  17           HB3      PHE  17   4.067   1.476  -2.014
  141    HD1  PHE  17           HD1      PHE  17   6.122   1.839  -5.112
  142    HD2  PHE  17           HD2      PHE  17   5.210   3.385  -1.207
  143    HE1  PHE  17           HE1      PHE  17   7.530   3.828  -5.568
  144    HE2  PHE  17           HE2      PHE  17   6.618   5.374  -1.666
  145    HZ   PHE  17           HZ       PHE  17   7.777   5.596  -3.847
  146    H    TRP  18           H        TRP  18   5.081   0.517  -0.058
  147    HA   TRP  18           HA       TRP  18   7.485   1.821   0.800
  148    HB2  TRP  18           HB2      TRP  18   5.222   0.349   2.170
  149    HB3  TRP  18           HB3      TRP  18   6.519   1.112   3.090
  150    HD1  TRP  18           HD1      TRP  18   3.203   1.888   2.151
  151    HE1  TRP  18           HE1      TRP  18   2.804   4.417   1.838
  152    HE3  TRP  18           HE3      TRP  18   8.035   3.509   1.801
  153    HZ2  TRP  18           HZ2      TRP  18   4.333   6.808   1.485
  154    HZ3  TRP  18           HZ3      TRP  18   8.535   5.913   1.476
  155    HH2  TRP  18           HH2      TRP  18   6.691   7.564   1.318
  156    H    ASN  19           H        ASN  19   6.488  -1.607   0.842
  157    HA   ASN  19           HA       ASN  19   8.552  -2.712   2.424
  158    HB2  ASN  19           HB2      ASN  19   6.433  -3.674   1.136
  159    HB3  ASN  19           HB3      ASN  19   7.641  -4.075  -0.086
  160   HD21  ASN  19          HD21      ASN  19   7.252  -4.334   3.504
  161   HD22  ASN  19          HD22      ASN  19   7.971  -5.867   3.610
  162    H    VAL  20           H        VAL  20   8.640  -1.727  -1.007
  163    HA   VAL  20           HA       VAL  20  11.518  -2.551  -1.124
  164    HB   VAL  20           HB       VAL  20  11.137  -2.328  -3.606
  165   HG11  VAL  20          HG11      VAL  20  10.064  -4.422  -3.790
  166   HG12  VAL  20          HG12      VAL  20   9.040  -4.119  -2.388
  167   HG13  VAL  20          HG13      VAL  20  10.758  -4.447  -2.169
  168   HG21  VAL  20          HG21      VAL  20   8.193  -2.171  -2.963
  169   HG22  VAL  20          HG22      VAL  20   9.006  -1.864  -4.497
  170   HG23  VAL  20          HG23      VAL  20   9.141  -0.700  -3.180
  171    H    THR  21           H        THR  21   9.705   0.236  -0.556
  172    HA   THR  21           HA       THR  21  11.770   1.995  -1.829
  173    HB   THR  21           HB       THR  21   8.928   2.582  -0.940
  174    HG1  THR  21           HG1      THR  21   8.605   1.501  -2.731
  175   HG21  THR  21          HG21      THR  21   9.914   4.676  -0.920
  176   HG22  THR  21          HG22      THR  21   9.476   4.561  -2.625
  177   HG23  THR  21          HG23      THR  21  11.131   4.229  -2.115
  178    H    LEU  22           H        LEU  22  10.481   0.945   1.215
  179    HA   LEU  22           HA       LEU  22  10.971   3.201   2.876
  180    HB2  LEU  22           HB2      LEU  22  10.865   0.221   3.210
  181    HB3  LEU  22           HB3      LEU  22  11.408   1.204   4.569
  182    HG   LEU  22           HG       LEU  22   8.836   1.768   3.078
  183   HD11  LEU  22          HD11      LEU  22   9.273   0.116   5.586
  184   HD12  LEU  22          HD12      LEU  22   8.681  -0.480   4.036
  185   HD13  LEU  22          HD13      LEU  22   7.698   0.636   4.982
  186   HD21  LEU  22          HD21      LEU  22   9.440   3.675   4.313
  187   HD22  LEU  22          HD22      LEU  22  10.146   2.723   5.619
  188   HD23  LEU  22          HD23      LEU  22   8.393   2.807   5.436
  189    H    ARG  23           H        ARG  23  13.164   0.707   1.664
  190    HA   ARG  23           HA       ARG  23  15.516   0.550   1.689
  191    HB2  ARG  23           HB2      ARG  23  14.924   2.946   0.811
  192    HB3  ARG  23           HB3      ARG  23  15.524   3.484   2.379
  193    HG2  ARG  23           HG2      ARG  23  17.438   1.641   1.479
  194    HG3  ARG  23           HG3      ARG  23  17.022   2.591   0.052
  195    HD2  ARG  23           HD2      ARG  23  17.547   3.994   2.670
  196    HD3  ARG  23           HD3      ARG  23  18.903   3.493   1.641
  197    HE   ARG  23           HE       ARG  23  17.940   4.859  -0.179
  198   HH11  ARG  23          HH11      ARG  23  18.217   6.539   2.448
  199   HH12  ARG  23          HH12      ARG  23  16.763   7.475   2.354
  200   HH21  ARG  23          HH21      ARG  23  15.324   5.471  -0.096
  201   HH22  ARG  23          HH22      ARG  23  15.118   6.868   0.905
  202    HA   PRO  24           HA       PRO  24  15.465   0.564   6.337
  203    HB2  PRO  24           HB2      PRO  24  16.013  -2.103   6.625
  204    HB3  PRO  24           HB3      PRO  24  14.365  -1.467   6.454
  205    HG2  PRO  24           HG2      PRO  24  16.115  -2.760   4.426
  206    HG3  PRO  24           HG3      PRO  24  14.369  -2.909   4.671
  207    HD2  PRO  24           HD2      PRO  24  15.499  -1.363   2.723
  208    HD3  PRO  24           HD3      PRO  24  13.906  -1.041   3.442
  209    H    GLU  25           H        GLU  25  17.336  -0.232   7.787
  210    HA   GLU  25           HA       GLU  25  19.891   0.516   6.572
  211    HB2  GLU  25           HB2      GLU  25  18.735  -0.040   9.252
  212    HB3  GLU  25           HB3      GLU  25  20.465  -0.338   9.094
  213    HG2  GLU  25           HG2      GLU  25  20.195   1.958   9.781
  214    HG3  GLU  25           HG3      GLU  25  20.683   1.971   8.087
  215    H    ARG  26           H        ARG  26  18.426  -2.489   7.811
  216    HA   ARG  26           HA       ARG  26  19.037  -4.745   7.516
  217    HB2  ARG  26           HB2      ARG  26  19.399  -3.412   5.146
  218    HB3  ARG  26           HB3      ARG  26  21.000  -4.107   5.397
  219    HG2  ARG  26           HG2      ARG  26  20.165  -6.316   5.440
  220    HG3  ARG  26           HG3      ARG  26  18.508  -5.777   5.718
  221    HD2  ARG  26           HD2      ARG  26  18.642  -4.647   3.414
  222    HD3  ARG  26           HD3      ARG  26  20.116  -5.602   3.157
  223    HE   ARG  26           HE       ARG  26  18.791  -7.632   3.351
  224   HH11  ARG  26          HH11      ARG  26  17.156  -6.117   1.362
  225   HH12  ARG  26          HH12      ARG  26  15.563  -6.223   2.033
  226   HH21  ARG  26          HH21      ARG  26  16.674  -7.164   5.190
  227   HH22  ARG  26          HH22      ARG  26  15.288  -6.820   4.210
  Start of MODEL   10
    1    HA   ARG   1           HA       ARG   1 -20.590  -1.430  -4.866
    2    HB2  ARG   1           HB2      ARG   1 -19.634   1.423  -4.997
    3    HB3  ARG   1           HB3      ARG   1 -18.457   0.110  -4.995
    4    HG2  ARG   1           HG2      ARG   1 -20.070  -0.884  -6.861
    5    HG3  ARG   1           HG3      ARG   1 -20.507   0.813  -7.059
    6    HD2  ARG   1           HD2      ARG   1 -17.963   1.275  -7.164
    7    HD3  ARG   1           HD3      ARG   1 -17.794  -0.473  -7.423
    8    HE   ARG   1           HE       ARG   1 -19.411  -0.178  -9.361
    9   HH11  ARG   1          HH11      ARG   1 -20.227   2.622  -8.968
   10   HH12  ARG   1          HH12      ARG   1 -19.169   3.496 -10.025
   11   HH21  ARG   1          HH21      ARG   1 -16.907   0.876 -10.350
   12   HH22  ARG   1          HH22      ARG   1 -17.281   2.502 -10.811
   13    H    SER   2           H        SER   2 -18.498  -1.967  -3.615
   14    HA   SER   2           HA       SER   2 -19.046  -1.953  -0.759
   15    HB2  SER   2           HB2      SER   2 -17.337  -3.268  -2.671
   16    HB3  SER   2           HB3      SER   2 -16.363  -2.719  -1.313
   17    HG   SER   2           HG       SER   2 -18.414  -4.594  -1.422
   18    H    ALA   3           H        ALA   3 -17.887  -0.839   0.881
   19    HA   ALA   3           HA       ALA   3 -16.397   1.586  -0.051
   20    HB1  ALA   3           HB1      ALA   3 -18.535   1.711   1.325
   21    HB2  ALA   3           HB2      ALA   3 -17.156   2.572   2.009
   22    HB3  ALA   3           HB3      ALA   3 -17.624   0.999   2.657
   23    H    LEU   4           H        LEU   4 -16.245  -1.081   2.340
   24    HA   LEU   4           HA       LEU   4 -13.570  -0.262   3.256
   25    HB2  LEU   4           HB2      LEU   4 -15.750  -1.718   4.245
   26    HB3  LEU   4           HB3      LEU   4 -14.486  -2.925   4.019
   27    HG   LEU   4           HG       LEU   4 -14.385  -1.912   6.277
   28   HD11  LEU   4          HD11      LEU   4 -12.037  -1.563   6.309
   29   HD12  LEU   4          HD12      LEU   4 -12.028  -0.920   4.668
   30   HD13  LEU   4          HD13      LEU   4 -12.314  -2.638   4.939
   31   HD21  LEU   4          HD21      LEU   4 -15.262   0.349   5.379
   32   HD22  LEU   4          HD22      LEU   4 -13.587   0.675   4.936
   33   HD23  LEU   4          HD23      LEU   4 -14.014   0.403   6.624
   34    H    VAL   5           H        VAL   5 -14.379  -1.563   0.401
   35    HA   VAL   5           HA       VAL   5 -12.333  -3.731   0.392
   36    HB   VAL   5           HB       VAL   5 -14.460  -2.800  -1.569
   37   HG11  VAL   5          HG11      VAL   5 -13.803  -5.131  -2.607
   38   HG12  VAL   5          HG12      VAL   5 -12.259  -4.833  -1.808
   39   HG13  VAL   5          HG13      VAL   5 -12.860  -3.697  -3.014
   40   HG21  VAL   5          HG21      VAL   5 -14.172  -5.177   0.287
   41   HG22  VAL   5          HG22      VAL   5 -15.352  -5.130  -1.023
   42   HG23  VAL   5          HG23      VAL   5 -15.444  -3.956   0.289
   43    H    ASN   6           H        ASN   6 -13.223  -0.795  -1.479
   44    HA   ASN   6           HA       ASN   6 -10.835  -0.701  -3.070
   45    HB2  ASN   6           HB2      ASN   6 -13.241   0.806  -2.613
   46    HB3  ASN   6           HB3      ASN   6 -11.873   1.919  -2.606
   47   HD21  ASN   6          HD21      ASN   6 -10.256   1.519  -4.527
   48   HD22  ASN   6          HD22      ASN   6 -10.958   1.144  -6.027
   49    H    SER   7           H        SER   7 -11.645   0.719   0.110
   50    HA   SER   7           HA       SER   7  -9.368   2.399   0.437
   51    HB2  SER   7           HB2      SER   7  -9.862   1.931   2.907
   52    HB3  SER   7           HB3      SER   7 -11.224   2.515   1.957
   53    HG   SER   7           HG       SER   7 -11.343   0.475   3.394
   54    H    TYR   8           H        TYR   8  -9.837  -0.990   1.528
   55    HA   TYR   8           HA       TYR   8  -7.118  -1.403   2.392
   56    HB2  TYR   8           HB2      TYR   8  -8.821  -2.852   3.211
   57    HB3  TYR   8           HB3      TYR   8  -9.452  -3.156   1.594
   58    HD1  TYR   8           HD1      TYR   8  -6.381  -3.630   3.684
   59    HD2  TYR   8           HD2      TYR   8  -8.748  -5.044   0.390
   60    HE1  TYR   8           HE2      TYR   8  -4.908  -5.612   3.478
   61    HE2  TYR   8           HE1      TYR   8  -7.273  -7.027   0.182
   62    HH   TYR   8           HH       TYR   8  -5.707  -8.334   1.850
   63    H    LEU   9           H        LEU   9  -8.816  -1.988  -0.690
   64    HA   LEU   9           HA       LEU   9  -6.737  -3.356  -2.086
   65    HB2  LEU   9           HB2      LEU   9  -9.156  -1.722  -2.737
   66    HB3  LEU   9           HB3      LEU   9  -8.032  -2.057  -4.050
   67    HG   LEU   9           HG       LEU   9  -9.175  -4.196  -2.233
   68   HD11  LEU   9          HD11      LEU   9 -10.005  -3.540  -5.072
   69   HD12  LEU   9          HD12      LEU   9 -10.899  -3.001  -3.651
   70   HD13  LEU   9          HD13      LEU   9 -10.737  -4.724  -3.989
   71   HD21  LEU   9          HD21      LEU   9  -7.600  -4.242  -4.825
   72   HD22  LEU   9          HD22      LEU   9  -8.396  -5.661  -4.144
   73   HD23  LEU   9          HD23      LEU   9  -7.092  -4.872  -3.258
   74    H    TRP  10           H        TRP  10  -7.327   0.104  -1.532
   75    HA   TRP  10           HA       TRP  10  -5.244   1.037  -3.334
   76    HB2  TRP  10           HB2      TRP  10  -7.194   2.390  -2.647
   77    HB3  TRP  10           HB3      TRP  10  -6.654   2.326  -0.969
   78    HD1  TRP  10           HD1      TRP  10  -4.649   3.053  -4.194
   79    HE1  TRP  10           HE1      TRP  10  -3.401   5.284  -3.882
   80    HE3  TRP  10           HE3      TRP  10  -6.379   4.393   0.420
   81    HZ2  TRP  10           HZ2      TRP  10  -3.167   7.365  -1.934
   82    HZ3  TRP  10           HZ3      TRP  10  -5.627   6.502   1.479
   83    HH2  TRP  10           HH2      TRP  10  -4.024   7.989   0.309
   84    H    GLN  11           H        GLN  11  -5.454   0.398   0.177
   85    HA   GLN  11           HA       GLN  11  -2.872   1.370   0.922
   86    HB2  GLN  11           HB2      GLN  11  -5.067   0.257   2.151
   87    HB3  GLN  11           HB3      GLN  11  -3.889  -1.047   2.297
   88    HG2  GLN  11           HG2      GLN  11  -2.709   1.558   2.897
   89    HG3  GLN  11           HG3      GLN  11  -4.072   1.190   3.954
   90   HE21  GLN  11          HE21      GLN  11  -3.990  -1.195   4.870
   91   HE22  GLN  11          HE22      GLN  11  -2.459  -1.754   5.341
   92    H    ARG  12           H        ARG  12  -3.924  -1.767  -0.384
   93    HA   ARG  12           HA       ARG  12  -1.586  -3.323  -0.012
   94    HB2  ARG  12           HB2      ARG  12  -3.688  -3.158  -2.188
   95    HB3  ARG  12           HB3      ARG  12  -2.457  -4.419  -2.174
   96    HG2  ARG  12           HG2      ARG  12  -4.073  -3.926   0.309
   97    HG3  ARG  12           HG3      ARG  12  -4.789  -4.844  -1.016
   98    HD2  ARG  12           HD2      ARG  12  -3.737  -6.649  -0.098
   99    HD3  ARG  12           HD3      ARG  12  -2.248  -5.963  -0.778
  100    HE   ARG  12           HE       ARG  12  -2.785  -4.612   1.669
  101   HH11  ARG  12          HH11      ARG  12  -3.490  -7.464   2.422
  102   HH12  ARG  12          HH12      ARG  12  -1.963  -8.057   2.990
  103   HH21  ARG  12          HH21      ARG  12  -0.131  -5.476   1.546
  104   HH22  ARG  12          HH22      ARG  12  -0.054  -6.927   2.489
  105    H    TRP  13           H        TRP  13  -2.380  -0.970  -2.561
  106    HA   TRP  13           HA       TRP  13  -0.224  -1.363  -4.346
  107    HB2  TRP  13           HB2      TRP  13  -2.371   0.354  -3.999
  108    HB3  TRP  13           HB3      TRP  13  -0.992   1.433  -3.827
  109    HD1  TRP  13           HD1      TRP  13  -2.976   1.499  -6.299
  110    HE1  TRP  13           HE1      TRP  13  -2.037   1.171  -8.681
  111    HE3  TRP  13           HE3      TRP  13   1.411  -0.865  -5.197
  112    HZ2  TRP  13           HZ2      TRP  13   0.273   0.052  -9.944
  113    HZ3  TRP  13           HZ3      TRP  13   2.959  -1.550  -7.002
  114    HH2  TRP  13           HH2      TRP  13   2.399  -1.094  -9.373
  115    H    GLU  14           H        GLU  14  -0.408   1.173  -1.825
  116    HA   GLU  14           HA       GLU  14   2.393   1.837  -1.973
  117    HB2  GLU  14           HB2      GLU  14   0.214   2.343   0.075
  118    HB3  GLU  14           HB3      GLU  14   1.786   3.146   0.082
  119    HG2  GLU  14           HG2      GLU  14   1.195   3.700  -2.426
  120    HG3  GLU  14           HG3      GLU  14  -0.463   3.410  -1.895
  121    H    ASN  15           H        ASN  15   0.537  -0.445   0.014
  122    HA   ASN  15           HA       ASN  15   2.338  -0.947   2.125
  123    HB2  ASN  15           HB2      ASN  15  -0.015  -1.921   1.488
  124    HB3  ASN  15           HB3      ASN  15   0.914  -3.160   0.648
  125   HD21  ASN  15          HD21      ASN  15   2.885  -3.983   2.196
  126   HD22  ASN  15          HD22      ASN  15   2.398  -4.355   3.778
  127    H    TRP  16           H        TRP  16   2.269  -2.485  -1.122
  128    HA   TRP  16           HA       TRP  16   4.699  -4.014  -0.730
  129    HB2  TRP  16           HB2      TRP  16   3.223  -4.788  -2.405
  130    HB3  TRP  16           HB3      TRP  16   2.958  -3.167  -3.049
  131    HD1  TRP  16           HD1      TRP  16   5.545  -5.995  -3.014
  132    HE1  TRP  16           HE1      TRP  16   7.180  -5.642  -4.975
  133    HE3  TRP  16           HE3      TRP  16   3.958  -1.431  -4.676
  134    HZ2  TRP  16           HZ2      TRP  16   7.741  -3.684  -6.982
  135    HZ3  TRP  16           HZ3      TRP  16   5.061  -0.348  -6.612
  136    HH2  TRP  16           HH2      TRP  16   6.949  -1.467  -7.767
  137    H    PHE  17           H        PHE  17   3.968  -0.889  -2.313
  138    HA   PHE  17           HA       PHE  17   6.534  -0.268  -3.333
  139    HB2  PHE  17           HB2      PHE  17   4.641   1.064  -3.923
  140    HB3  PHE  17           HB3      PHE  17   4.227   1.359  -2.236
  141    HD1  PHE  17           HD1      PHE  17   7.058   1.891  -4.648
  142    HD2  PHE  17           HD2      PHE  17   4.877   3.374  -1.257
  143    HE1  PHE  17           HE2      PHE  17   8.435   3.953  -4.663
  144    HE2  PHE  17           HE1      PHE  17   6.254   5.436  -1.274
  145    HZ   PHE  17           HZ       PHE  17   8.031   5.726  -2.977
  146    H    TRP  18           H        TRP  18   5.137   0.746  -0.181
  147    HA   TRP  18           HA       TRP  18   7.552   1.869   0.878
  148    HB2  TRP  18           HB2      TRP  18   5.027   0.714   2.092
  149    HB3  TRP  18           HB3      TRP  18   6.275   1.485   3.069
  150    HD1  TRP  18           HD1      TRP  18   3.149   2.332   1.599
  151    HE1  TRP  18           HE1      TRP  18   2.952   4.843   1.048
  152    HE3  TRP  18           HE3      TRP  18   8.066   3.685   1.885
  153    HZ2  TRP  18           HZ2      TRP  18   4.655   7.124   0.771
  154    HZ3  TRP  18           HZ3      TRP  18   8.749   6.030   1.474
  155    HH2  TRP  18           HH2      TRP  18   7.052   7.750   0.918
  156    H    ASN  19           H        ASN  19   6.257  -1.439   0.884
  157    HA   ASN  19           HA       ASN  19   7.946  -2.629   2.839
  158    HB2  ASN  19           HB2      ASN  19   5.918  -3.558   1.602
  159    HB3  ASN  19           HB3      ASN  19   6.998  -3.876   0.245
  160   HD21  ASN  19          HD21      ASN  19   6.059  -4.956   3.451
  161   HD22  ASN  19          HD22      ASN  19   7.079  -6.312   3.498
  162    H    VAL  20           H        VAL  20   8.530  -2.038  -0.646
  163    HA   VAL  20           HA       VAL  20  11.296  -3.127  -0.343
  164    HB   VAL  20           HB       VAL  20  11.256  -3.028  -2.848
  165   HG11  VAL  20          HG11      VAL  20   8.867  -4.427  -1.610
  166   HG12  VAL  20          HG12      VAL  20  10.517  -5.050  -1.614
  167   HG13  VAL  20          HG13      VAL  20   9.645  -4.851  -3.135
  168   HG21  VAL  20          HG21      VAL  20   9.254  -1.170  -2.508
  169   HG22  VAL  20          HG22      VAL  20   8.335  -2.612  -2.935
  170   HG23  VAL  20          HG23      VAL  20   9.589  -2.012  -4.019
  171    H    THR  21           H        THR  21   9.849  -0.164   0.045
  172    HA   THR  21           HA       THR  21  12.076   1.356  -1.243
  173    HB   THR  21           HB       THR  21   9.321   2.107  -0.221
  174    HG1  THR  21           HG1      THR  21   9.041   1.339  -2.187
  175   HG21  THR  21          HG21      THR  21  11.612   3.816  -1.183
  176   HG22  THR  21          HG22      THR  21  10.589   4.043   0.236
  177   HG23  THR  21          HG23      THR  21   9.940   4.343  -1.375
  178    H    LEU  22           H        LEU  22  10.391   0.880   1.852
  179    HA   LEU  22           HA       LEU  22  11.892   2.801   3.373
  180    HB2  LEU  22           HB2      LEU  22  10.342   0.291   4.058
  181    HB3  LEU  22           HB3      LEU  22  11.027   1.347   5.292
  182    HG   LEU  22           HG       LEU  22   9.149   2.322   3.123
  183   HD11  LEU  22          HD11      LEU  22   8.250   0.586   4.863
  184   HD12  LEU  22          HD12      LEU  22   7.335   2.068   4.586
  185   HD13  LEU  22          HD13      LEU  22   8.373   1.926   6.005
  186   HD21  LEU  22          HD21      LEU  22  10.282   3.512   5.668
  187   HD22  LEU  22          HD22      LEU  22   8.890   4.203   4.834
  188   HD23  LEU  22          HD23      LEU  22  10.453   4.122   4.022
  189    H    ARG  23           H        ARG  23  12.191  -0.764   3.333
  190    HA   ARG  23           HA       ARG  23  15.110  -0.653   3.305
  191    HB2  ARG  23           HB2      ARG  23  15.301  -1.687   5.610
  192    HB3  ARG  23           HB3      ARG  23  14.750  -0.014   5.611
  193    HG2  ARG  23           HG2      ARG  23  12.474  -1.769   5.371
  194    HG3  ARG  23           HG3      ARG  23  13.451  -2.260   6.756
  195    HD2  ARG  23           HD2      ARG  23  13.415   0.063   7.612
  196    HD3  ARG  23           HD3      ARG  23  12.418   0.552   6.228
  197    HE   ARG  23           HE       ARG  23  10.909  -1.463   7.133
  198   HH11  ARG  23          HH11      ARG  23  12.418  -1.505   9.729
  199   HH12  ARG  23          HH12      ARG  23  11.465  -0.453  10.720
  200   HH21  ARG  23          HH21      ARG  23   9.767   0.959   8.031
  201   HH22  ARG  23          HH22      ARG  23   9.955   0.950   9.753
  202    HA   PRO  24           HA       PRO  24  13.168  -4.557   1.780
  203    HB2  PRO  24           HB2      PRO  24  14.620  -4.665  -0.538
  204    HB3  PRO  24           HB3      PRO  24  13.103  -3.758  -0.389
  205    HG2  PRO  24           HG2      PRO  24  15.909  -2.776  -0.316
  206    HG3  PRO  24           HG3      PRO  24  14.475  -2.045  -1.054
  207    HD2  PRO  24           HD2      PRO  24  15.520  -1.234   1.331
  208    HD3  PRO  24           HD3      PRO  24  13.802  -1.072   0.903
  209    H    GLU  25           H        GLU  25  14.452  -6.597   0.995
  210    HA   GLU  25           HA       GLU  25  16.104  -8.221   1.419
  211    HB2  GLU  25           HB2      GLU  25  17.511  -5.611   1.144
  212    HB3  GLU  25           HB3      GLU  25  18.445  -6.924   1.857
  213    HG2  GLU  25           HG2      GLU  25  18.858  -7.533  -0.291
  214    HG3  GLU  25           HG3      GLU  25  17.221  -8.190  -0.255
  215    H    ARG  26           H        ARG  26  17.908  -8.761   3.189
  216    HA   ARG  26           HA       ARG  26  17.474  -7.497   5.810
  217    HB2  ARG  26           HB2      ARG  26  16.550  -9.611   6.791
  218    HB3  ARG  26           HB3      ARG  26  15.480  -8.887   5.592
  219    HG2  ARG  26           HG2      ARG  26  15.560 -10.752   4.334
  220    HG3  ARG  26           HG3      ARG  26  17.320 -10.674   4.272
  221    HD2  ARG  26           HD2      ARG  26  15.910 -11.728   6.731
  222    HD3  ARG  26           HD3      ARG  26  16.272 -12.787   5.354
  223    HE   ARG  26           HE       ARG  26  18.691 -11.822   5.622
  224   HH11  ARG  26          HH11      ARG  26  17.750 -14.096   7.492
  225   HH12  ARG  26          HH12      ARG  26  18.352 -13.524   9.011
  226   HH21  ARG  26          HH21      ARG  26  18.900 -10.283   7.870
  227   HH22  ARG  26          HH22      ARG  26  19.006 -11.357   9.227
  Start of MODEL   11
    1    HA   ARG   1           HA       ARG   1 -15.500   1.814  -7.388
    2    HB2  ARG   1           HB2      ARG   1 -14.116   3.282  -6.097
    3    HB3  ARG   1           HB3      ARG   1 -14.654   4.235  -7.479
    4    HG2  ARG   1           HG2      ARG   1 -16.658   4.590  -5.540
    5    HG3  ARG   1           HG3      ARG   1 -15.141   4.676  -4.646
    6    HD2  ARG   1           HD2      ARG   1 -15.095   6.145  -7.208
    7    HD3  ARG   1           HD3      ARG   1 -16.235   6.793  -6.012
    8    HE   ARG   1           HE       ARG   1 -13.303   6.458  -5.574
    9   HH11  ARG   1          HH11      ARG   1 -14.926   9.082  -5.544
   10   HH12  ARG   1          HH12      ARG   1 -14.996   9.394  -3.843
   11   HH21  ARG   1          HH21      ARG   1 -14.028   6.178  -2.948
   12   HH22  ARG   1          HH22      ARG   1 -14.483   7.744  -2.366
   13    H    SER   2           H        SER   2 -15.174   1.181  -5.000
   14    HA   SER   2           HA       SER   2 -17.804   1.266  -3.549
   15    HB2  SER   2           HB2      SER   2 -15.838  -0.876  -4.217
   16    HB3  SER   2           HB3      SER   2 -16.620  -0.981  -2.642
   17    HG   SER   2           HG       SER   2 -17.610  -1.734  -4.921
   18    H    ALA   3           H        ALA   3 -17.573   1.109  -1.146
   19    HA   ALA   3           HA       ALA   3 -15.285   2.740  -0.201
   20    HB1  ALA   3           HB1      ALA   3 -16.715   2.712   1.910
   21    HB2  ALA   3           HB2      ALA   3 -17.892   1.766   0.999
   22    HB3  ALA   3           HB3      ALA   3 -17.490   3.406   0.487
   23    H    LEU   4           H        LEU   4 -16.720  -0.483   0.400
   24    HA   LEU   4           HA       LEU   4 -14.540  -1.170   2.291
   25    HB2  LEU   4           HB2      LEU   4 -17.122  -1.716   2.363
   26    HB3  LEU   4           HB3      LEU   4 -16.669  -3.047   1.298
   27    HG   LEU   4           HG       LEU   4 -14.753  -3.339   3.168
   28   HD11  LEU   4          HD11      LEU   4 -17.115  -2.052   4.562
   29   HD12  LEU   4          HD12      LEU   4 -15.435  -1.518   4.589
   30   HD13  LEU   4          HD13      LEU   4 -15.898  -3.011   5.405
   31   HD21  LEU   4          HD21      LEU   4 -16.167  -5.088   4.153
   32   HD22  LEU   4          HD22      LEU   4 -16.393  -5.047   2.405
   33   HD23  LEU   4          HD23      LEU   4 -17.607  -4.334   3.467
   34    H    VAL   5           H        VAL   5 -14.200  -0.817  -0.792
   35    HA   VAL   5           HA       VAL   5 -12.927  -3.491  -1.288
   36    HB   VAL   5           HB       VAL   5 -14.325  -1.564  -3.174
   37   HG11  VAL   5          HG11      VAL   5 -12.569  -2.473  -4.469
   38   HG12  VAL   5          HG12      VAL   5 -13.929  -3.545  -4.800
   39   HG13  VAL   5          HG13      VAL   5 -12.672  -4.039  -3.667
   40   HG21  VAL   5          HG21      VAL   5 -14.978  -4.301  -2.064
   41   HG22  VAL   5          HG22      VAL   5 -15.744  -3.683  -3.527
   42   HG23  VAL   5          HG23      VAL   5 -15.957  -2.837  -1.994
   43    H    ASN   6           H        ASN   6 -12.775   0.008  -2.102
   44    HA   ASN   6           HA       ASN   6 -10.094  -0.146  -3.204
   45    HB2  ASN   6           HB2      ASN   6 -10.412   2.138  -3.590
   46    HB3  ASN   6           HB3      ASN   6 -12.078   1.572  -3.497
   47   HD21  ASN   6          HD21      ASN   6  -9.547   3.326  -1.698
   48   HD22  ASN   6          HD22      ASN   6 -10.597   3.996  -0.545
   49    H    SER   7           H        SER   7 -11.366   0.212   0.044
   50    HA   SER   7           HA       SER   7  -9.343   1.572   1.425
   51    HB2  SER   7           HB2      SER   7 -11.580   0.442   2.155
   52    HB3  SER   7           HB3      SER   7 -10.585  -0.982   2.447
   53    HG   SER   7           HG       SER   7 -10.928   0.674   4.206
   54    H    TYR   8           H        TYR   8  -9.455  -1.988   0.914
   55    HA   TYR   8           HA       TYR   8  -6.724  -2.381   1.848
   56    HB2  TYR   8           HB2      TYR   8  -8.148  -4.215   2.156
   57    HB3  TYR   8           HB3      TYR   8  -8.931  -3.996   0.593
   58    HD1  TYR   8           HD1      TYR   8  -5.638  -4.926   2.126
   59    HD2  TYR   8           HD2      TYR   8  -8.278  -5.295  -1.244
   60    HE1  TYR   8           HE2      TYR   8  -4.120  -6.611   1.121
   61    HE2  TYR   8           HE1      TYR   8  -6.762  -6.980  -2.248
   62    HH   TYR   8           HH       TYR   8  -4.450  -7.679  -2.133
   63    H    LEU   9           H        LEU   9  -8.304  -2.302  -1.363
   64    HA   LEU   9           HA       LEU   9  -6.093  -2.980  -2.991
   65    HB2  LEU   9           HB2      LEU   9  -8.641  -1.455  -3.240
   66    HB3  LEU   9           HB3      LEU   9  -7.459  -1.223  -4.528
   67    HG   LEU   9           HG       LEU   9  -8.304  -3.966  -3.566
   68   HD11  LEU   9          HD11      LEU   9 -10.324  -3.074  -4.412
   69   HD12  LEU   9          HD12      LEU   9  -9.625  -3.919  -5.793
   70   HD13  LEU   9          HD13      LEU   9  -9.495  -2.164  -5.675
   71   HD21  LEU   9          HD21      LEU   9  -7.345  -4.678  -5.706
   72   HD22  LEU   9          HD22      LEU   9  -6.148  -3.754  -4.799
   73   HD23  LEU   9          HD23      LEU   9  -7.012  -3.001  -6.139
   74    H    TRP  10           H        TRP  10  -7.018   0.209  -1.660
   75    HA   TRP  10           HA       TRP  10  -4.915   1.673  -3.025
   76    HB2  TRP  10           HB2      TRP  10  -6.835   2.879  -2.307
   77    HB3  TRP  10           HB3      TRP  10  -6.782   2.166  -0.695
   78    HD1  TRP  10           HD1      TRP  10  -4.632   4.503  -2.909
   79    HE1  TRP  10           HE1      TRP  10  -3.439   6.192  -1.370
   80    HE3  TRP  10           HE3      TRP  10  -6.175   2.789   1.648
   81    HZ2  TRP  10           HZ2      TRP  10  -3.178   6.745   1.421
   82    HZ3  TRP  10           HZ3      TRP  10  -5.439   3.915   3.728
   83    HH2  TRP  10           HH2      TRP  10  -3.943   5.890   3.621
   84    H    GLN  11           H        GLN  11  -5.285   0.493   0.350
   85    HA   GLN  11           HA       GLN  11  -2.729   1.378   1.278
   86    HB2  GLN  11           HB2      GLN  11  -4.865   0.497   2.499
   87    HB3  GLN  11           HB3      GLN  11  -4.144  -1.097   2.270
   88    HG2  GLN  11           HG2      GLN  11  -3.290  -0.473   4.358
   89    HG3  GLN  11           HG3      GLN  11  -1.993   0.022   3.271
   90   HE21  GLN  11          HE21      GLN  11  -1.741   2.347   2.845
   91   HE22  GLN  11          HE22      GLN  11  -2.498   3.504   3.828
   92    H    ARG  12           H        ARG  12  -3.727  -1.931   0.255
   93    HA   ARG  12           HA       ARG  12  -1.256  -3.246   0.434
   94    HB2  ARG  12           HB2      ARG  12  -3.750  -3.852  -0.416
   95    HB3  ARG  12           HB3      ARG  12  -2.933  -3.754  -1.976
   96    HG2  ARG  12           HG2      ARG  12  -1.880  -5.384   0.349
   97    HG3  ARG  12           HG3      ARG  12  -2.916  -6.054  -0.911
   98    HD2  ARG  12           HD2      ARG  12  -1.202  -5.179  -2.604
   99    HD3  ARG  12           HD3      ARG  12  -0.125  -4.916  -1.218
  100    HE   ARG  12           HE       ARG  12  -0.339  -7.338  -0.706
  101   HH11  ARG  12          HH11      ARG  12   0.660  -6.830  -3.622
  102   HH12  ARG  12          HH12      ARG  12  -0.196  -8.085  -4.453
  103   HH21  ARG  12          HH21      ARG  12  -2.381  -8.699  -1.817
  104   HH22  ARG  12          HH22      ARG  12  -1.923  -9.152  -3.426
  105    H    TRP  13           H        TRP  13  -2.427  -1.152  -2.198
  106    HA   TRP  13           HA       TRP  13  -0.365  -1.605  -4.104
  107    HB2  TRP  13           HB2      TRP  13  -2.613   0.042  -3.728
  108    HB3  TRP  13           HB3      TRP  13  -1.273   1.160  -3.949
  109    HD1  TRP  13           HD1      TRP  13  -3.621   0.618  -6.078
  110    HE1  TRP  13           HE1      TRP  13  -2.970  -0.096  -8.472
  111    HE3  TRP  13           HE3      TRP  13   1.090  -1.146  -5.218
  112    HZ2  TRP  13           HZ2      TRP  13  -0.739  -1.257  -9.836
  113    HZ3  TRP  13           HZ3      TRP  13   2.456  -2.046  -7.078
  114    HH2  TRP  13           HH2      TRP  13   1.549  -2.103  -9.383
  115    H    GLU  14           H        GLU  14  -0.630   1.112  -1.793
  116    HA   GLU  14           HA       GLU  14   2.113   1.981  -2.240
  117    HB2  GLU  14           HB2      GLU  14  -0.025   2.695  -0.211
  118    HB3  GLU  14           HB3      GLU  14   1.470   3.602  -0.449
  119    HG2  GLU  14           HG2      GLU  14   0.708   3.614  -2.978
  120    HG3  GLU  14           HG3      GLU  14  -0.890   3.327  -2.288
  121    H    ASN  15           H        ASN  15   0.434   0.297   0.457
  122    HA   ASN  15           HA       ASN  15   2.551   0.233   2.325
  123    HB2  ASN  15           HB2      ASN  15   0.032  -0.733   2.210
  124    HB3  ASN  15           HB3      ASN  15   0.918  -2.234   1.939
  125   HD21  ASN  15          HD21      ASN  15   3.149  -1.980   3.578
  126   HD22  ASN  15          HD22      ASN  15   2.673  -1.785   5.196
  127    H    TRP  16           H        TRP  16   1.906  -1.985  -0.416
  128    HA   TRP  16           HA       TRP  16   4.195  -3.692   0.078
  129    HB2  TRP  16           HB2      TRP  16   2.417  -4.565  -1.238
  130    HB3  TRP  16           HB3      TRP  16   2.337  -3.117  -2.240
  131    HD1  TRP  16           HD1      TRP  16   4.446  -6.265  -1.684
  132    HE1  TRP  16           HE1      TRP  16   5.915  -6.650  -3.765
  133    HE3  TRP  16           HE3      TRP  16   3.439  -1.981  -4.281
  134    HZ2  TRP  16           HZ2      TRP  16   6.580  -5.320  -6.204
  135    HZ3  TRP  16           HZ3      TRP  16   4.507  -1.569  -6.480
  136    HH2  TRP  16           HH2      TRP  16   6.075  -3.233  -7.439
  137    H    PHE  17           H        PHE  17   3.600  -0.935  -2.132
  138    HA   PHE  17           HA       PHE  17   6.147  -0.860  -3.395
  139    HB2  PHE  17           HB2      PHE  17   3.967   0.380  -3.917
  140    HB3  PHE  17           HB3      PHE  17   4.420   1.515  -2.645
  141    HD1  PHE  17           HD1      PHE  17   5.545   0.032  -5.874
  142    HD2  PHE  17           HD2      PHE  17   6.034   3.215  -3.032
  143    HE1  PHE  17           HE2      PHE  17   7.017   1.230  -7.470
  144    HE2  PHE  17           HE1      PHE  17   7.505   4.415  -4.629
  145    HZ   PHE  17           HZ       PHE  17   7.997   3.422  -6.847
  146    H    TRP  18           H        TRP  18   4.998   0.749  -0.411
  147    HA   TRP  18           HA       TRP  18   7.546   2.049   0.131
  148    HB2  TRP  18           HB2      TRP  18   5.073   1.495   1.796
  149    HB3  TRP  18           HB3      TRP  18   6.397   2.534   2.315
  150    HD1  TRP  18           HD1      TRP  18   3.241   3.287   1.500
  151    HE1  TRP  18           HE1      TRP  18   2.910   5.279  -0.101
  152    HE3  TRP  18           HE3      TRP  18   7.916   3.563  -0.551
  153    HZ2  TRP  18           HZ2      TRP  18   4.424   6.786  -1.995
  154    HZ3  TRP  18           HZ3      TRP  18   8.439   5.286  -2.248
  155    HH2  TRP  18           HH2      TRP  18   6.701   6.898  -2.973
  156    H    ASN  19           H        ASN  19   6.406  -1.181   0.612
  157    HA   ASN  19           HA       ASN  19   8.350  -1.659   2.829
  158    HB2  ASN  19           HB2      ASN  19   5.871  -2.921   1.764
  159    HB3  ASN  19           HB3      ASN  19   7.068  -4.010   2.462
  160   HD21  ASN  19          HD21      ASN  19   5.355  -0.926   3.250
  161   HD22  ASN  19          HD22      ASN  19   5.292  -1.225   4.920
  162    H    VAL  20           H        VAL  20   7.816  -2.314  -0.586
  163    HA   VAL  20           HA       VAL  20  10.089  -4.257  -0.625
  164    HB   VAL  20           HB       VAL  20   7.979  -3.541  -2.692
  165   HG11  VAL  20          HG11      VAL  20  10.074  -4.495  -3.634
  166   HG12  VAL  20          HG12      VAL  20   8.703  -5.589  -3.820
  167   HG13  VAL  20          HG13      VAL  20   9.901  -5.884  -2.559
  168   HG21  VAL  20          HG21      VAL  20   7.194  -5.926  -2.013
  169   HG22  VAL  20          HG22      VAL  20   6.798  -4.586  -0.937
  170   HG23  VAL  20          HG23      VAL  20   8.142  -5.660  -0.552
  171    H    THR  21           H        THR  21   8.928  -1.251  -2.201
  172    HA   THR  21           HA       THR  21  11.308  -0.990  -3.864
  173    HB   THR  21           HB       THR  21   9.286   1.142  -3.148
  174    HG1  THR  21           HG1      THR  21   7.880  -0.184  -3.947
  175   HG21  THR  21          HG21      THR  21  11.247   1.813  -4.505
  176   HG22  THR  21          HG22      THR  21   9.748   1.913  -5.429
  177   HG23  THR  21          HG23      THR  21  10.847   0.558  -5.680
  178    H    LEU  22           H        LEU  22  10.263   0.356  -0.753
  179    HA   LEU  22           HA       LEU  22  12.394   2.313  -0.563
  180    HB2  LEU  22           HB2      LEU  22  10.522   0.992   1.416
  181    HB3  LEU  22           HB3      LEU  22  11.665   2.245   1.892
  182    HG   LEU  22           HG       LEU  22   9.430   2.511  -0.141
  183   HD11  LEU  22          HD11      LEU  22   9.906   3.507   2.661
  184   HD12  LEU  22          HD12      LEU  22   8.461   2.759   1.983
  185   HD13  LEU  22          HD13      LEU  22   8.875   4.419   1.559
  186   HD21  LEU  22          HD21      LEU  22  11.172   3.851  -1.018
  187   HD22  LEU  22          HD22      LEU  22  11.737   4.320   0.586
  188   HD23  LEU  22          HD23      LEU  22  10.229   4.979  -0.046
  189    H    ARG  23           H        ARG  23  11.903  -0.667   1.348
  190    HA   ARG  23           HA       ARG  23  13.466  -2.083   2.418
  191    HB2  ARG  23           HB2      ARG  23  13.699  -2.172  -0.267
  192    HB3  ARG  23           HB3      ARG  23  15.329  -1.631   0.130
  193    HG2  ARG  23           HG2      ARG  23  14.178  -3.902   1.705
  194    HG3  ARG  23           HG3      ARG  23  14.719  -4.224   0.058
  195    HD2  ARG  23           HD2      ARG  23  16.455  -2.836   2.130
  196    HD3  ARG  23           HD3      ARG  23  16.516  -4.579   1.809
  197    HE   ARG  23           HE       ARG  23  16.702  -3.026  -0.642
  198   HH11  ARG  23          HH11      ARG  23  18.824  -2.001   1.335
  199   HH12  ARG  23          HH12      ARG  23  20.183  -2.978   0.888
  200   HH21  ARG  23          HH21      ARG  23  18.271  -5.257  -0.916
  201   HH22  ARG  23          HH22      ARG  23  19.866  -4.828  -0.397
  202    HA   PRO  24           HA       PRO  24  16.234   1.514   3.567
  203    HB2  PRO  24           HB2      PRO  24  15.187   2.035   6.038
  204    HB3  PRO  24           HB3      PRO  24  14.580   2.793   4.554
  205    HG2  PRO  24           HG2      PRO  24  13.433   0.578   6.150
  206    HG3  PRO  24           HG3      PRO  24  12.619   1.841   5.216
  207    HD2  PRO  24           HD2      PRO  24  12.972  -0.785   4.397
  208    HD3  PRO  24           HD3      PRO  24  12.602   0.585   3.329
  209    H    GLU  25           H        GLU  25  17.719  -0.394   3.631
  210    HA   GLU  25           HA       GLU  25  19.186  -1.870   4.747
  211    HB2  GLU  25           HB2      GLU  25  19.140   0.495   6.021
  212    HB3  GLU  25           HB3      GLU  25  18.519  -0.514   7.328
  213    HG2  GLU  25           HG2      GLU  25  20.536  -1.481   7.681
  214    HG3  GLU  25           HG3      GLU  25  20.817  -1.715   5.956
  215    H    ARG  26           H        ARG  26  16.457  -2.810   4.490
  216    HA   ARG  26           HA       ARG  26  16.162  -4.396   7.024
  217    HB2  ARG  26           HB2      ARG  26  14.267  -2.922   5.255
  218    HB3  ARG  26           HB3      ARG  26  13.693  -4.446   5.931
  219    HG2  ARG  26           HG2      ARG  26  14.739  -3.425   8.165
  220    HG3  ARG  26           HG3      ARG  26  14.420  -1.906   7.328
  221    HD2  ARG  26           HD2      ARG  26  12.158  -3.745   7.096
  222    HD3  ARG  26           HD3      ARG  26  12.547  -3.378   8.789
  223    HE   ARG  26           HE       ARG  26  12.016  -1.297   6.700
  224   HH11  ARG  26          HH11      ARG  26  10.115  -2.060   9.006
  225   HH12  ARG  26          HH12      ARG  26  10.411  -0.758  10.109
  226   HH21  ARG  26          HH21      ARG  26  13.342   0.255   8.541
  227   HH22  ARG  26          HH22      ARG  26  12.243   0.555   9.846
  Start of MODEL   12
    1    HA   ARG   1           HA       ARG   1 -19.710   0.605  -2.915
    2    HB2  ARG   1           HB2      ARG   1 -22.049  -1.218  -3.265
    3    HB3  ARG   1           HB3      ARG   1 -22.037  -0.211  -1.816
    4    HG2  ARG   1           HG2      ARG   1 -22.129   1.773  -3.024
    5    HG3  ARG   1           HG3      ARG   1 -21.397   1.055  -4.459
    6    HD2  ARG   1           HD2      ARG   1 -23.546   1.014  -5.253
    7    HD3  ARG   1           HD3      ARG   1 -23.721  -0.417  -4.219
    8    HE   ARG   1           HE       ARG   1 -24.280   2.333  -3.166
    9   HH11  ARG   1          HH11      ARG   1 -24.417  -0.034  -1.328
   10   HH12  ARG   1          HH12      ARG   1 -26.106  -0.417  -1.352
   11   HH21  ARG   1          HH21      ARG   1 -26.749   1.436  -4.223
   12   HH22  ARG   1          HH22      ARG   1 -27.432   0.419  -2.998
   13    H    SER   2           H        SER   2 -17.740  -0.551  -1.875
   14    HA   SER   2           HA       SER   2 -18.586  -1.639   0.778
   15    HB2  SER   2           HB2      SER   2 -17.627  -3.187  -1.322
   16    HB3  SER   2           HB3      SER   2 -16.188  -2.900  -0.348
   17    HG   SER   2           HG       SER   2 -16.969  -4.260   1.042
   18    H    ALA   3           H        ALA   3 -17.116  -1.133   2.466
   19    HA   ALA   3           HA       ALA   3 -15.154   1.017   1.817
   20    HB1  ALA   3           HB1      ALA   3 -16.957   1.403   3.468
   21    HB2  ALA   3           HB2      ALA   3 -15.368   1.498   4.228
   22    HB3  ALA   3           HB3      ALA   3 -16.358   0.052   4.431
   23    H    LEU   4           H        LEU   4 -15.184  -2.338   2.566
   24    HA   LEU   4           HA       LEU   4 -12.465  -2.250   3.789
   25    HB2  LEU   4           HB2      LEU   4 -14.648  -3.596   4.531
   26    HB3  LEU   4           HB3      LEU   4 -14.040  -4.757   3.350
   27    HG   LEU   4           HG       LEU   4 -11.764  -4.491   4.559
   28   HD11  LEU   4          HD11      LEU   4 -12.056  -3.903   6.990
   29   HD12  LEU   4          HD12      LEU   4 -13.682  -3.338   6.607
   30   HD13  LEU   4          HD13      LEU   4 -12.279  -2.537   5.898
   31   HD21  LEU   4          HD21      LEU   4 -12.419  -6.185   6.246
   32   HD22  LEU   4          HD22      LEU   4 -13.153  -6.524   4.679
   33   HD23  LEU   4          HD23      LEU   4 -14.117  -5.799   5.966
   34    H    VAL   5           H        VAL   5 -13.708  -2.342   0.715
   35    HA   VAL   5           HA       VAL   5 -11.694  -4.305  -0.308
   36    HB   VAL   5           HB       VAL   5 -14.151  -3.009  -1.549
   37   HG11  VAL   5          HG11      VAL   5 -12.334  -3.569  -3.191
   38   HG12  VAL   5          HG12      VAL   5 -13.805  -4.509  -3.430
   39   HG13  VAL   5          HG13      VAL   5 -12.410  -5.242  -2.638
   40   HG21  VAL   5          HG21      VAL   5 -13.586  -5.760  -0.414
   41   HG22  VAL   5          HG22      VAL   5 -14.964  -5.426  -1.462
   42   HG23  VAL   5          HG23      VAL   5 -14.828  -4.618   0.099
   43    H    ASN   6           H        ASN   6 -13.082  -1.116  -1.236
   44    HA   ASN   6           HA       ASN   6 -10.959  -0.371  -3.011
   45    HB2  ASN   6           HB2      ASN   6 -12.967   1.223  -1.382
   46    HB3  ASN   6           HB3      ASN   6 -11.955   1.927  -2.644
   47   HD21  ASN   6          HD21      ASN   6 -12.112   0.611  -4.849
   48   HD22  ASN   6          HD22      ASN   6 -13.675   0.117  -5.291
   49    H    SER   7           H        SER   7 -11.473   0.331   0.470
   50    HA   SER   7           HA       SER   7  -9.241   2.055   0.884
   51    HB2  SER   7           HB2      SER   7 -11.221   1.352   2.413
   52    HB3  SER   7           HB3      SER   7 -10.217  -0.026   2.852
   53    HG   SER   7           HG       SER   7 -10.125   2.236   3.993
   54    H    TYR   8           H        TYR   8  -9.482  -1.507   1.191
   55    HA   TYR   8           HA       TYR   8  -6.710  -1.963   1.838
   56    HB2  TYR   8           HB2      TYR   8  -8.227  -3.689   2.362
   57    HB3  TYR   8           HB3      TYR   8  -9.049  -3.566   0.808
   58    HD1  TYR   8           HD1      TYR   8  -5.735  -4.471   2.308
   59    HD2  TYR   8           HD2      TYR   8  -8.499  -5.043  -0.930
   60    HE1  TYR   8           HE2      TYR   8  -4.296  -6.274   1.398
   61    HE2  TYR   8           HE1      TYR   8  -7.060  -6.846  -1.840
   62    HH   TYR   8           HH       TYR   8  -5.142  -8.520  -0.498
   63    H    LEU   9           H        LEU   9  -8.530  -1.937  -1.232
   64    HA   LEU   9           HA       LEU   9  -6.549  -2.869  -3.014
   65    HB2  LEU   9           HB2      LEU   9  -9.058  -1.403  -3.043
   66    HB3  LEU   9           HB3      LEU   9  -7.977  -0.793  -4.291
   67    HG   LEU   9           HG       LEU   9  -9.484  -2.734  -4.976
   68   HD11  LEU   9          HD11      LEU   9  -6.489  -3.164  -5.181
   69   HD12  LEU   9          HD12      LEU   9  -7.430  -2.084  -6.209
   70   HD13  LEU   9          HD13      LEU   9  -7.711  -3.824  -6.268
   71   HD21  LEU   9          HD21      LEU   9  -7.495  -4.445  -3.484
   72   HD22  LEU   9          HD22      LEU   9  -9.042  -4.916  -4.185
   73   HD23  LEU   9          HD23      LEU   9  -9.001  -3.930  -2.724
   74    H    TRP  10           H        TRP  10  -6.984   0.397  -1.649
   75    HA   TRP  10           HA       TRP  10  -4.780   1.523  -3.241
   76    HB2  TRP  10           HB2      TRP  10  -6.602   2.974  -2.724
   77    HB3  TRP  10           HB3      TRP  10  -6.617   2.480  -1.032
   78    HD1  TRP  10           HD1      TRP  10  -4.081   4.132  -3.461
   79    HE1  TRP  10           HE1      TRP  10  -2.801   5.950  -2.157
   80    HE3  TRP  10           HE3      TRP  10  -6.200   3.565   1.149
   81    HZ2  TRP  10           HZ2      TRP  10  -2.692   7.024   0.492
   82    HZ3  TRP  10           HZ3      TRP  10  -5.491   4.997   3.044
   83    HH2  TRP  10           HH2      TRP  10  -3.741   6.725   2.722
   84    H    GLN  11           H        GLN  11  -5.341   0.689   0.208
   85    HA   GLN  11           HA       GLN  11  -2.771   1.454   1.186
   86    HB2  GLN  11           HB2      GLN  11  -5.071   0.614   2.280
   87    HB3  GLN  11           HB3      GLN  11  -4.199  -0.920   2.318
   88    HG2  GLN  11           HG2      GLN  11  -2.531   1.312   3.200
   89    HG3  GLN  11           HG3      GLN  11  -3.978   1.134   4.191
   90   HE21  GLN  11          HE21      GLN  11  -4.428  -1.393   4.691
   91   HE22  GLN  11          HE22      GLN  11  -3.058  -2.257   5.200
   92    H    ARG  12           H        ARG  12  -3.936  -1.754   0.060
   93    HA   ARG  12           HA       ARG  12  -1.558  -3.247   0.440
   94    HB2  ARG  12           HB2      ARG  12  -3.941  -3.923  -0.318
   95    HB3  ARG  12           HB3      ARG  12  -3.402  -3.511  -1.945
   96    HG2  ARG  12           HG2      ARG  12  -1.473  -5.189  -0.517
   97    HG3  ARG  12           HG3      ARG  12  -3.045  -5.968  -0.693
   98    HD2  ARG  12           HD2      ARG  12  -2.561  -6.421  -2.858
   99    HD3  ARG  12           HD3      ARG  12  -2.417  -4.681  -3.181
  100    HE   ARG  12           HE       ARG  12  -0.102  -6.008  -1.877
  101   HH11  ARG  12          HH11      ARG  12  -0.453  -6.858  -4.769
  102   HH12  ARG  12          HH12      ARG  12   0.522  -5.688  -5.594
  103   HH21  ARG  12          HH21      ARG  12   0.668  -3.516  -2.880
  104   HH22  ARG  12          HH22      ARG  12   1.159  -3.788  -4.519
  105    H    TRP  13           H        TRP  13  -2.538  -1.156  -2.266
  106    HA   TRP  13           HA       TRP  13  -0.479  -1.685  -4.129
  107    HB2  TRP  13           HB2      TRP  13  -2.596   0.127  -3.721
  108    HB3  TRP  13           HB3      TRP  13  -1.169   1.139  -3.908
  109    HD1  TRP  13           HD1      TRP  13  -3.564   0.786  -6.050
  110    HE1  TRP  13           HE1      TRP  13  -2.947   0.098  -8.462
  111    HE3  TRP  13           HE3      TRP  13   1.044  -1.240  -5.229
  112    HZ2  TRP  13           HZ2      TRP  13  -0.777  -1.149  -9.852
  113    HZ3  TRP  13           HZ3      TRP  13   2.365  -2.169  -7.107
  114    HH2  TRP  13           HH2      TRP  13   1.463  -2.126  -9.415
  115    H    GLU  14           H        GLU  14  -0.564   1.047  -1.822
  116    HA   GLU  14           HA       GLU  14   2.227   1.714  -2.162
  117    HB2  GLU  14           HB2      GLU  14   0.163   2.409  -0.048
  118    HB3  GLU  14           HB3      GLU  14   1.702   3.243  -0.264
  119    HG2  GLU  14           HG2      GLU  14   0.768   3.342  -2.808
  120    HG3  GLU  14           HG3      GLU  14  -0.760   3.360  -1.925
  121    H    ASN  15           H        ASN  15   0.465  -0.345   0.132
  122    HA   ASN  15           HA       ASN  15   2.329  -0.647   2.215
  123    HB2  ASN  15           HB2      ASN  15  -0.000  -1.672   1.863
  124    HB3  ASN  15           HB3      ASN  15   0.801  -2.917   0.908
  125   HD21  ASN  15          HD21      ASN  15   2.728  -4.025   2.124
  126   HD22  ASN  15          HD22      ASN  15   2.503  -4.317   3.780
  127    H    TRP  16           H        TRP  16   2.233  -2.390  -0.918
  128    HA   TRP  16           HA       TRP  16   4.690  -3.876  -0.429
  129    HB2  TRP  16           HB2      TRP  16   3.246  -4.883  -1.977
  130    HB3  TRP  16           HB3      TRP  16   2.803  -3.344  -2.713
  131    HD1  TRP  16           HD1      TRP  16   5.638  -5.931  -2.658
  132    HE1  TRP  16           HE1      TRP  16   7.090  -5.607  -4.760
  133    HE3  TRP  16           HE3      TRP  16   3.514  -1.689  -4.557
  134    HZ2  TRP  16           HZ2      TRP  16   7.323  -3.795  -6.955
  135    HZ3  TRP  16           HZ3      TRP  16   4.375  -0.687  -6.654
  136    HH2  TRP  16           HH2      TRP  16   6.277  -1.735  -7.852
  137    H    PHE  17           H        PHE  17   3.833  -0.959  -2.319
  138    HA   PHE  17           HA       PHE  17   6.349  -0.388  -3.473
  139    HB2  PHE  17           HB2      PHE  17   4.160   0.735  -3.922
  140    HB3  PHE  17           HB3      PHE  17   4.276   1.533  -2.353
  141    HD1  PHE  17           HD1      PHE  17   6.106   1.090  -5.586
  142    HD2  PHE  17           HD2      PHE  17   5.467   3.553  -2.124
  143    HE1  PHE  17           HE2      PHE  17   7.512   2.867  -6.590
  144    HE2  PHE  17           HE1      PHE  17   6.874   5.329  -3.130
  145    HZ   PHE  17           HZ       PHE  17   7.897   4.986  -5.362
  146    H    TRP  18           H        TRP  18   5.057   0.591  -0.279
  147    HA   TRP  18           HA       TRP  18   7.474   1.998   0.519
  148    HB2  TRP  18           HB2      TRP  18   5.072   0.902   2.014
  149    HB3  TRP  18           HB3      TRP  18   6.304   1.916   2.760
  150    HD1  TRP  18           HD1      TRP  18   3.065   2.487   1.924
  151    HE1  TRP  18           HE1      TRP  18   2.591   4.763   0.812
  152    HE3  TRP  18           HE3      TRP  18   7.781   3.725   0.391
  153    HZ2  TRP  18           HZ2      TRP  18   4.017   6.830  -0.546
  154    HZ3  TRP  18           HZ3      TRP  18   8.191   5.854  -0.807
  155    HH2  TRP  18           HH2      TRP  18   6.318   7.407  -1.277
  156    H    ASN  19           H        ASN  19   6.129  -1.251   1.239
  157    HA   ASN  19           HA       ASN  19   8.176  -2.075   3.062
  158    HB2  ASN  19           HB2      ASN  19   5.891  -3.107   2.515
  159    HB3  ASN  19           HB3      ASN  19   6.675  -3.845   1.120
  160   HD21  ASN  19          HD21      ASN  19   6.126  -4.193   4.504
  161   HD22  ASN  19          HD22      ASN  19   7.206  -5.475   4.772
  162    H    VAL  20           H        VAL  20   8.002  -2.228  -0.497
  163    HA   VAL  20           HA       VAL  20  10.514  -3.744  -0.708
  164    HB   VAL  20           HB       VAL  20   8.693  -2.377  -2.720
  165   HG11  VAL  20          HG11      VAL  20   9.855  -3.745  -4.407
  166   HG12  VAL  20          HG12      VAL  20  10.944  -4.363  -3.165
  167   HG13  VAL  20          HG13      VAL  20  10.986  -2.655  -3.605
  168   HG21  VAL  20          HG21      VAL  20   7.380  -4.139  -2.114
  169   HG22  VAL  20          HG22      VAL  20   8.717  -4.995  -1.348
  170   HG23  VAL  20          HG23      VAL  20   8.495  -5.086  -3.095
  171    H    THR  21           H        THR  21   9.470  -0.350  -1.148
  172    HA   THR  21           HA       THR  21  12.078   0.519  -2.145
  173    HB   THR  21           HB       THR  21   9.682   2.041  -1.074
  174    HG1  THR  21           HG1      THR  21   8.898   1.241  -2.856
  175   HG21  THR  21          HG21      THR  21  12.095   2.923  -2.677
  176   HG22  THR  21          HG22      THR  21  11.629   3.474  -1.068
  177   HG23  THR  21          HG23      THR  21  10.645   3.903  -2.467
  178    H    LEU  22           H        LEU  22  10.357   0.752   0.967
  179    HA   LEU  22           HA       LEU  22  12.648   2.092   2.251
  180    HB2  LEU  22           HB2      LEU  22  10.042   1.019   3.378
  181    HB3  LEU  22           HB3      LEU  22  11.142   2.124   4.196
  182    HG   LEU  22           HG       LEU  22  10.043   2.861   1.495
  183   HD11  LEU  22          HD11      LEU  22   8.017   3.634   2.355
  184   HD12  LEU  22          HD12      LEU  22   8.619   3.678   4.011
  185   HD13  LEU  22          HD13      LEU  22   8.225   2.134   3.256
  186   HD21  LEU  22          HD21      LEU  22  11.833   4.219   2.525
  187   HD22  LEU  22          HD22      LEU  22  10.837   4.443   3.963
  188   HD23  LEU  22          HD23      LEU  22  10.328   5.134   2.423
  189    H    ARG  23           H        ARG  23  11.297  -1.141   2.018
  190    HA   ARG  23           HA       ARG  23  12.040  -3.218   2.846
  191    HB2  ARG  23           HB2      ARG  23  14.116  -1.918   1.736
  192    HB3  ARG  23           HB3      ARG  23  14.725  -2.021   3.388
  193    HG2  ARG  23           HG2      ARG  23  14.078  -4.518   3.277
  194    HG3  ARG  23           HG3      ARG  23  13.959  -4.277   1.533
  195    HD2  ARG  23           HD2      ARG  23  16.374  -3.124   1.971
  196    HD3  ARG  23           HD3      ARG  23  16.376  -4.337   3.267
  197    HE   ARG  23           HE       ARG  23  16.261  -4.911   0.367
  198   HH11  ARG  23          HH11      ARG  23  14.233  -6.647   1.673
  199   HH12  ARG  23          HH12      ARG  23  15.163  -8.032   2.140
  200   HH21  ARG  23          HH21      ARG  23  18.222  -6.411   1.814
  201   HH22  ARG  23          HH22      ARG  23  17.431  -7.896   2.223
  202    HA   PRO  24           HA       PRO  24  11.785  -1.588   7.202
  203    HB2  PRO  24           HB2      PRO  24   9.417  -2.804   7.839
  204    HB3  PRO  24           HB3      PRO  24   9.510  -1.195   7.097
  205    HG2  PRO  24           HG2      PRO  24   8.894  -3.822   5.852
  206    HG3  PRO  24           HG3      PRO  24   8.218  -2.222   5.510
  207    HD2  PRO  24           HD2      PRO  24  10.119  -3.447   3.965
  208    HD3  PRO  24           HD3      PRO  24   9.891  -1.687   4.057
  209    H    GLU  25           H        GLU  25  12.273  -2.835   9.072
  210    HA   GLU  25           HA       GLU  25  13.015  -5.669   8.540
  211    HB2  GLU  25           HB2      GLU  25  13.653  -3.664  10.730
  212    HB3  GLU  25           HB3      GLU  25  14.255  -5.322  10.722
  213    HG2  GLU  25           HG2      GLU  25  15.348  -4.921   8.545
  214    HG3  GLU  25           HG3      GLU  25  14.747  -3.264   8.546
  215    H    ARG  26           H        ARG  26  11.342  -3.769  11.095
  216    HA   ARG  26           HA       ARG  26   9.593  -6.140  11.605
  217    HB2  ARG  26           HB2      ARG  26  11.747  -5.453  13.169
  218    HB3  ARG  26           HB3      ARG  26  10.439  -4.584  13.972
  219    HG2  ARG  26           HG2      ARG  26  10.024  -7.448  13.170
  220    HG3  ARG  26           HG3      ARG  26  10.943  -7.085  14.631
  221    HD2  ARG  26           HD2      ARG  26   9.091  -6.344  15.767
  222    HD3  ARG  26           HD3      ARG  26   8.382  -5.598  14.321
  223    HE   ARG  26           HE       ARG  26   8.438  -8.576  14.664
  224   HH11  ARG  26          HH11      ARG  26   7.382  -6.616  12.351
  225   HH12  ARG  26          HH12      ARG  26   5.684  -6.903  12.533
  226   HH21  ARG  26          HH21      ARG  26   6.016  -8.514  15.596
  227   HH22  ARG  26          HH22      ARG  26   4.908  -7.979  14.377
  Start of MODEL   13
    1    HA   ARG   1           HA       ARG   1 -14.494   2.063  -5.593
    2    HB2  ARG   1           HB2      ARG   1 -13.621   4.145  -4.547
    3    HB3  ARG   1           HB3      ARG   1 -13.693   4.279  -6.303
    4    HG2  ARG   1           HG2      ARG   1 -15.531   5.730  -6.249
    5    HG3  ARG   1           HG3      ARG   1 -16.029   5.200  -4.643
    6    HD2  ARG   1           HD2      ARG   1 -15.057   7.258  -4.120
    7    HD3  ARG   1           HD3      ARG   1 -13.639   6.201  -3.966
    8    HE   ARG   1           HE       ARG   1 -13.221   6.766  -6.445
    9   HH11  ARG   1          HH11      ARG   1 -15.661   8.491  -6.762
   10   HH12  ARG   1          HH12      ARG   1 -15.012  10.081  -6.550
   11   HH21  ARG   1          HH21      ARG   1 -12.059   8.963  -5.094
   12   HH22  ARG   1          HH22      ARG   1 -12.963  10.350  -5.601
   13    H    SER   2           H        SER   2 -14.449   1.949  -3.191
   14    HA   SER   2           HA       SER   2 -17.127   2.484  -1.940
   15    HB2  SER   2           HB2      SER   2 -15.833   0.031  -2.530
   16    HB3  SER   2           HB3      SER   2 -15.732   0.237  -0.783
   17    HG   SER   2           HG       SER   2 -17.683  -0.741  -1.300
   18    H    ALA   3           H        ALA   3 -16.904   2.372   0.556
   19    HA   ALA   3           HA       ALA   3 -14.640   4.109   1.355
   20    HB1  ALA   3           HB1      ALA   3 -16.023   4.447   3.348
   21    HB2  ALA   3           HB2      ALA   3 -17.076   3.115   2.872
   22    HB3  ALA   3           HB3      ALA   3 -17.029   4.593   1.908
   23    H    LEU   4           H        LEU   4 -16.044   0.939   2.263
   24    HA   LEU   4           HA       LEU   4 -13.670   0.415   4.000
   25    HB2  LEU   4           HB2      LEU   4 -16.501  -0.136   4.064
   26    HB3  LEU   4           HB3      LEU   4 -15.609  -1.656   4.143
   27    HG   LEU   4           HG       LEU   4 -14.361   0.361   5.819
   28   HD11  LEU   4          HD11      LEU   4 -17.259  -0.332   6.388
   29   HD12  LEU   4          HD12      LEU   4 -16.636   1.271   5.996
   30   HD13  LEU   4          HD13      LEU   4 -16.173   0.490   7.508
   31   HD21  LEU   4          HD21      LEU   4 -15.755  -2.178   6.683
   32   HD22  LEU   4          HD22      LEU   4 -14.327  -1.419   7.387
   33   HD23  LEU   4          HD23      LEU   4 -14.217  -2.221   5.820
   34    H    VAL   5           H        VAL   5 -14.117   0.085   0.844
   35    HA   VAL   5           HA       VAL   5 -13.003  -2.703   0.728
   36    HB   VAL   5           HB       VAL   5 -14.647  -1.197  -1.340
   37   HG11  VAL   5          HG11      VAL   5 -14.836  -3.462  -2.377
   38   HG12  VAL   5          HG12      VAL   5 -13.699  -4.073  -1.174
   39   HG13  VAL   5          HG13      VAL   5 -13.177  -2.863  -2.347
   40   HG21  VAL   5          HG21      VAL   5 -16.410  -2.905  -0.702
   41   HG22  VAL   5          HG22      VAL   5 -16.076  -1.701   0.542
   42   HG23  VAL   5          HG23      VAL   5 -15.404  -3.326   0.684
   43    H    ASN   6           H        ASN   6 -13.041   0.462  -0.973
   44    HA   ASN   6           HA       ASN   6 -10.719  -0.026  -2.593
   45    HB2  ASN   6           HB2      ASN   6 -12.546   2.145  -1.891
   46    HB3  ASN   6           HB3      ASN   6 -10.899   2.726  -2.135
   47   HD21  ASN   6          HD21      ASN   6 -10.039   2.678  -4.283
   48   HD22  ASN   6          HD22      ASN   6 -10.944   2.170  -5.626
   49    H    SER   7           H        SER   7 -11.095   1.186   0.727
   50    HA   SER   7           HA       SER   7  -8.558   2.348   1.175
   51    HB2  SER   7           HB2      SER   7 -10.623   2.158   2.689
   52    HB3  SER   7           HB3      SER   7 -10.047   0.547   3.106
   53    HG   SER   7           HG       SER   7  -9.014   3.058   3.738
   54    H    TYR   8           H        TYR   8  -9.530  -1.086   1.480
   55    HA   TYR   8           HA       TYR   8  -6.874  -2.049   2.150
   56    HB2  TYR   8           HB2      TYR   8  -8.752  -3.356   2.811
   57    HB3  TYR   8           HB3      TYR   8  -9.486  -3.256   1.211
   58    HD1  TYR   8           HD1      TYR   8  -6.345  -4.477   2.866
   59    HD2  TYR   8           HD2      TYR   8  -9.242  -5.055  -0.251
   60    HE1  TYR   8           HE1      TYR   8  -5.213  -6.581   2.204
   61    HE2  TYR   8           HE2      TYR   8  -8.113  -7.160  -0.910
   62    HH   TYR   8           HH       TYR   8  -6.328  -8.891   0.761
   63    H    LEU   9           H        LEU   9  -8.772  -1.814  -0.867
   64    HA   LEU   9           HA       LEU   9  -6.958  -3.187  -2.596
   65    HB2  LEU   9           HB2      LEU   9  -9.252  -1.325  -2.763
   66    HB3  LEU   9           HB3      LEU   9  -8.184  -1.289  -4.163
   67    HG   LEU   9           HG       LEU   9  -9.988  -2.960  -4.447
   68   HD11  LEU   9          HD11      LEU   9  -7.430  -4.489  -3.996
   69   HD12  LEU   9          HD12      LEU   9  -7.540  -3.274  -5.269
   70   HD13  LEU   9          HD13      LEU   9  -8.613  -4.673  -5.291
   71   HD21  LEU   9          HD21      LEU   9 -10.068  -4.936  -3.002
   72   HD22  LEU   9          HD22      LEU   9 -10.261  -3.481  -2.026
   73   HD23  LEU   9          HD23      LEU   9  -8.713  -4.323  -2.055
   74    H    TRP  10           H        TRP  10  -7.275   0.311  -1.871
   75    HA   TRP  10           HA       TRP  10  -5.020   1.147  -3.459
   76    HB2  TRP  10           HB2      TRP  10  -6.567   2.820  -2.876
   77    HB3  TRP  10           HB3      TRP  10  -6.689   2.261  -1.209
   78    HD1  TRP  10           HD1      TRP  10  -4.118   3.960  -3.546
   79    HE1  TRP  10           HE1      TRP  10  -2.607   5.477  -2.109
   80    HE3  TRP  10           HE3      TRP  10  -5.936   2.867   1.099
   81    HZ2  TRP  10           HZ2      TRP  10  -2.225   6.140   0.645
   82    HZ3  TRP  10           HZ3      TRP  10  -4.980   3.953   3.110
   83    HH2  TRP  10           HH2      TRP  10  -3.128   5.587   2.890
   84    H    GLN  11           H        GLN  11  -5.377   0.207  -0.030
   85    HA   GLN  11           HA       GLN  11  -2.742   0.856   0.858
   86    HB2  GLN  11           HB2      GLN  11  -5.003  -0.904   1.677
   87    HB3  GLN  11           HB3      GLN  11  -3.432  -1.280   2.382
   88    HG2  GLN  11           HG2      GLN  11  -4.278   1.584   2.348
   89    HG3  GLN  11           HG3      GLN  11  -5.070   0.511   3.502
   90   HE21  GLN  11          HE21      GLN  11  -3.660  -0.607   5.104
   91   HE22  GLN  11          HE22      GLN  11  -2.132   0.031   5.477
   92    H    ARG  12           H        ARG  12  -4.045  -2.162  -0.573
   93    HA   ARG  12           HA       ARG  12  -1.737  -3.798  -0.362
   94    HB2  ARG  12           HB2      ARG  12  -4.133  -3.583  -2.145
   95    HB3  ARG  12           HB3      ARG  12  -2.846  -4.690  -2.625
   96    HG2  ARG  12           HG2      ARG  12  -3.839  -4.748   0.209
   97    HG3  ARG  12           HG3      ARG  12  -4.793  -5.533  -1.050
   98    HD2  ARG  12           HD2      ARG  12  -2.038  -6.262  -1.437
   99    HD3  ARG  12           HD3      ARG  12  -2.475  -6.563   0.258
  100    HE   ARG  12           HE       ARG  12  -4.469  -7.835  -0.616
  101   HH11  ARG  12          HH11      ARG  12  -4.332  -6.989  -3.471
  102   HH12  ARG  12          HH12      ARG  12  -3.559  -8.341  -4.226
  103   HH21  ARG  12          HH21      ARG  12  -2.374  -9.664  -1.238
  104   HH22  ARG  12          HH22      ARG  12  -2.446  -9.864  -2.956
  105    H    TRP  13           H        TRP  13  -2.382  -1.103  -2.526
  106    HA   TRP  13           HA       TRP  13  -0.326  -1.783  -4.484
  107    HB2  TRP  13           HB2      TRP  13  -2.524  -0.116  -4.311
  108    HB3  TRP  13           HB3      TRP  13  -1.187   1.024  -4.192
  109    HD1  TRP  13           HD1      TRP  13  -3.071   0.916  -6.710
  110    HE1  TRP  13           HE1      TRP  13  -2.078   0.411  -9.037
  111    HE3  TRP  13           HE3      TRP  13   1.269  -1.397  -5.337
  112    HZ2  TRP  13           HZ2      TRP  13   0.249  -0.810 -10.163
  113    HZ3  TRP  13           HZ3      TRP  13   2.852  -2.219  -7.054
  114    HH2  TRP  13           HH2      TRP  13   2.351  -1.928  -9.463
  115    H    GLU  14           H        GLU  14  -0.596   0.928  -2.157
  116    HA   GLU  14           HA       GLU  14   2.199   1.640  -2.348
  117    HB2  GLU  14           HB2      GLU  14  -0.011   2.308  -0.383
  118    HB3  GLU  14           HB3      GLU  14   1.545   3.135  -0.443
  119    HG2  GLU  14           HG2      GLU  14   0.851   3.282  -3.058
  120    HG3  GLU  14           HG3      GLU  14  -0.752   3.291  -2.322
  121    H    ASN  15           H        ASN  15   0.390  -0.518  -0.187
  122    HA   ASN  15           HA       ASN  15   2.173  -0.727   1.997
  123    HB2  ASN  15           HB2      ASN  15   0.082  -1.863   2.085
  124    HB3  ASN  15           HB3      ASN  15   0.373  -2.687   0.555
  125   HD21  ASN  15          HD21      ASN  15   2.579  -2.395   3.403
  126   HD22  ASN  15          HD22      ASN  15   2.706  -4.068   3.654
  127    H    TRP  16           H        TRP  16   2.198  -2.652  -1.042
  128    HA   TRP  16           HA       TRP  16   4.663  -4.034  -0.477
  129    HB2  TRP  16           HB2      TRP  16   3.331  -5.006  -2.147
  130    HB3  TRP  16           HB3      TRP  16   2.941  -3.450  -2.878
  131    HD1  TRP  16           HD1      TRP  16   5.808  -5.995  -2.624
  132    HE1  TRP  16           HE1      TRP  16   7.407  -5.633  -4.612
  133    HE3  TRP  16           HE3      TRP  16   3.738  -1.795  -4.666
  134    HZ2  TRP  16           HZ2      TRP  16   7.764  -3.803  -6.777
  135    HZ3  TRP  16           HZ3      TRP  16   4.732  -0.763  -6.689
  136    HH2  TRP  16           HH2      TRP  16   6.739  -1.762  -7.747
  137    H    PHE  17           H        PHE  17   3.906  -1.067  -2.322
  138    HA   PHE  17           HA       PHE  17   6.483  -0.446  -3.306
  139    HB2  PHE  17           HB2      PHE  17   4.264   0.649  -3.816
  140    HB3  PHE  17           HB3      PHE  17   4.368   1.467  -2.257
  141    HD1  PHE  17           HD1      PHE  17   6.432   0.879  -5.341
  142    HD2  PHE  17           HD2      PHE  17   5.370   3.571  -2.164
  143    HE1  PHE  17           HE2      PHE  17   7.854   2.639  -6.356
  144    HE2  PHE  17           HE1      PHE  17   6.792   5.330  -3.181
  145    HZ   PHE  17           HZ       PHE  17   8.033   4.864  -5.277
  146    H    TRP  18           H        TRP  18   4.970   0.892  -0.327
  147    HA   TRP  18           HA       TRP  18   7.344   2.097   0.706
  148    HB2  TRP  18           HB2      TRP  18   4.881   0.987   2.090
  149    HB3  TRP  18           HB3      TRP  18   6.041   2.080   2.840
  150    HD1  TRP  18           HD1      TRP  18   2.818   2.488   1.823
  151    HE1  TRP  18           HE1      TRP  18   2.321   4.696   0.587
  152    HE3  TRP  18           HE3      TRP  18   7.560   3.839   0.485
  153    HZ2  TRP  18           HZ2      TRP  18   3.746   6.756  -0.785
  154    HZ3  TRP  18           HZ3      TRP  18   7.959   5.928  -0.784
  155    HH2  TRP  18           HH2      TRP  18   6.059   7.388  -1.420
  156    H    ASN  19           H        ASN  19   6.088  -1.221   0.993
  157    HA   ASN  19           HA       ASN  19   7.723  -2.185   3.107
  158    HB2  ASN  19           HB2      ASN  19   5.965  -3.190   1.105
  159    HB3  ASN  19           HB3      ASN  19   7.443  -4.142   1.005
  160   HD21  ASN  19          HD21      ASN  19   8.304  -4.723   3.415
  161   HD22  ASN  19          HD22      ASN  19   7.100  -5.309   4.458
  162    H    VAL  20           H        VAL  20   8.451  -1.861  -0.383
  163    HA   VAL  20           HA       VAL  20  11.220  -2.844   0.090
  164    HB   VAL  20           HB       VAL  20  11.334  -2.752  -2.408
  165   HG11  VAL  20          HG11      VAL  20   9.752  -4.575  -2.805
  166   HG12  VAL  20          HG12      VAL  20   8.862  -4.149  -1.344
  167   HG13  VAL  20          HG13      VAL  20  10.507  -4.773  -1.223
  168   HG21  VAL  20          HG21      VAL  20   9.660  -0.825  -2.572
  169   HG22  VAL  20          HG22      VAL  20   8.396  -2.025  -2.310
  170   HG23  VAL  20          HG23      VAL  20   9.435  -2.137  -3.728
  171    H    THR  21           H        THR  21   9.471   0.143  -0.645
  172    HA   THR  21           HA       THR  21  11.761   1.722  -1.421
  173    HB   THR  21           HB       THR  21   9.090   2.486  -0.189
  174    HG1  THR  21           HG1      THR  21   9.950   2.272  -2.886
  175   HG21  THR  21          HG21      THR  21  11.072   4.130  -1.788
  176   HG22  THR  21          HG22      THR  21  10.743   4.308  -0.065
  177   HG23  THR  21          HG23      THR  21   9.488   4.680  -1.246
  178    H    LEU  22           H        LEU  22  10.103   1.197   1.688
  179    HA   LEU  22           HA       LEU  22  11.930   2.955   3.156
  180    HB2  LEU  22           HB2      LEU  22   9.774   0.979   3.956
  181    HB3  LEU  22           HB3      LEU  22  10.629   2.002   5.109
  182    HG   LEU  22           HG       LEU  22   9.129   3.097   2.712
  183   HD11  LEU  22          HD11      LEU  22   7.363   3.705   4.349
  184   HD12  LEU  22          HD12      LEU  22   8.227   2.806   5.596
  185   HD13  LEU  22          HD13      LEU  22   7.550   1.957   4.205
  186   HD21  LEU  22          HD21      LEU  22  10.509   4.257   5.127
  187   HD22  LEU  22          HD22      LEU  22   9.196   5.139   4.348
  188   HD23  LEU  22          HD23      LEU  22  10.649   4.737   3.435
  189    H    ARG  23           H        ARG  23  11.178  -0.492   3.723
  190    HA   ARG  23           HA       ARG  23  14.051  -1.187   3.714
  191    HB2  ARG  23           HB2      ARG  23  12.946  -0.210   6.017
  192    HB3  ARG  23           HB3      ARG  23  12.635  -1.935   6.213
  193    HG2  ARG  23           HG2      ARG  23  14.759  -2.001   7.023
  194    HG3  ARG  23           HG3      ARG  23  15.224  -1.964   5.323
  195    HD2  ARG  23           HD2      ARG  23  14.707   0.736   6.160
  196    HD3  ARG  23           HD3      ARG  23  15.814  -0.015   7.325
  197    HE   ARG  23           HE       ARG  23  16.884  -0.857   4.964
  198   HH11  ARG  23          HH11      ARG  23  15.328   1.623   3.901
  199   HH12  ARG  23          HH12      ARG  23  16.610   2.789   3.864
  200   HH21  ARG  23          HH21      ARG  23  18.744   0.896   5.852
  201   HH22  ARG  23          HH22      ARG  23  18.553   2.375   4.972
  202    HA   PRO  24           HA       PRO  24  11.424  -4.622   2.259
  203    HB2  PRO  24           HB2      PRO  24  13.300  -5.641   0.544
  204    HB3  PRO  24           HB3      PRO  24  12.216  -4.304   0.112
  205    HG2  PRO  24           HG2      PRO  24  15.068  -4.233   0.953
  206    HG3  PRO  24           HG3      PRO  24  14.220  -3.250  -0.251
  207    HD2  PRO  24           HD2      PRO  24  14.840  -2.372   2.260
  208    HD3  PRO  24           HD3      PRO  24  13.477  -1.753   1.305
  209    H    GLU  25           H        GLU  25  11.334  -6.458   3.486
  210    HA   GLU  25           HA       GLU  25  13.769  -7.392   4.912
  211    HB2  GLU  25           HB2      GLU  25  11.378  -6.931   5.866
  212    HB3  GLU  25           HB3      GLU  25  10.970  -8.495   5.161
  213    HG2  GLU  25           HG2      GLU  25  13.374  -8.167   6.957
  214    HG3  GLU  25           HG3      GLU  25  11.769  -8.473   7.620
  215    H    ARG  26           H        ARG  26  11.069  -8.972   3.129
  216    HA   ARG  26           HA       ARG  26  13.062 -10.897   1.987
  217    HB2  ARG  26           HB2      ARG  26  11.228 -11.417   4.004
  218    HB3  ARG  26           HB3      ARG  26  10.388 -11.972   2.558
  219    HG2  ARG  26           HG2      ARG  26  11.597 -13.878   3.100
  220    HG3  ARG  26           HG3      ARG  26  12.729 -13.079   2.008
  221    HD2  ARG  26           HD2      ARG  26  13.814 -12.011   4.026
  222    HD3  ARG  26           HD3      ARG  26  12.782 -13.032   5.046
  223    HE   ARG  26           HE       ARG  26  15.007 -13.975   3.360
  224   HH11  ARG  26          HH11      ARG  26  14.187 -14.833   6.209
  225   HH12  ARG  26          HH12      ARG  26  13.645 -16.449   5.911
  226   HH21  ARG  26          HH21      ARG  26  13.415 -16.015   2.467
  227   HH22  ARG  26          HH22      ARG  26  13.208 -17.124   3.782
  Start of MODEL   14
    1    HA   ARG   1           HA       ARG   1 -18.757   0.643  -6.125
    2    HB2  ARG   1           HB2      ARG   1 -20.087  -1.846  -7.137
    3    HB3  ARG   1           HB3      ARG   1 -20.807  -1.032  -5.749
    4    HG2  ARG   1           HG2      ARG   1 -21.629   0.618  -7.046
    5    HG3  ARG   1           HG3      ARG   1 -20.057   0.886  -7.801
    6    HD2  ARG   1           HD2      ARG   1 -21.438   0.198  -9.609
    7    HD3  ARG   1           HD3      ARG   1 -20.595  -1.294  -9.149
    8    HE   ARG   1           HE       ARG   1 -23.278  -0.642  -7.991
    9   HH11  ARG   1          HH11      ARG   1 -22.054  -3.129  -7.051
   10   HH12  ARG   1          HH12      ARG   1 -22.664  -4.321  -8.149
   11   HH21  ARG   1          HH21      ARG   1 -23.649  -1.994 -10.538
   12   HH22  ARG   1          HH22      ARG   1 -23.570  -3.676 -10.131
   13    H    SER   2           H        SER   2 -16.856   0.183  -4.610
   14    HA   SER   2           HA       SER   2 -17.776  -1.577  -2.378
   15    HB2  SER   2           HB2      SER   2 -15.401  -1.848  -4.116
   16    HB3  SER   2           HB3      SER   2 -15.065  -1.971  -2.393
   17    HG   SER   2           HG       SER   2 -15.643  -3.989  -3.359
   18    H    ALA   3           H        ALA   3 -17.212  -0.762  -0.335
   19    HA   ALA   3           HA       ALA   3 -15.992   1.967  -0.311
   20    HB1  ALA   3           HB1      ALA   3 -17.671   0.449   1.712
   21    HB2  ALA   3           HB2      ALA   3 -18.281   1.645   0.568
   22    HB3  ALA   3           HB3      ALA   3 -17.178   2.136   1.855
   23    H    LEU   4           H        LEU   4 -15.860  -1.163   1.441
   24    HA   LEU   4           HA       LEU   4 -13.449  -0.308   2.922
   25    HB2  LEU   4           HB2      LEU   4 -15.430  -2.537   2.956
   26    HB3  LEU   4           HB3      LEU   4 -13.830  -2.881   3.612
   27    HG   LEU   4           HG       LEU   4 -15.155  -0.336   4.449
   28   HD11  LEU   4          HD11      LEU   4 -16.948  -2.029   4.647
   29   HD12  LEU   4          HD12      LEU   4 -16.381  -1.509   6.234
   30   HD13  LEU   4          HD13      LEU   4 -15.862  -3.063   5.578
   31   HD21  LEU   4          HD21      LEU   4 -13.926  -0.768   6.494
   32   HD22  LEU   4          HD22      LEU   4 -12.833  -1.043   5.138
   33   HD23  LEU   4          HD23      LEU   4 -13.559  -2.413   5.979
   34    H    VAL   5           H        VAL   5 -14.328  -2.591   0.355
   35    HA   VAL   5           HA       VAL   5 -11.873  -4.009   0.121
   36    HB   VAL   5           HB       VAL   5 -13.939  -3.168  -1.939
   37   HG11  VAL   5          HG11      VAL   5 -11.600  -5.062  -2.084
   38   HG12  VAL   5          HG12      VAL   5 -12.091  -3.828  -3.243
   39   HG13  VAL   5          HG13      VAL   5 -13.028  -5.313  -3.087
   40   HG21  VAL   5          HG21      VAL   5 -14.801  -5.466  -1.570
   41   HG22  VAL   5          HG22      VAL   5 -14.835  -4.517  -0.084
   42   HG23  VAL   5          HG23      VAL   5 -13.568  -5.718  -0.335
   43    H    ASN   6           H        ASN   6 -12.898  -0.920  -1.365
   44    HA   ASN   6           HA       ASN   6 -10.580  -0.494  -2.994
   45    HB2  ASN   6           HB2      ASN   6 -12.915   0.981  -1.987
   46    HB3  ASN   6           HB3      ASN   6 -11.505   2.012  -2.233
   47   HD21  ASN   6          HD21      ASN   6 -14.117   0.521  -3.851
   48   HD22  ASN   6          HD22      ASN   6 -13.550   0.714  -5.439
   49    H    SER   7           H        SER   7 -11.267   0.316   0.419
   50    HA   SER   7           HA       SER   7  -8.986   1.944   0.950
   51    HB2  SER   7           HB2      SER   7 -10.465  -0.051   2.702
   52    HB3  SER   7           HB3      SER   7  -9.409   1.225   3.298
   53    HG   SER   7           HG       SER   7 -10.925   2.648   2.916
   54    H    TYR   8           H        TYR   8  -9.421  -1.596   1.333
   55    HA   TYR   8           HA       TYR   8  -6.704  -2.164   2.094
   56    HB2  TYR   8           HB2      TYR   8  -8.354  -3.797   2.567
   57    HB3  TYR   8           HB3      TYR   8  -9.038  -3.701   0.946
   58    HD1  TYR   8           HD1      TYR   8  -5.812  -4.561   2.665
   59    HD2  TYR   8           HD2      TYR   8  -8.478  -5.345  -0.610
   60    HE1  TYR   8           HE2      TYR   8  -4.359  -6.430   1.929
   61    HE2  TYR   8           HE1      TYR   8  -7.025  -7.214  -1.346
   62    HH   TYR   8           HH       TYR   8  -4.287  -7.678  -0.930
   63    H    LEU   9           H        LEU   9  -8.399  -2.286  -1.063
   64    HA   LEU   9           HA       LEU   9  -6.230  -3.181  -2.675
   65    HB2  LEU   9           HB2      LEU   9  -8.854  -1.901  -2.960
   66    HB3  LEU   9           HB3      LEU   9  -7.735  -1.415  -4.230
   67    HG   LEU   9           HG       LEU   9  -9.033  -3.452  -4.837
   68   HD11  LEU   9          HD11      LEU   9  -7.174  -4.680  -5.706
   69   HD12  LEU   9          HD12      LEU   9  -6.120  -4.141  -4.399
   70   HD13  LEU   9          HD13      LEU   9  -6.655  -2.996  -5.630
   71   HD21  LEU   9          HD21      LEU   9  -8.984  -4.235  -2.343
   72   HD22  LEU   9          HD22      LEU   9  -7.431  -4.951  -2.772
   73   HD23  LEU   9          HD23      LEU   9  -8.896  -5.454  -3.614
   74    H    TRP  10           H        TRP  10  -7.215   0.135  -1.767
   75    HA   TRP  10           HA       TRP  10  -5.135   1.496  -3.235
   76    HB2  TRP  10           HB2      TRP  10  -7.115   2.671  -2.550
   77    HB3  TRP  10           HB3      TRP  10  -6.916   2.165  -0.874
   78    HD1  TRP  10           HD1      TRP  10  -4.695   4.056  -3.436
   79    HE1  TRP  10           HE1      TRP  10  -3.621   6.063  -2.226
   80    HE3  TRP  10           HE3      TRP  10  -6.669   3.427   1.232
   81    HZ2  TRP  10           HZ2      TRP  10  -3.606   7.248   0.378
   82    HZ3  TRP  10           HZ3      TRP  10  -6.108   5.009   3.056
   83    HH2  TRP  10           HH2      TRP  10  -4.582   6.916   2.636
   84    H    GLN  11           H        GLN  11  -5.418   0.383   0.156
   85    HA   GLN  11           HA       GLN  11  -2.896   1.411   1.072
   86    HB2  GLN  11           HB2      GLN  11  -4.755  -0.823   1.921
   87    HB3  GLN  11           HB3      GLN  11  -3.283  -0.455   2.820
   88    HG2  GLN  11           HG2      GLN  11  -5.302   1.691   2.157
   89    HG3  GLN  11           HG3      GLN  11  -5.454   0.696   3.604
   90   HE21  GLN  11          HE21      GLN  11  -3.455   3.178   2.038
   91   HE22  GLN  11          HE22      GLN  11  -2.544   3.558   3.418
   92    H    ARG  12           H        ARG  12  -3.813  -1.889  -0.033
   93    HA   ARG  12           HA       ARG  12  -1.295  -3.148   0.150
   94    HB2  ARG  12           HB2      ARG  12  -3.688  -3.967  -0.526
   95    HB3  ARG  12           HB3      ARG  12  -3.183  -3.567  -2.167
   96    HG2  ARG  12           HG2      ARG  12  -1.407  -5.254  -0.419
   97    HG3  ARG  12           HG3      ARG  12  -2.768  -5.990  -1.266
   98    HD2  ARG  12           HD2      ARG  12  -1.799  -4.726  -3.365
   99    HD3  ARG  12           HD3      ARG  12  -0.299  -4.712  -2.418
  100    HE   ARG  12           HE       ARG  12  -1.489  -7.331  -2.320
  101   HH11  ARG  12          HH11      ARG  12  -1.665  -6.776  -5.248
  102   HH12  ARG  12          HH12      ARG  12  -0.114  -7.293  -5.818
  103   HH21  ARG  12          HH21      ARG  12   1.336  -7.301  -2.660
  104   HH22  ARG  12          HH22      ARG  12   1.592  -7.593  -4.348
  105    H    TRP  13           H        TRP  13  -2.549  -0.985  -2.371
  106    HA   TRP  13           HA       TRP  13  -0.544  -1.360  -4.364
  107    HB2  TRP  13           HB2      TRP  13  -2.796   0.266  -3.834
  108    HB3  TRP  13           HB3      TRP  13  -1.465   1.383  -4.122
  109    HD1  TRP  13           HD1      TRP  13  -3.966   0.763  -6.100
  110    HE1  TRP  13           HE1      TRP  13  -3.437   0.095  -8.536
  111    HE3  TRP  13           HE3      TRP  13   0.865  -0.781  -5.552
  112    HZ2  TRP  13           HZ2      TRP  13  -1.244  -0.952 -10.050
  113    HZ3  TRP  13           HZ3      TRP  13   2.152  -1.605  -7.502
  114    HH2  TRP  13           HH2      TRP  13   1.106  -1.692  -9.748
  115    H    GLU  14           H        GLU  14  -0.776   1.214  -1.890
  116    HA   GLU  14           HA       GLU  14   1.931   2.175  -2.405
  117    HB2  GLU  14           HB2      GLU  14  -0.116   2.746  -0.238
  118    HB3  GLU  14           HB3      GLU  14   1.329   3.713  -0.546
  119    HG2  GLU  14           HG2      GLU  14   0.383   3.771  -3.018
  120    HG3  GLU  14           HG3      GLU  14  -1.148   3.421  -2.217
  121    H    ASN  15           H        ASN  15   0.374   0.337   0.259
  122    HA   ASN  15           HA       ASN  15   2.567   0.215   2.047
  123    HB2  ASN  15           HB2      ASN  15   0.021  -0.757   1.941
  124    HB3  ASN  15           HB3      ASN  15   0.941  -2.244   1.711
  125   HD21  ASN  15          HD21      ASN  15   2.996  -2.269   3.365
  126   HD22  ASN  15          HD22      ASN  15   2.586  -1.884   4.966
  127    H    TRP  16           H        TRP  16   1.861  -1.812  -0.813
  128    HA   TRP  16           HA       TRP  16   3.968  -3.726  -0.430
  129    HB2  TRP  16           HB2      TRP  16   2.313  -4.289  -2.012
  130    HB3  TRP  16           HB3      TRP  16   2.337  -2.685  -2.744
  131    HD1  TRP  16           HD1      TRP  16   4.575  -5.819  -2.456
  132    HE1  TRP  16           HE1      TRP  16   6.065  -5.944  -4.554
  133    HE3  TRP  16           HE3      TRP  16   3.243  -1.451  -4.742
  134    HZ2  TRP  16           HZ2      TRP  16   6.621  -4.396  -6.890
  135    HZ3  TRP  16           HZ3      TRP  16   4.271  -0.801  -6.902
  136    HH2  TRP  16           HH2      TRP  16   5.956  -2.267  -7.978
  137    H    PHE  17           H        PHE  17   3.848  -0.707  -2.370
  138    HA   PHE  17           HA       PHE  17   6.500  -0.730  -3.368
  139    HB2  PHE  17           HB2      PHE  17   4.899   0.836  -4.204
  140    HB3  PHE  17           HB3      PHE  17   4.539   1.445  -2.590
  141    HD1  PHE  17           HD1      PHE  17   7.325   1.164  -5.078
  142    HD2  PHE  17           HD2      PHE  17   5.673   3.328  -1.755
  143    HE1  PHE  17           HE1      PHE  17   9.075   2.903  -5.338
  144    HE2  PHE  17           HE2      PHE  17   7.421   5.066  -2.017
  145    HZ   PHE  17           HZ       PHE  17   9.122   4.853  -3.806
  146    H    TRP  18           H        TRP  18   5.256   0.832  -0.386
  147    HA   TRP  18           HA       TRP  18   7.789   1.747   0.585
  148    HB2  TRP  18           HB2      TRP  18   5.129   1.069   1.859
  149    HB3  TRP  18           HB3      TRP  18   6.458   1.766   2.782
  150    HD1  TRP  18           HD1      TRP  18   3.489   2.893   1.203
  151    HE1  TRP  18           HE1      TRP  18   3.659   5.326   0.368
  152    HE3  TRP  18           HE3      TRP  18   8.557   3.522   1.326
  153    HZ2  TRP  18           HZ2      TRP  18   5.675   7.280  -0.175
  154    HZ3  TRP  18           HZ3      TRP  18   9.574   5.675   0.644
  155    HH2  TRP  18           HH2      TRP  18   8.141   7.554  -0.105
  156    H    ASN  19           H        ASN  19   6.130  -1.376   0.909
  157    HA   ASN  19           HA       ASN  19   7.727  -2.478   3.024
  158    HB2  ASN  19           HB2      ASN  19   5.834  -3.378   0.937
  159    HB3  ASN  19           HB3      ASN  19   6.975  -4.614   1.462
  160   HD21  ASN  19          HD21      ASN  19   5.362  -5.831   2.667
  161   HD22  ASN  19          HD22      ASN  19   4.676  -5.230   4.098
  162    H    VAL  20           H        VAL  20   8.142  -2.544  -0.536
  163    HA   VAL  20           HA       VAL  20  10.694  -4.026  -0.264
  164    HB   VAL  20           HB       VAL  20  10.614  -3.963  -2.755
  165   HG11  VAL  20          HG11      VAL  20   9.342  -5.662  -1.346
  166   HG12  VAL  20          HG12      VAL  20   8.748  -5.439  -2.991
  167   HG13  VAL  20          HG13      VAL  20   7.898  -4.693  -1.639
  168   HG21  VAL  20          HG21      VAL  20   7.907  -2.657  -2.562
  169   HG22  VAL  20          HG22      VAL  20   8.971  -2.802  -3.959
  170   HG23  VAL  20          HG23      VAL  20   9.358  -1.660  -2.672
  171    H    THR  21           H        THR  21   9.677  -0.726  -0.383
  172    HA   THR  21           HA       THR  21  12.251   0.250  -1.480
  173    HB   THR  21           HB       THR  21   9.719   1.613  -0.508
  174    HG1  THR  21           HG1      THR  21   9.182   0.794  -2.392
  175   HG21  THR  21          HG21      THR  21  10.673   3.611  -1.702
  176   HG22  THR  21          HG22      THR  21  12.196   2.735  -1.843
  177   HG23  THR  21          HG23      THR  21  11.565   3.156  -0.250
  178    H    LEU  22           H        LEU  22  10.488   0.141   1.598
  179    HA   LEU  22           HA       LEU  22  12.640   1.638   2.979
  180    HB2  LEU  22           HB2      LEU  22  10.015   0.431   3.911
  181    HB3  LEU  22           HB3      LEU  22  11.061   1.445   4.901
  182    HG   LEU  22           HG       LEU  22  10.033   2.397   2.226
  183   HD11  LEU  22          HD11      LEU  22   8.145   1.697   3.780
  184   HD12  LEU  22          HD12      LEU  22   8.134   3.393   3.302
  185   HD13  LEU  22          HD13      LEU  22   8.717   2.931   4.900
  186   HD21  LEU  22          HD21      LEU  22  10.503   4.591   3.170
  187   HD22  LEU  22          HD22      LEU  22  11.931   3.577   3.372
  188   HD23  LEU  22          HD23      LEU  22  10.863   3.877   4.743
  189    H    ARG  23           H        ARG  23  10.954  -1.121   4.400
  190    HA   ARG  23           HA       ARG  23  13.209  -2.957   4.182
  191    HB2  ARG  23           HB2      ARG  23  13.860  -1.119   5.858
  192    HB3  ARG  23           HB3      ARG  23  12.612  -1.787   6.911
  193    HG2  ARG  23           HG2      ARG  23  13.799  -4.066   6.503
  194    HG3  ARG  23           HG3      ARG  23  15.159  -3.085   5.956
  195    HD2  ARG  23           HD2      ARG  23  15.360  -2.004   8.094
  196    HD3  ARG  23           HD3      ARG  23  13.808  -2.666   8.643
  197    HE   ARG  23           HE       ARG  23  14.898  -4.959   8.399
  198   HH11  ARG  23          HH11      ARG  23  17.448  -3.830   7.173
  199   HH12  ARG  23          HH12      ARG  23  18.523  -3.866   8.530
  200   HH21  ARG  23          HH21      ARG  23  15.977  -4.259  10.865
  201   HH22  ARG  23          HH22      ARG  23  17.686  -4.110  10.630
  202    HA   PRO  24           HA       PRO  24   9.443  -5.312   4.922
  203    HB2  PRO  24           HB2      PRO  24  10.539  -7.743   4.285
  204    HB3  PRO  24           HB3      PRO  24   9.989  -6.578   3.065
  205    HG2  PRO  24           HG2      PRO  24  12.750  -7.120   4.053
  206    HG3  PRO  24           HG3      PRO  24  12.184  -6.812   2.403
  207    HD2  PRO  24           HD2      PRO  24  13.391  -4.913   3.911
  208    HD3  PRO  24           HD3      PRO  24  12.151  -4.532   2.696
  209    H    GLU  25           H        GLU  25   8.766  -6.467   6.738
  210    HA   GLU  25           HA       GLU  25  10.783  -6.906   8.881
  211    HB2  GLU  25           HB2      GLU  25   7.778  -6.649   8.709
  212    HB3  GLU  25           HB3      GLU  25   8.556  -7.227  10.183
  213    HG2  GLU  25           HG2      GLU  25  10.003  -5.149  10.122
  214    HG3  GLU  25           HG3      GLU  25   8.975  -4.556   8.818
  215    H    ARG  26           H        ARG  26   7.956  -8.667   7.525
  216    HA   ARG  26           HA       ARG  26   9.457 -11.226   7.919
  217    HB2  ARG  26           HB2      ARG  26   7.359 -10.250   9.513
  218    HB3  ARG  26           HB3      ARG  26   6.599 -11.441   8.457
  219    HG2  ARG  26           HG2      ARG  26   8.026 -13.180   9.196
  220    HG3  ARG  26           HG3      ARG  26   9.178 -12.048   9.904
  221    HD2  ARG  26           HD2      ARG  26   6.425 -11.859  10.996
  222    HD3  ARG  26           HD3      ARG  26   7.291 -13.361  11.374
  223    HE   ARG  26           HE       ARG  26   8.886 -10.912  11.721
  224   HH11  ARG  26          HH11      ARG  26   9.445 -13.418  13.223
  225   HH12  ARG  26          HH12      ARG  26   8.805 -13.068  14.795
  226   HH21  ARG  26          HH21      ARG  26   6.899 -10.372  13.702
  227   HH22  ARG  26          HH22      ARG  26   7.356 -11.336  15.066
  Start of MODEL   15
    1    HA   ARG   1           HA       ARG   1 -21.302   0.534  -2.855
    2    HB2  ARG   1           HB2      ARG   1 -20.994   3.373  -1.949
    3    HB3  ARG   1           HB3      ARG   1 -19.541   2.508  -2.449
    4    HG2  ARG   1           HG2      ARG   1 -21.353   1.842  -4.433
    5    HG3  ARG   1           HG3      ARG   1 -21.762   3.521  -4.079
    6    HD2  ARG   1           HD2      ARG   1 -19.166   3.912  -4.186
    7    HD3  ARG   1           HD3      ARG   1 -19.163   2.390  -5.099
    8    HE   ARG   1           HE       ARG   1 -20.680   4.842  -5.891
    9   HH11  ARG   1          HH11      ARG   1 -18.293   3.646  -7.403
   10   HH12  ARG   1          HH12      ARG   1 -19.101   2.838  -8.704
   11   HH21  ARG   1          HH21      ARG   1 -22.226   2.963  -7.187
   12   HH22  ARG   1          HH22      ARG   1 -21.337   2.450  -8.581
   13    H    SER   2           H        SER   2 -19.440  -0.591  -2.146
   14    HA   SER   2           HA       SER   2 -19.249  -1.167   0.701
   15    HB2  SER   2           HB2      SER   2 -18.310  -2.192  -1.838
   16    HB3  SER   2           HB3      SER   2 -16.982  -2.136  -0.686
   17    HG   SER   2           HG       SER   2 -19.447  -3.495  -0.531
   18    H    ALA   3           H        ALA   3 -17.545  -0.588   2.123
   19    HA   ALA   3           HA       ALA   3 -15.879   1.739   1.232
   20    HB1  ALA   3           HB1      ALA   3 -17.445   2.214   3.023
   21    HB2  ALA   3           HB2      ALA   3 -15.823   2.190   3.713
   22    HB3  ALA   3           HB3      ALA   3 -16.897   0.807   3.933
   23    H    LEU   4           H        LEU   4 -15.744  -1.363   3.008
   24    HA   LEU   4           HA       LEU   4 -12.839  -1.142   3.433
   25    HB2  LEU   4           HB2      LEU   4 -14.848  -2.302   4.791
   26    HB3  LEU   4           HB3      LEU   4 -14.355  -3.684   3.812
   27    HG   LEU   4           HG       LEU   4 -11.922  -2.842   4.601
   28   HD11  LEU   4          HD11      LEU   4 -13.087  -0.988   5.929
   29   HD12  LEU   4          HD12      LEU   4 -11.932  -1.974   6.824
   30   HD13  LEU   4          HD13      LEU   4 -13.662  -2.261   7.007
   31   HD21  LEU   4          HD21      LEU   4 -13.807  -4.530   6.280
   32   HD22  LEU   4          HD22      LEU   4 -12.045  -4.572   6.354
   33   HD23  LEU   4          HD23      LEU   4 -12.880  -5.108   4.895
   34    H    VAL   5           H        VAL   5 -14.340  -1.590   0.622
   35    HA   VAL   5           HA       VAL   5 -12.821  -4.005  -0.250
   36    HB   VAL   5           HB       VAL   5 -15.009  -2.319  -1.516
   37   HG11  VAL   5          HG11      VAL   5 -13.655  -4.857  -2.484
   38   HG12  VAL   5          HG12      VAL   5 -13.604  -3.277  -3.267
   39   HG13  VAL   5          HG13      VAL   5 -15.120  -4.175  -3.190
   40   HG21  VAL   5          HG21      VAL   5 -15.823  -3.649   0.348
   41   HG22  VAL   5          HG22      VAL   5 -14.969  -5.073  -0.243
   42   HG23  VAL   5          HG23      VAL   5 -16.338  -4.427  -1.149
   43    H    ASN   6           H        ASN   6 -13.206  -0.526  -0.975
   44    HA   ASN   6           HA       ASN   6 -11.048  -0.633  -3.002
   45    HB2  ASN   6           HB2      ASN   6 -13.145   1.271  -2.055
   46    HB3  ASN   6           HB3      ASN   6 -11.703   1.973  -2.789
   47   HD21  ASN   6          HD21      ASN   6 -11.044   0.468  -4.906
   48   HD22  ASN   6          HD22      ASN   6 -12.345   0.229  -5.969
   49    H    SER   7           H        SER   7 -11.621   0.705   0.257
   50    HA   SER   7           HA       SER   7  -9.256   2.253   0.549
   51    HB2  SER   7           HB2      SER   7 -11.384   1.939   2.024
   52    HB3  SER   7           HB3      SER   7 -10.493   0.608   2.758
   53    HG   SER   7           HG       SER   7 -10.084   2.507   3.892
   54    H    TYR   8           H        TYR   8  -9.798  -1.159   1.564
   55    HA   TYR   8           HA       TYR   8  -7.101  -1.637   2.407
   56    HB2  TYR   8           HB2      TYR   8  -8.031  -3.624   3.001
   57    HB3  TYR   8           HB3      TYR   8  -9.549  -2.927   2.452
   58    HD1  TYR   8           HD1      TYR   8 -10.489  -3.523   0.250
   59    HD2  TYR   8           HD2      TYR   8  -6.830  -5.265   1.672
   60    HE1  TYR   8           HE1      TYR   8 -10.651  -5.284  -1.488
   61    HE2  TYR   8           HE2      TYR   8  -6.992  -7.024  -0.065
   62    HH   TYR   8           HH       TYR   8  -9.557  -7.899  -1.565
   63    H    LEU   9           H        LEU   9  -8.642  -1.800  -0.769
   64    HA   LEU   9           HA       LEU   9  -6.562  -3.249  -2.149
   65    HB2  LEU   9           HB2      LEU   9  -9.098  -2.229  -2.659
   66    HB3  LEU   9           HB3      LEU   9  -8.063  -1.233  -3.675
   67    HG   LEU   9           HG       LEU   9  -7.178  -3.152  -4.811
   68   HD11  LEU   9          HD11      LEU   9  -6.866  -5.045  -3.623
   69   HD12  LEU   9          HD12      LEU   9  -8.592  -5.363  -3.799
   70   HD13  LEU   9          HD13      LEU   9  -7.993  -4.510  -2.377
   71   HD21  LEU   9          HD21      LEU   9  -9.319  -2.532  -5.689
   72   HD22  LEU   9          HD22      LEU   9 -10.166  -3.324  -4.359
   73   HD23  LEU   9          HD23      LEU   9  -9.328  -4.291  -5.573
   74    H    TRP  10           H        TRP  10  -7.249   0.252  -1.792
   75    HA   TRP  10           HA       TRP  10  -5.032   1.234  -3.301
   76    HB2  TRP  10           HB2      TRP  10  -6.947   2.595  -2.586
   77    HB3  TRP  10           HB3      TRP  10  -6.519   2.351  -0.896
   78    HD1  TRP  10           HD1      TRP  10  -5.945   4.801  -0.274
   79    HE1  TRP  10           HE1      TRP  10  -4.101   6.449  -0.998
   80    HE3  TRP  10           HE3      TRP  10  -4.032   2.292  -4.294
   81    HZ2  TRP  10           HZ2      TRP  10  -2.085   6.677  -3.009
   82    HZ3  TRP  10           HZ3      TRP  10  -2.153   3.250  -5.593
   83    HH2  TRP  10           HH2      TRP  10  -1.178   5.437  -4.957
   84    H    GLN  11           H        GLN  11  -5.328   0.245   0.105
   85    HA   GLN  11           HA       GLN  11  -2.778   1.125   1.036
   86    HB2  GLN  11           HB2      GLN  11  -4.829   0.202   2.295
   87    HB3  GLN  11           HB3      GLN  11  -4.228  -1.402   1.871
   88    HG2  GLN  11           HG2      GLN  11  -2.836  -1.312   3.636
   89    HG3  GLN  11           HG3      GLN  11  -2.007   0.049   2.879
   90   HE21  GLN  11          HE21      GLN  11  -2.912   2.269   3.383
   91   HE22  GLN  11          HE22      GLN  11  -3.710   2.509   4.861
   92    H    ARG  12           H        ARG  12  -3.797  -2.013  -0.369
   93    HA   ARG  12           HA       ARG  12  -1.386  -3.458  -0.251
   94    HB2  ARG  12           HB2      ARG  12  -3.590  -3.283  -2.324
   95    HB3  ARG  12           HB3      ARG  12  -2.320  -4.502  -2.400
   96    HG2  ARG  12           HG2      ARG  12  -3.028  -5.549  -0.418
   97    HG3  ARG  12           HG3      ARG  12  -3.920  -4.128   0.125
   98    HD2  ARG  12           HD2      ARG  12  -5.800  -4.868  -0.896
   99    HD3  ARG  12           HD3      ARG  12  -4.943  -5.023  -2.441
  100    HE   ARG  12           HE       ARG  12  -4.877  -7.131  -0.310
  101   HH11  ARG  12          HH11      ARG  12  -2.793  -7.218  -2.488
  102   HH12  ARG  12          HH12      ARG  12  -3.522  -8.291  -3.636
  103   HH21  ARG  12          HH21      ARG  12  -6.704  -8.012  -2.260
  104   HH22  ARG  12          HH22      ARG  12  -5.747  -8.743  -3.505
  105    H    TRP  13           H        TRP  13  -2.393  -1.015  -2.639
  106    HA   TRP  13           HA       TRP  13  -0.271  -1.278  -4.512
  107    HB2  TRP  13           HB2      TRP  13  -2.510   0.317  -4.065
  108    HB3  TRP  13           HB3      TRP  13  -1.176   1.463  -3.973
  109    HD1  TRP  13           HD1      TRP  13  -3.296   1.371  -6.350
  110    HE1  TRP  13           HE1      TRP  13  -2.454   1.067  -8.770
  111    HE3  TRP  13           HE3      TRP  13   1.286  -0.687  -5.437
  112    HZ2  TRP  13           HZ2      TRP  13  -0.142   0.084 -10.132
  113    HZ3  TRP  13           HZ3      TRP  13   2.784  -1.295  -7.311
  114    HH2  TRP  13           HH2      TRP  13   2.079  -0.911  -9.655
  115    H    GLU  14           H        GLU  14  -0.554   1.125  -1.870
  116    HA   GLU  14           HA       GLU  14   2.207   1.993  -2.120
  117    HB2  GLU  14           HB2      GLU  14   0.035   2.412  -0.048
  118    HB3  GLU  14           HB3      GLU  14   1.560   3.299  -0.077
  119    HG2  GLU  14           HG2      GLU  14   0.769   3.632  -2.655
  120    HG3  GLU  14           HG3      GLU  14  -0.802   3.544  -1.856
  121    H    ASN  15           H        ASN  15   0.478  -0.134   0.200
  122    HA   ASN  15           HA       ASN  15   2.493  -0.481   2.133
  123    HB2  ASN  15           HB2      ASN  15   0.031  -1.561   1.589
  124    HB3  ASN  15           HB3      ASN  15   1.084  -2.944   1.303
  125   HD21  ASN  15          HD21      ASN  15   3.058  -2.711   3.214
  126   HD22  ASN  15          HD22      ASN  15   2.389  -2.694   4.774
  127    H    TRP  16           H        TRP  16   2.126  -2.204  -0.993
  128    HA   TRP  16           HA       TRP  16   4.421  -3.922  -0.642
  129    HB2  TRP  16           HB2      TRP  16   2.904  -4.587  -2.312
  130    HB3  TRP  16           HB3      TRP  16   2.712  -2.945  -2.925
  131    HD1  TRP  16           HD1      TRP  16   5.238  -5.845  -2.913
  132    HE1  TRP  16           HE1      TRP  16   6.813  -5.569  -4.933
  133    HE3  TRP  16           HE3      TRP  16   3.642  -1.319  -4.664
  134    HZ2  TRP  16           HZ2      TRP  16   7.332  -3.678  -7.013
  135    HZ3  TRP  16           HZ3      TRP  16   4.697  -0.303  -6.662
  136    HH2  TRP  16           HH2      TRP  16   6.538  -1.476  -7.839
  137    H    PHE  17           H        PHE  17   3.972  -0.826  -2.389
  138    HA   PHE  17           HA       PHE  17   6.619  -0.457  -3.323
  139    HB2  PHE  17           HB2      PHE  17   4.579   0.855  -3.931
  140    HB3  PHE  17           HB3      PHE  17   4.616   1.605  -2.336
  141    HD1  PHE  17           HD1      PHE  17   6.753   1.051  -5.363
  142    HD2  PHE  17           HD2      PHE  17   5.871   3.556  -1.987
  143    HE1  PHE  17           HE1      PHE  17   8.372   2.737  -6.191
  144    HE2  PHE  17           HE2      PHE  17   7.491   5.241  -2.814
  145    HZ   PHE  17           HZ       PHE  17   8.742   4.832  -4.916
  146    H    TRP  18           H        TRP  18   5.135   0.780  -0.295
  147    HA   TRP  18           HA       TRP  18   7.543   1.912   0.781
  148    HB2  TRP  18           HB2      TRP  18   5.012   0.843   2.073
  149    HB3  TRP  18           HB3      TRP  18   6.213   1.816   2.916
  150    HD1  TRP  18           HD1      TRP  18   3.042   2.471   1.864
  151    HE1  TRP  18           HE1      TRP  18   2.697   4.780   0.768
  152    HE3  TRP  18           HE3      TRP  18   7.883   3.643   0.719
  153    HZ2  TRP  18           HZ2      TRP  18   4.261   6.844  -0.432
  154    HZ3  TRP  18           HZ3      TRP  18   8.424   5.786  -0.398
  155    HH2  TRP  18           HH2      TRP  18   6.620   7.388  -0.974
  156    H    ASN  19           H        ASN  19   6.228  -1.377   0.857
  157    HA   ASN  19           HA       ASN  19   7.867  -2.422   2.972
  158    HB2  ASN  19           HB2      ASN  19   5.780  -3.364   1.741
  159    HB3  ASN  19           HB3      ASN  19   6.932  -3.965   0.550
  160   HD21  ASN  19          HD21      ASN  19   5.703  -4.421   3.809
  161   HD22  ASN  19          HD22      ASN  19   6.625  -5.800   4.166
  162    H    VAL  20           H        VAL  20   8.354  -2.402  -0.592
  163    HA   VAL  20           HA       VAL  20  11.051  -3.562  -0.292
  164    HB   VAL  20           HB       VAL  20  11.029  -3.464  -2.764
  165   HG11  VAL  20          HG11      VAL  20   9.358  -5.100  -3.086
  166   HG12  VAL  20          HG12      VAL  20   8.295  -4.380  -1.877
  167   HG13  VAL  20          HG13      VAL  20   9.754  -5.233  -1.372
  168   HG21  VAL  20          HG21      VAL  20   9.778  -1.281  -2.910
  169   HG22  VAL  20          HG22      VAL  20   8.308  -2.151  -2.473
  170   HG23  VAL  20          HG23      VAL  20   9.143  -2.534  -3.976
  171    H    THR  21           H        THR  21   9.634  -0.364  -0.731
  172    HA   THR  21           HA       THR  21  12.116   0.904  -1.609
  173    HB   THR  21           HB       THR  21   9.472   1.959  -0.555
  174    HG1  THR  21           HG1      THR  21   9.012   1.181  -2.478
  175   HG21  THR  21          HG21      THR  21  10.193   4.107  -1.611
  176   HG22  THR  21          HG22      THR  21  11.789   3.403  -1.870
  177   HG23  THR  21          HG23      THR  21  11.190   3.651  -0.230
  178    H    LEU  22           H        LEU  22  10.408   0.532   1.485
  179    HA   LEU  22           HA       LEU  22  12.421   2.170   2.902
  180    HB2  LEU  22           HB2      LEU  22  10.012   0.588   3.855
  181    HB3  LEU  22           HB3      LEU  22  10.944   1.710   4.843
  182    HG   LEU  22           HG       LEU  22   9.600   2.530   2.256
  183   HD11  LEU  22          HD11      LEU  22   8.587   2.818   5.101
  184   HD12  LEU  22          HD12      LEU  22   7.905   1.748   3.877
  185   HD13  LEU  22          HD13      LEU  22   7.823   3.496   3.663
  186   HD21  LEU  22          HD21      LEU  22   9.817   4.799   3.442
  187   HD22  LEU  22          HD22      LEU  22  11.316   4.074   2.860
  188   HD23  LEU  22          HD23      LEU  22  10.898   3.982   4.571
  189    H    ARG  23           H        ARG  23  11.690  -1.212   2.345
  190    HA   ARG  23           HA       ARG  23  12.809  -3.188   2.958
  191    HB2  ARG  23           HB2      ARG  23  14.839  -0.996   2.969
  192    HB3  ARG  23           HB3      ARG  23  15.321  -2.547   3.657
  193    HG2  ARG  23           HG2      ARG  23  14.563  -3.675   1.569
  194    HG3  ARG  23           HG3      ARG  23  14.192  -2.094   0.878
  195    HD2  ARG  23           HD2      ARG  23  16.407  -1.573   0.543
  196    HD3  ARG  23           HD3      ARG  23  16.931  -2.422   2.012
  197    HE   ARG  23           HE       ARG  23  16.743  -4.542   0.794
  198   HH11  ARG  23          HH11      ARG  23  18.513  -2.822  -0.955
  199   HH12  ARG  23          HH12      ARG  23  17.810  -3.067  -2.520
  200   HH21  ARG  23          HH21      ARG  23  14.840  -4.369  -1.263
  201   HH22  ARG  23          HH22      ARG  23  15.721  -3.949  -2.694
  202    HA   PRO  24           HA       PRO  24  11.954  -2.537   7.415
  203    HB2  PRO  24           HB2      PRO  24  10.619  -4.910   7.731
  204    HB3  PRO  24           HB3      PRO  24   9.832  -3.429   7.147
  205    HG2  PRO  24           HG2      PRO  24  10.829  -5.774   5.606
  206    HG3  PRO  24           HG3      PRO  24   9.354  -4.821   5.380
  207    HD2  PRO  24           HD2      PRO  24  11.569  -4.507   3.841
  208    HD3  PRO  24           HD3      PRO  24  10.435  -3.183   4.191
  209    H    GLU  25           H        GLU  25  13.735  -2.992   8.653
  210    HA   GLU  25           HA       GLU  25  15.572  -4.141   9.583
  211    HB2  GLU  25           HB2      GLU  25  13.403  -6.148   9.103
  212    HB3  GLU  25           HB3      GLU  25  14.991  -6.761   9.565
  213    HG2  GLU  25           HG2      GLU  25  14.987  -5.524  11.605
  214    HG3  GLU  25           HG3      GLU  25  13.612  -4.545  11.094
  215    H    ARG  26           H        ARG  26  16.441  -3.341   7.292
  216    HA   ARG  26           HA       ARG  26  17.948  -3.762   5.535
  217    HB2  ARG  26           HB2      ARG  26  18.535  -5.468   7.602
  218    HB3  ARG  26           HB3      ARG  26  18.291  -6.606   6.277
  219    HG2  ARG  26           HG2      ARG  26  19.878  -5.283   4.886
  220    HG3  ARG  26           HG3      ARG  26  20.171  -4.227   6.270
  221    HD2  ARG  26           HD2      ARG  26  20.647  -6.584   7.474
  222    HD3  ARG  26           HD3      ARG  26  21.078  -7.035   5.812
  223    HE   ARG  26           HE       ARG  26  22.523  -4.902   5.840
  224   HH11  ARG  26          HH11      ARG  26  23.756  -7.213   7.342
  225   HH12  ARG  26          HH12      ARG  26  24.211  -6.463   8.834
  226   HH21  ARG  26          HH21      ARG  26  22.200  -3.670   8.346
  227   HH22  ARG  26          HH22      ARG  26  23.328  -4.448   9.405
  Start of MODEL   16
    1    HA   ARG   1           HA       ARG   1 -14.681  -2.558  -7.055
    2    HB2  ARG   1           HB2      ARG   1 -15.678  -4.147  -8.827
    3    HB3  ARG   1           HB3      ARG   1 -17.190  -4.013  -7.929
    4    HG2  ARG   1           HG2      ARG   1 -17.492  -2.256  -9.389
    5    HG3  ARG   1           HG3      ARG   1 -16.622  -1.401  -8.117
    6    HD2  ARG   1           HD2      ARG   1 -14.920  -0.948  -9.540
    7    HD3  ARG   1           HD3      ARG   1 -14.732  -2.672  -9.913
    8    HE   ARG   1           HE       ARG   1 -16.741  -0.906 -11.272
    9   HH11  ARG   1          HH11      ARG   1 -14.170  -1.520 -12.690
   10   HH12  ARG   1          HH12      ARG   1 -14.602  -2.891 -13.654
   11   HH21  ARG   1          HH21      ARG   1 -17.498  -3.575 -11.856
   12   HH22  ARG   1          HH22      ARG   1 -16.494  -4.058 -13.182
   13    H    SER   2           H        SER   2 -14.865  -2.506  -4.505
   14    HA   SER   2           HA       SER   2 -17.617  -1.558  -3.843
   15    HB2  SER   2           HB2      SER   2 -15.975  -3.652  -2.396
   16    HB3  SER   2           HB3      SER   2 -17.344  -2.837  -1.647
   17    HG   SER   2           HG       SER   2 -18.336  -4.484  -2.577
   18    H    ALA   3           H        ALA   3 -17.619  -0.113  -1.959
   19    HA   ALA   3           HA       ALA   3 -15.425   1.720  -1.843
   20    HB1  ALA   3           HB1      ALA   3 -16.722   2.654   0.051
   21    HB2  ALA   3           HB2      ALA   3 -17.678   1.173   0.122
   22    HB3  ALA   3           HB3      ALA   3 -17.786   2.225  -1.289
   23    H    LEU   4           H        LEU   4 -16.382  -0.943   0.348
   24    HA   LEU   4           HA       LEU   4 -14.243  -0.484   2.252
   25    HB2  LEU   4           HB2      LEU   4 -16.594  -1.933   2.116
   26    HB3  LEU   4           HB3      LEU   4 -15.366  -3.196   2.041
   27    HG   LEU   4           HG       LEU   4 -15.094  -1.012   4.084
   28   HD11  LEU   4          HD11      LEU   4 -17.445  -1.920   4.208
   29   HD12  LEU   4          HD12      LEU   4 -16.481  -2.220   5.654
   30   HD13  LEU   4          HD13      LEU   4 -16.752  -3.517   4.490
   31   HD21  LEU   4          HD21      LEU   4 -14.086  -2.948   5.347
   32   HD22  LEU   4          HD22      LEU   4 -13.249  -2.570   3.841
   33   HD23  LEU   4          HD23      LEU   4 -14.346  -3.949   3.917
   34    H    VAL   5           H        VAL   5 -14.624  -2.530  -0.613
   35    HA   VAL   5           HA       VAL   5 -12.206  -4.081  -0.238
   36    HB   VAL   5           HB       VAL   5 -13.974  -3.423  -2.616
   37   HG11  VAL   5          HG11      VAL   5 -12.788  -5.589  -3.508
   38   HG12  VAL   5          HG12      VAL   5 -11.499  -5.118  -2.400
   39   HG13  VAL   5          HG13      VAL   5 -11.990  -4.027  -3.697
   40   HG21  VAL   5          HG21      VAL   5 -15.012  -4.767  -0.828
   41   HG22  VAL   5          HG22      VAL   5 -13.661  -5.901  -0.887
   42   HG23  VAL   5          HG23      VAL   5 -14.750  -5.752  -2.267
   43    H    ASN   6           H        ASN   6 -12.971  -1.229  -2.282
   44    HA   ASN   6           HA       ASN   6 -10.329  -0.909  -3.370
   45    HB2  ASN   6           HB2      ASN   6 -12.815   0.148  -3.782
   46    HB3  ASN   6           HB3      ASN   6 -12.024   1.491  -2.958
   47   HD21  ASN   6          HD21      ASN   6 -12.624   0.421  -6.014
   48   HD22  ASN   6          HD22      ASN   6 -11.245   1.007  -6.810
   49    H    SER   7           H        SER   7 -11.878   0.374  -0.418
   50    HA   SER   7           HA       SER   7  -9.936   2.308   0.334
   51    HB2  SER   7           HB2      SER   7 -12.203   1.795   1.361
   52    HB3  SER   7           HB3      SER   7 -11.452   0.418   2.162
   53    HG   SER   7           HG       SER   7 -11.511   2.413   3.402
   54    H    TYR   8           H        TYR   8 -10.051  -1.205   1.027
   55    HA   TYR   8           HA       TYR   8  -7.491  -1.188   2.448
   56    HB2  TYR   8           HB2      TYR   8  -9.168  -2.818   3.039
   57    HB3  TYR   8           HB3      TYR   8  -9.349  -3.326   1.359
   58    HD1  TYR   8           HD1      TYR   8  -6.836  -3.121   4.122
   59    HD2  TYR   8           HD2      TYR   8  -8.046  -5.088   0.501
   60    HE1  TYR   8           HE2      TYR   8  -5.028  -4.790   4.425
   61    HE2  TYR   8           HE1      TYR   8  -6.237  -6.756   0.802
   62    HH   TYR   8           HH       TYR   8  -4.780  -7.418   3.490
   63    H    LEU   9           H        LEU   9  -8.638  -2.002  -0.824
   64    HA   LEU   9           HA       LEU   9  -6.307  -3.207  -1.892
   65    HB2  LEU   9           HB2      LEU   9  -8.647  -1.644  -2.910
   66    HB3  LEU   9           HB3      LEU   9  -7.314  -1.927  -4.026
   67    HG   LEU   9           HG       LEU   9  -8.796  -4.074  -2.477
   68   HD11  LEU   9          HD11      LEU   9  -8.762  -3.585  -5.463
   69   HD12  LEU   9          HD12      LEU   9 -10.012  -2.925  -4.406
   70   HD13  LEU   9          HD13      LEU   9  -9.815  -4.672  -4.556
   71   HD21  LEU   9          HD21      LEU   9  -6.442  -4.106  -4.365
   72   HD22  LEU   9          HD22      LEU   9  -7.479  -5.520  -4.189
   73   HD23  LEU   9          HD23      LEU   9  -6.602  -4.892  -2.795
   74    H    TRP  10           H        TRP  10  -7.170   0.261  -1.645
   75    HA   TRP  10           HA       TRP  10  -4.948   1.340  -3.058
   76    HB2  TRP  10           HB2      TRP  10  -6.935   2.615  -2.372
   77    HB3  TRP  10           HB3      TRP  10  -6.524   2.378  -0.674
   78    HD1  TRP  10           HD1      TRP  10  -6.031   4.835  -0.018
   79    HE1  TRP  10           HE1      TRP  10  -4.234   6.551  -0.710
   80    HE3  TRP  10           HE3      TRP  10  -4.009   2.435  -4.052
   81    HZ2  TRP  10           HZ2      TRP  10  -2.213   6.867  -2.703
   82    HZ3  TRP  10           HZ3      TRP  10  -2.151   3.467  -5.325
   83    HH2  TRP  10           HH2      TRP  10  -1.252   5.678  -4.656
   84    H    GLN  11           H        GLN  11  -5.309   0.478   0.399
   85    HA   GLN  11           HA       GLN  11  -2.733   1.364   1.277
   86    HB2  GLN  11           HB2      GLN  11  -4.977  -0.265   2.213
   87    HB3  GLN  11           HB3      GLN  11  -3.432  -0.887   2.791
   88    HG2  GLN  11           HG2      GLN  11  -3.659   0.685   4.420
   89    HG3  GLN  11           HG3      GLN  11  -3.095   1.803   3.178
   90   HE21  GLN  11          HE21      GLN  11  -5.762   1.036   5.232
   91   HE22  GLN  11          HE22      GLN  11  -6.879   2.116   4.550
   92    H    ARG  12           H        ARG  12  -3.847  -1.804   0.035
   93    HA   ARG  12           HA       ARG  12  -1.459  -3.305   0.281
   94    HB2  ARG  12           HB2      ARG  12  -3.919  -3.283  -1.374
   95    HB3  ARG  12           HB3      ARG  12  -2.566  -4.171  -2.073
   96    HG2  ARG  12           HG2      ARG  12  -3.043  -4.666   0.810
   97    HG3  ARG  12           HG3      ARG  12  -4.308  -5.246  -0.273
   98    HD2  ARG  12           HD2      ARG  12  -1.358  -5.859  -0.669
   99    HD3  ARG  12           HD3      ARG  12  -2.497  -6.953   0.139
  100    HE   ARG  12           HE       ARG  12  -3.837  -6.442  -2.169
  101   HH11  ARG  12          HH11      ARG  12  -1.045  -5.638  -3.216
  102   HH12  ARG  12          HH12      ARG  12  -0.565  -7.108  -3.996
  103   HH21  ARG  12          HH21      ARG  12  -3.013  -9.033  -2.455
  104   HH22  ARG  12          HH22      ARG  12  -1.681  -9.037  -3.562
  105    H    TRP  13           H        TRP  13  -2.468  -1.028  -2.261
  106    HA   TRP  13           HA       TRP  13  -0.414  -1.430  -4.168
  107    HB2  TRP  13           HB2      TRP  13  -2.582   0.246  -3.750
  108    HB3  TRP  13           HB3      TRP  13  -1.223   1.363  -3.683
  109    HD1  TRP  13           HD1      TRP  13  -3.326   1.334  -6.051
  110    HE1  TRP  13           HE1      TRP  13  -2.508   0.946  -8.469
  111    HE3  TRP  13           HE3      TRP  13   1.142  -0.946  -5.114
  112    HZ2  TRP  13           HZ2      TRP  13  -0.253  -0.182  -9.819
  113    HZ3  TRP  13           HZ3      TRP  13   2.603  -1.667  -6.978
  114    HH2  TRP  13           HH2      TRP  13   1.914  -1.287  -9.328
  115    H    GLU  14           H        GLU  14  -0.522   1.144  -1.679
  116    HA   GLU  14           HA       GLU  14   2.248   1.890  -2.003
  117    HB2  GLU  14           HB2      GLU  14   0.212   2.352   0.200
  118    HB3  GLU  14           HB3      GLU  14   1.740   3.221   0.048
  119    HG2  GLU  14           HG2      GLU  14   0.748   3.534  -2.470
  120    HG3  GLU  14           HG3      GLU  14  -0.750   3.494  -1.538
  121    H    ASN  15           H        ASN  15   0.558  -0.347   0.186
  122    HA   ASN  15           HA       ASN  15   2.527  -0.800   2.150
  123    HB2  ASN  15           HB2      ASN  15   0.121  -1.776   1.719
  124    HB3  ASN  15           HB3      ASN  15   0.991  -3.062   0.884
  125   HD21  ASN  15          HD21      ASN  15   2.954  -3.956   2.284
  126   HD22  ASN  15          HD22      ASN  15   2.626  -4.182   3.934
  127    H    TRP  16           H        TRP  16   2.241  -2.278  -1.099
  128    HA   TRP  16           HA       TRP  16   4.606  -3.940  -0.854
  129    HB2  TRP  16           HB2      TRP  16   3.077  -4.624  -2.496
  130    HB3  TRP  16           HB3      TRP  16   2.758  -2.974  -3.025
  131    HD1  TRP  16           HD1      TRP  16   5.352  -5.776  -3.349
  132    HE1  TRP  16           HE1      TRP  16   6.827  -5.301  -5.410
  133    HE3  TRP  16           HE3      TRP  16   3.621  -1.143  -4.627
  134    HZ2  TRP  16           HZ2      TRP  16   7.221  -3.230  -7.343
  135    HZ3  TRP  16           HZ3      TRP  16   4.564   0.056  -6.580
  136    HH2  TRP  16           HH2      TRP  16   6.359  -0.981  -7.938
  137    H    PHE  17           H        PHE  17   3.953  -0.765  -2.369
  138    HA   PHE  17           HA       PHE  17   6.547  -0.246  -3.408
  139    HB2  PHE  17           HB2      PHE  17   4.448   1.014  -3.884
  140    HB3  PHE  17           HB3      PHE  17   4.487   1.666  -2.245
  141    HD1  PHE  17           HD1      PHE  17   6.568   1.400  -5.350
  142    HD2  PHE  17           HD2      PHE  17   5.672   3.642  -1.796
  143    HE1  PHE  17           HE2      PHE  17   8.099   3.201  -6.099
  144    HE2  PHE  17           HE1      PHE  17   7.202   5.443  -2.547
  145    HZ   PHE  17           HZ       PHE  17   8.417   5.222  -4.698
  146    H    TRP  18           H        TRP  18   5.131   0.665  -0.238
  147    HA   TRP  18           HA       TRP  18   7.541   1.868   0.798
  148    HB2  TRP  18           HB2      TRP  18   5.081   0.660   2.102
  149    HB3  TRP  18           HB3      TRP  18   6.291   1.595   2.976
  150    HD1  TRP  18           HD1      TRP  18   3.086   2.268   2.108
  151    HE1  TRP  18           HE1      TRP  18   2.655   4.633   1.179
  152    HE3  TRP  18           HE3      TRP  18   7.848   3.594   0.809
  153    HZ2  TRP  18           HZ2      TRP  18   4.130   6.797   0.041
  154    HZ3  TRP  18           HZ3      TRP  18   8.304   5.812  -0.192
  155    HH2  TRP  18           HH2      TRP  18   6.453   7.415  -0.578
  156    H    ASN  19           H        ASN  19   6.256  -1.444   0.839
  157    HA   ASN  19           HA       ASN  19   8.061  -2.549   2.776
  158    HB2  ASN  19           HB2      ASN  19   5.928  -3.531   1.833
  159    HB3  ASN  19           HB3      ASN  19   6.821  -3.898   0.358
  160   HD21  ASN  19          HD21      ASN  19   6.317  -4.864   3.700
  161   HD22  ASN  19          HD22      ASN  19   7.326  -6.228   3.653
  162    H    VAL  20           H        VAL  20   8.288  -2.351  -0.808
  163    HA   VAL  20           HA       VAL  20  10.982  -3.546  -0.777
  164    HB   VAL  20           HB       VAL  20  10.794  -3.274  -3.225
  165   HG11  VAL  20          HG11      VAL  20   9.298  -4.931  -1.632
  166   HG12  VAL  20          HG12      VAL  20   9.381  -5.041  -3.390
  167   HG13  VAL  20          HG13      VAL  20   8.052  -4.172  -2.623
  168   HG21  VAL  20          HG21      VAL  20   8.763  -1.316  -2.418
  169   HG22  VAL  20          HG22      VAL  20   8.193  -2.418  -3.669
  170   HG23  VAL  20          HG23      VAL  20   9.646  -1.455  -3.936
  171    H    THR  21           H        THR  21   9.619  -0.294  -0.829
  172    HA   THR  21           HA       THR  21  12.126   0.947  -1.748
  173    HB   THR  21           HB       THR  21   9.521   2.046  -0.642
  174    HG1  THR  21           HG1      THR  21   8.991   1.383  -2.578
  175   HG21  THR  21          HG21      THR  21  11.260   3.686  -0.277
  176   HG22  THR  21          HG22      THR  21  10.321   4.193  -1.682
  177   HG23  THR  21          HG23      THR  21  11.899   3.436  -1.903
  178    H    LEU  22           H        LEU  22  10.355   0.601   1.319
  179    HA   LEU  22           HA       LEU  22  12.558   1.962   2.780
  180    HB2  LEU  22           HB2      LEU  22   9.863   0.889   3.671
  181    HB3  LEU  22           HB3      LEU  22  10.950   1.859   4.661
  182    HG   LEU  22           HG       LEU  22  10.115   2.921   1.982
  183   HD11  LEU  22          HD11      LEU  22   8.073   3.828   2.868
  184   HD12  LEU  22          HD12      LEU  22   8.448   3.244   4.489
  185   HD13  LEU  22          HD13      LEU  22   8.053   2.098   3.209
  186   HD21  LEU  22          HD21      LEU  22  11.806   4.099   3.348
  187   HD22  LEU  22          HD22      LEU  22  10.665   4.181   4.690
  188   HD23  LEU  22          HD23      LEU  22  10.336   5.063   3.198
  189    H    ARG  23           H        ARG  23  11.305  -1.238   2.167
  190    HA   ARG  23           HA       ARG  23  11.972  -3.369   2.932
  191    HB2  ARG  23           HB2      ARG  23  14.118  -1.951   2.114
  192    HB3  ARG  23           HB3      ARG  23  14.585  -2.213   3.794
  193    HG2  ARG  23           HG2      ARG  23  15.456  -4.121   2.783
  194    HG3  ARG  23           HG3      ARG  23  13.872  -4.700   3.301
  195    HD2  ARG  23           HD2      ARG  23  13.353  -3.575   0.801
  196    HD3  ARG  23           HD3      ARG  23  14.918  -4.384   0.585
  197    HE   ARG  23           HE       ARG  23  13.840  -6.440   1.572
  198   HH11  ARG  23          HH11      ARG  23  12.614  -5.938  -1.103
  199   HH12  ARG  23          HH12      ARG  23  10.919  -6.014  -0.753
  200   HH21  ARG  23          HH21      ARG  23  11.343  -5.635   2.674
  201   HH22  ARG  23          HH22      ARG  23  10.195  -5.846   1.393
  202    HA   PRO  24           HA       PRO  24  11.398  -1.955   7.365
  203    HB2  PRO  24           HB2      PRO  24   8.891  -2.996   7.727
  204    HB3  PRO  24           HB3      PRO  24   9.181  -1.359   7.107
  205    HG2  PRO  24           HG2      PRO  24   8.465  -3.841   5.635
  206    HG3  PRO  24           HG3      PRO  24   7.945  -2.173   5.357
  207    HD2  PRO  24           HD2      PRO  24   9.863  -3.441   3.876
  208    HD3  PRO  24           HD3      PRO  24   9.774  -1.679   4.085
  209    H    GLU  25           H        GLU  25  13.019  -3.564   7.861
  210    HA   GLU  25           HA       GLU  25  12.002  -6.364   8.227
  211    HB2  GLU  25           HB2      GLU  25  14.189  -5.352   6.859
  212    HB3  GLU  25           HB3      GLU  25  14.896  -5.858   8.393
  213    HG2  GLU  25           HG2      GLU  25  13.020  -7.676   6.887
  214    HG3  GLU  25           HG3      GLU  25  14.736  -7.617   6.487
  215    H    ARG  26           H        ARG  26  12.083  -7.255  10.298
  216    HA   ARG  26           HA       ARG  26  13.586  -5.842  12.443
  217    HB2  ARG  26           HB2      ARG  26  10.786  -5.562  11.915
  218    HB3  ARG  26           HB3      ARG  26  10.962  -6.462  13.421
  219    HG2  ARG  26           HG2      ARG  26  12.573  -3.963  12.912
  220    HG3  ARG  26           HG3      ARG  26  10.932  -3.871  13.554
  221    HD2  ARG  26           HD2      ARG  26  11.775  -4.277  15.619
  222    HD3  ARG  26           HD3      ARG  26  12.279  -5.883  15.057
  223    HE   ARG  26           HE       ARG  26  14.044  -3.627  14.308
  224   HH11  ARG  26          HH11      ARG  26  14.664  -6.654  14.490
  225   HH12  ARG  26          HH12      ARG  26  15.706  -6.674  15.873
  226   HH21  ARG  26          HH21      ARG  26  14.814  -3.483  16.925
  227   HH22  ARG  26          HH22      ARG  26  15.789  -4.875  17.259
  Start of MODEL   17
    1    HA   ARG   1           HA       ARG   1 -14.375   1.968  -7.200
    2    HB2  ARG   1           HB2      ARG   1 -15.872   2.542  -9.366
    3    HB3  ARG   1           HB3      ARG   1 -17.162   2.428  -8.168
    4    HG2  ARG   1           HG2      ARG   1 -16.210   4.148  -6.825
    5    HG3  ARG   1           HG3      ARG   1 -14.674   4.078  -7.690
    6    HD2  ARG   1           HD2      ARG   1 -17.263   4.842  -9.075
    7    HD3  ARG   1           HD3      ARG   1 -16.193   6.040  -8.323
    8    HE   ARG   1           HE       ARG   1 -14.369   4.815  -9.801
    9   HH11  ARG   1          HH11      ARG   1 -16.521   3.271 -11.270
   10   HH12  ARG   1          HH12      ARG   1 -16.761   4.257 -12.672
   11   HH21  ARG   1          HH21      ARG   1 -15.163   7.030 -11.316
   12   HH22  ARG   1          HH22      ARG   1 -15.990   6.395 -12.698
   13    H    SER   2           H        SER   2 -14.818   1.707  -5.047
   14    HA   SER   2           HA       SER   2 -17.454   0.838  -4.092
   15    HB2  SER   2           HB2      SER   2 -15.141  -0.979  -4.423
   16    HB3  SER   2           HB3      SER   2 -15.931  -1.072  -2.852
   17    HG   SER   2           HG       SER   2 -17.172  -1.290  -5.403
   18    H    ALA   3           H        ALA   3 -17.258   0.515  -1.566
   19    HA   ALA   3           HA       ALA   3 -15.598   2.764  -0.532
   20    HB1  ALA   3           HB1      ALA   3 -17.824   1.176   0.781
   21    HB2  ALA   3           HB2      ALA   3 -18.097   2.609  -0.210
   22    HB3  ALA   3           HB3      ALA   3 -17.192   2.740   1.298
   23    H    LEU   4           H        LEU   4 -16.242  -0.707   0.060
   24    HA   LEU   4           HA       LEU   4 -13.995  -0.743   2.033
   25    HB2  LEU   4           HB2      LEU   4 -16.536  -2.216   1.591
   26    HB3  LEU   4           HB3      LEU   4 -15.194  -3.169   2.225
   27    HG   LEU   4           HG       LEU   4 -15.722  -0.497   3.464
   28   HD11  LEU   4          HD11      LEU   4 -17.383  -2.992   3.916
   29   HD12  LEU   4          HD12      LEU   4 -17.961  -1.408   3.397
   30   HD13  LEU   4          HD13      LEU   4 -17.339  -1.628   5.033
   31   HD21  LEU   4          HD21      LEU   4 -13.806  -2.083   4.046
   32   HD22  LEU   4          HD22      LEU   4 -15.027  -3.170   4.707
   33   HD23  LEU   4          HD23      LEU   4 -14.805  -1.566   5.405
   34    H    VAL   5           H        VAL   5 -14.188  -1.122  -1.198
   35    HA   VAL   5           HA       VAL   5 -12.493  -3.594  -1.275
   36    HB   VAL   5           HB       VAL   5 -14.150  -2.121  -3.351
   37   HG11  VAL   5          HG11      VAL   5 -12.143  -4.346  -3.603
   38   HG12  VAL   5          HG12      VAL   5 -12.397  -2.954  -4.655
   39   HG13  VAL   5          HG13      VAL   5 -13.536  -4.299  -4.684
   40   HG21  VAL   5          HG21      VAL   5 -14.401  -4.790  -1.938
   41   HG22  VAL   5          HG22      VAL   5 -15.336  -4.377  -3.374
   42   HG23  VAL   5          HG23      VAL   5 -15.534  -3.440  -1.893
   43    H    ASN   6           H        ASN   6 -12.772  -0.422  -2.932
   44    HA   ASN   6           HA       ASN   6 -10.075  -0.378  -3.925
   45    HB2  ASN   6           HB2      ASN   6 -12.122   1.787  -3.329
   46    HB3  ASN   6           HB3      ASN   6 -10.641   2.063  -4.245
   47   HD21  ASN   6          HD21      ASN   6 -10.720   1.593  -6.476
   48   HD22  ASN   6          HD22      ASN   6 -11.984   0.747  -7.228
   49    H    SER   7           H        SER   7 -11.563   0.916  -0.941
   50    HA   SER   7           HA       SER   7  -9.350   2.402   0.062
   51    HB2  SER   7           HB2      SER   7 -11.779   2.211   0.883
   52    HB3  SER   7           HB3      SER   7 -11.283   0.727   1.692
   53    HG   SER   7           HG       SER   7 -11.009   2.363   3.147
   54    H    TYR   8           H        TYR   8 -10.229  -1.034   0.585
   55    HA   TYR   8           HA       TYR   8  -7.892  -1.684   2.163
   56    HB2  TYR   8           HB2      TYR   8  -9.776  -3.090   2.391
   57    HB3  TYR   8           HB3      TYR   8 -10.040  -3.172   0.650
   58    HD1  TYR   8           HD1      TYR   8  -7.471  -4.074   3.236
   59    HD2  TYR   8           HD2      TYR   8  -9.309  -5.056  -0.519
   60    HE1  TYR   8           HE2      TYR   8  -6.135  -6.160   3.128
   61    HE2  TYR   8           HE1      TYR   8  -7.974  -7.142  -0.628
   62    HH   TYR   8           HH       TYR   8  -5.647  -7.890   0.418
   63    H    LEU   9           H        LEU   9  -8.697  -2.024  -1.305
   64    HA   LEU   9           HA       LEU   9  -6.335  -3.406  -2.128
   65    HB2  LEU   9           HB2      LEU   9  -8.612  -1.974  -3.278
   66    HB3  LEU   9           HB3      LEU   9  -7.155  -1.763  -4.242
   67    HG   LEU   9           HG       LEU   9  -8.460  -3.759  -4.945
   68   HD11  LEU   9          HD11      LEU   9  -6.598  -5.212  -5.147
   69   HD12  LEU   9          HD12      LEU   9  -5.908  -4.676  -3.615
   70   HD13  LEU   9          HD13      LEU   9  -5.891  -3.602  -5.014
   71   HD21  LEU   9          HD21      LEU   9  -9.165  -4.157  -2.447
   72   HD22  LEU   9          HD22      LEU   9  -7.668  -5.087  -2.364
   73   HD23  LEU   9          HD23      LEU   9  -8.929  -5.546  -3.508
   74    H    TRP  10           H        TRP  10  -7.027   0.093  -1.846
   75    HA   TRP  10           HA       TRP  10  -4.547   1.016  -2.980
   76    HB2  TRP  10           HB2      TRP  10  -6.260   2.608  -2.855
   77    HB3  TRP  10           HB3      TRP  10  -6.737   2.113  -1.232
   78    HD1  TRP  10           HD1      TRP  10  -3.968   4.060  -3.061
   79    HE1  TRP  10           HE1      TRP  10  -2.862   5.676  -1.383
   80    HE3  TRP  10           HE3      TRP  10  -6.351   2.648   1.229
   81    HZ2  TRP  10           HZ2      TRP  10  -2.977   6.290   1.406
   82    HZ3  TRP  10           HZ3      TRP  10  -5.833   3.764   3.380
   83    HH2  TRP  10           HH2      TRP  10  -4.151   5.583   3.473
   84    H    GLN  11           H        GLN  11  -5.556   0.492   0.429
   85    HA   GLN  11           HA       GLN  11  -3.185   1.338   1.717
   86    HB2  GLN  11           HB2      GLN  11  -5.607   0.176   2.394
   87    HB3  GLN  11           HB3      GLN  11  -4.444  -1.071   2.844
   88    HG2  GLN  11           HG2      GLN  11  -3.257   1.279   3.746
   89    HG3  GLN  11           HG3      GLN  11  -4.968   1.516   4.101
   90   HE21  GLN  11          HE21      GLN  11  -2.108  -0.053   5.190
   91   HE22  GLN  11          HE22      GLN  11  -2.832  -1.053   6.355
   92    H    ARG  12           H        ARG  12  -3.952  -1.794   0.211
   93    HA   ARG  12           HA       ARG  12  -1.538  -3.149   1.068
   94    HB2  ARG  12           HB2      ARG  12  -3.962  -3.741  -0.203
   95    HB3  ARG  12           HB3      ARG  12  -2.742  -4.067  -1.434
   96    HG2  ARG  12           HG2      ARG  12  -1.593  -5.173   0.811
   97    HG3  ARG  12           HG3      ARG  12  -3.306  -5.505   1.072
   98    HD2  ARG  12           HD2      ARG  12  -3.487  -6.621  -1.078
   99    HD3  ARG  12           HD3      ARG  12  -1.829  -6.147  -1.506
  100    HE   ARG  12           HE       ARG  12  -2.541  -8.079   0.661
  101   HH11  ARG  12          HH11      ARG  12  -0.998  -8.610  -1.984
  102   HH12  ARG  12          HH12      ARG  12   0.616  -8.761  -1.374
  103   HH21  ARG  12          HH21      ARG  12  -0.147  -7.366   1.718
  104   HH22  ARG  12          HH22      ARG  12   1.099  -8.058   0.734
  105    H    TRP  13           H        TRP  13  -2.395  -1.158  -1.749
  106    HA   TRP  13           HA       TRP  13  -0.134  -1.813  -3.390
  107    HB2  TRP  13           HB2      TRP  13  -1.395  -0.539  -4.768
  108    HB3  TRP  13           HB3      TRP  13  -2.442  -0.139  -3.415
  109    HD1  TRP  13           HD1      TRP  13  -2.576   2.321  -2.830
  110    HE1  TRP  13           HE1      TRP  13  -1.159   4.419  -3.312
  111    HE3  TRP  13           HE3      TRP  13   1.380   0.178  -5.236
  112    HZ2  TRP  13           HZ2      TRP  13   1.328   5.097  -4.554
  113    HZ3  TRP  13           HZ3      TRP  13   3.258   1.569  -6.059
  114    HH2  TRP  13           HH2      TRP  13   3.238   4.025  -5.721
  115    H    GLU  14           H        GLU  14  -0.637   0.816  -0.999
  116    HA   GLU  14           HA       GLU  14   2.001   1.965  -1.348
  117    HB2  GLU  14           HB2      GLU  14  -0.246   2.126   0.649
  118    HB3  GLU  14           HB3      GLU  14   1.296   2.908   1.005
  119    HG2  GLU  14           HG2      GLU  14   0.993   3.799  -1.497
  120    HG3  GLU  14           HG3      GLU  14  -0.709   3.550  -1.112
  121    H    ASN  15           H        ASN  15   0.619  -0.416   0.928
  122    HA   ASN  15           HA       ASN  15   2.840  -0.720   2.675
  123    HB2  ASN  15           HB2      ASN  15   0.374  -1.767   2.505
  124    HB3  ASN  15           HB3      ASN  15   1.263  -3.109   1.784
  125   HD21  ASN  15          HD21      ASN  15   3.561  -3.351   3.228
  126   HD22  ASN  15          HD22      ASN  15   3.245  -3.538   4.884
  127    H    TRP  16           H        TRP  16   2.076  -2.459  -0.367
  128    HA   TRP  16           HA       TRP  16   4.522  -4.005  -0.420
  129    HB2  TRP  16           HB2      TRP  16   2.754  -4.860  -1.709
  130    HB3  TRP  16           HB3      TRP  16   2.300  -3.268  -2.318
  131    HD1  TRP  16           HD1      TRP  16   4.952  -6.004  -2.787
  132    HE1  TRP  16           HE1      TRP  16   6.042  -5.703  -5.104
  133    HE3  TRP  16           HE3      TRP  16   2.757  -1.623  -4.233
  134    HZ2  TRP  16           HZ2      TRP  16   5.991  -3.850  -7.279
  135    HZ3  TRP  16           HZ3      TRP  16   3.297  -0.615  -6.431
  136    HH2  TRP  16           HH2      TRP  16   4.909  -1.721  -7.954
  137    H    PHE  17           H        PHE  17   3.505  -0.935  -1.946
  138    HA   PHE  17           HA       PHE  17   5.793  -0.434  -3.540
  139    HB2  PHE  17           HB2      PHE  17   3.614   0.790  -3.542
  140    HB3  PHE  17           HB3      PHE  17   4.050   1.518  -1.996
  141    HD1  PHE  17           HD1      PHE  17   5.513   1.012  -5.420
  142    HD2  PHE  17           HD2      PHE  17   5.067   3.611  -2.029
  143    HE1  PHE  17           HE2      PHE  17   6.775   2.782  -6.611
  144    HE2  PHE  17           HE1      PHE  17   6.326   5.382  -3.222
  145    HZ   PHE  17           HZ       PHE  17   7.182   4.969  -5.512
  146    H    TRP  18           H        TRP  18   5.132   0.883  -0.251
  147    HA   TRP  18           HA       TRP  18   7.717   2.011   0.166
  148    HB2  TRP  18           HB2      TRP  18   5.676   0.868   2.102
  149    HB3  TRP  18           HB3      TRP  18   7.025   1.900   2.573
  150    HD1  TRP  18           HD1      TRP  18   3.666   2.407   2.455
  151    HE1  TRP  18           HE1      TRP  18   2.923   4.682   1.499
  152    HE3  TRP  18           HE3      TRP  18   7.929   3.767  -0.011
  153    HZ2  TRP  18           HZ2      TRP  18   3.994   6.798  -0.092
  154    HZ3  TRP  18           HZ3      TRP  18   8.039   5.918  -1.234
  155    HH2  TRP  18           HH2      TRP  18   6.079   7.435  -1.277
  156    H    ASN  19           H        ASN  19   6.486  -1.272   0.803
  157    HA   ASN  19           HA       ASN  19   8.633  -2.320   2.321
  158    HB2  ASN  19           HB2      ASN  19   6.505  -3.325   0.504
  159    HB3  ASN  19           HB3      ASN  19   7.835  -4.437   0.820
  160   HD21  ASN  19          HD21      ASN  19   6.993  -5.863   2.381
  161   HD22  ASN  19          HD22      ASN  19   6.269  -5.369   3.834
  162    H    VAL  20           H        VAL  20   8.279  -2.182  -1.254
  163    HA   VAL  20           HA       VAL  20  11.037  -3.234  -1.578
  164    HB   VAL  20           HB       VAL  20  10.416  -3.310  -3.967
  165   HG11  VAL  20          HG11      VAL  20   9.647  -5.074  -2.281
  166   HG12  VAL  20          HG12      VAL  20   8.763  -5.014  -3.806
  167   HG13  VAL  20          HG13      VAL  20   8.063  -4.302  -2.352
  168   HG21  VAL  20          HG21      VAL  20   8.164  -2.612  -4.689
  169   HG22  VAL  20          HG22      VAL  20   9.058  -1.240  -4.036
  170   HG23  VAL  20          HG23      VAL  20   7.816  -2.025  -3.064
  171    H    THR  21           H        THR  21   9.250  -0.192  -1.979
  172    HA   THR  21           HA       THR  21  11.319   1.213  -3.431
  173    HB   THR  21           HB       THR  21   9.017   2.123  -1.672
  174    HG1  THR  21           HG1      THR  21   9.344   1.815  -4.475
  175   HG21  THR  21          HG21      THR  21  10.839   3.669  -3.528
  176   HG22  THR  21          HG22      THR  21  10.545   3.966  -1.815
  177   HG23  THR  21          HG23      THR  21   9.271   4.274  -2.996
  178    H    LEU  22           H        LEU  22  10.673   0.674   0.002
  179    HA   LEU  22           HA       LEU  22  13.021   2.379   0.713
  180    HB2  LEU  22           HB2      LEU  22  10.712   1.246   2.333
  181    HB3  LEU  22           HB3      LEU  22  11.996   2.253   2.998
  182    HG   LEU  22           HG       LEU  22  10.506   3.270   0.608
  183   HD11  LEU  22          HD11      LEU  22   9.442   3.621   3.416
  184   HD12  LEU  22          HD12      LEU  22   8.835   2.367   2.334
  185   HD13  LEU  22          HD13      LEU  22   8.668   4.067   1.896
  186   HD21  LEU  22          HD21      LEU  22  12.395   4.543   1.500
  187   HD22  LEU  22          HD22      LEU  22  11.681   4.518   3.113
  188   HD23  LEU  22          HD23      LEU  22  10.899   5.421   1.816
  189    H    ARG  23           H        ARG  23  12.042  -0.011   2.985
  190    HA   ARG  23           HA       ARG  23  13.440  -2.330   2.199
  191    HB2  ARG  23           HB2      ARG  23  15.443  -1.028   2.031
  192    HB3  ARG  23           HB3      ARG  23  15.133  -0.213   3.557
  193    HG2  ARG  23           HG2      ARG  23  15.253  -3.143   3.793
  194    HG3  ARG  23           HG3      ARG  23  16.760  -2.416   3.238
  195    HD2  ARG  23           HD2      ARG  23  16.558  -0.776   5.182
  196    HD3  ARG  23           HD3      ARG  23  15.251  -1.807   5.797
  197    HE   ARG  23           HE       ARG  23  18.091  -2.647   5.476
  198   HH11  ARG  23          HH11      ARG  23  16.207  -4.897   4.897
  199   HH12  ARG  23          HH12      ARG  23  15.984  -5.604   6.462
  200   HH21  ARG  23          HH21      ARG  23  17.213  -2.836   8.172
  201   HH22  ARG  23          HH22      ARG  23  16.555  -4.432   8.324
  202    HA   PRO  24           HA       PRO  24  12.903  -2.498   6.920
  203    HB2  PRO  24           HB2      PRO  24  12.442  -0.216   8.346
  204    HB3  PRO  24           HB3      PRO  24  14.073  -0.792   7.955
  205    HG2  PRO  24           HG2      PRO  24  12.511   1.411   6.753
  206    HG3  PRO  24           HG3      PRO  24  14.258   1.247   6.966
  207    HD2  PRO  24           HD2      PRO  24  12.863   0.843   4.593
  208    HD3  PRO  24           HD3      PRO  24  14.515   0.298   4.939
  209    H    GLU  25           H        GLU  25  11.000  -1.769   8.666
  210    HA   GLU  25           HA       GLU  25   8.481  -2.171   7.229
  211    HB2  GLU  25           HB2      GLU  25   9.497  -2.090  10.036
  212    HB3  GLU  25           HB3      GLU  25   7.775  -1.783   9.807
  213    HG2  GLU  25           HG2      GLU  25   7.569  -4.043   9.813
  214    HG3  GLU  25           HG3      GLU  25   8.184  -3.952   8.163
  215    H    ARG  26           H        ARG  26   6.560  -0.720   7.748
  216    HA   ARG  26           HA       ARG  26   7.392   2.158   7.970
  217    HB2  ARG  26           HB2      ARG  26   6.499   0.894   5.730
  218    HB3  ARG  26           HB3      ARG  26   4.965   1.421   6.420
  219    HG2  ARG  26           HG2      ARG  26   7.263   3.354   6.237
  220    HG3  ARG  26           HG3      ARG  26   6.267   3.037   4.817
  221    HD2  ARG  26           HD2      ARG  26   4.872   4.638   5.653
  222    HD3  ARG  26           HD3      ARG  26   4.384   3.410   6.839
  223    HE   ARG  26           HE       ARG  26   6.151   4.291   8.351
  224   HH11  ARG  26          HH11      ARG  26   7.500   5.778   5.956
  225   HH12  ARG  26          HH12      ARG  26   7.166   7.419   6.398
  226   HH21  ARG  26          HH21      ARG  26   4.764   6.572   8.763
  227   HH22  ARG  26          HH22      ARG  26   5.612   7.870   7.992
  Start of MODEL   18
    1    HA   ARG   1           HA       ARG   1 -17.357  -1.185  -6.209
    2    HB2  ARG   1           HB2      ARG   1 -15.972  -2.997  -7.405
    3    HB3  ARG   1           HB3      ARG   1 -15.680  -3.675  -5.803
    4    HG2  ARG   1           HG2      ARG   1 -17.939  -4.207  -5.473
    5    HG3  ARG   1           HG3      ARG   1 -18.489  -3.044  -6.678
    6    HD2  ARG   1           HD2      ARG   1 -17.784  -4.433  -8.494
    7    HD3  ARG   1           HD3      ARG   1 -16.836  -5.478  -7.417
    8    HE   ARG   1           HE       ARG   1 -18.863  -6.492  -6.661
    9   HH11  ARG   1          HH11      ARG   1 -19.788  -6.244  -9.475
   10   HH12  ARG   1          HH12      ARG   1 -21.309  -5.433  -9.306
   11   HH21  ARG   1          HH21      ARG   1 -20.664  -4.351  -6.065
   12   HH22  ARG   1          HH22      ARG   1 -21.808  -4.360  -7.365
   13    H    SER   2           H        SER   2 -18.621  -2.006  -4.386
   14    HA   SER   2           HA       SER   2 -19.142  -2.190  -2.093
   15    HB2  SER   2           HB2      SER   2 -17.006  -3.864  -2.710
   16    HB3  SER   2           HB3      SER   2 -16.441  -2.995  -1.285
   17    HG   SER   2           HG       SER   2 -18.388  -4.895  -1.536
   18    H    ALA   3           H        ALA   3 -17.688  -1.672   0.213
   19    HA   ALA   3           HA       ALA   3 -16.890   1.200  -0.159
   20    HB1  ALA   3           HB1      ALA   3 -18.227  -0.320   2.098
   21    HB2  ALA   3           HB2      ALA   3 -18.941   0.936   1.085
   22    HB3  ALA   3           HB3      ALA   3 -17.683   1.352   2.248
   23    H    LEU   4           H        LEU   4 -16.260  -1.642   1.962
   24    HA   LEU   4           HA       LEU   4 -13.651  -0.465   2.757
   25    HB2  LEU   4           HB2      LEU   4 -15.656  -2.236   3.852
   26    HB3  LEU   4           HB3      LEU   4 -14.082  -3.026   3.900
   27    HG   LEU   4           HG       LEU   4 -14.564  -1.672   5.950
   28   HD11  LEU   4          HD11      LEU   4 -12.376  -0.068   5.170
   29   HD12  LEU   4          HD12      LEU   4 -12.222  -1.569   4.259
   30   HD13  LEU   4          HD13      LEU   4 -12.317  -1.612   6.019
   31   HD21  LEU   4          HD21      LEU   4 -14.755   0.696   5.857
   32   HD22  LEU   4          HD22      LEU   4 -15.819   0.111   4.578
   33   HD23  LEU   4          HD23      LEU   4 -14.227   0.753   4.175
   34    H    VAL   5           H        VAL   5 -14.177  -1.630  -0.028
   35    HA   VAL   5           HA       VAL   5 -12.225  -3.899   0.011
   36    HB   VAL   5           HB       VAL   5 -14.338  -2.934  -1.941
   37   HG11  VAL   5          HG11      VAL   5 -12.732  -3.688  -3.453
   38   HG12  VAL   5          HG12      VAL   5 -13.594  -5.187  -3.106
   39   HG13  VAL   5          HG13      VAL   5 -12.055  -4.851  -2.312
   40   HG21  VAL   5          HG21      VAL   5 -13.980  -5.602  -0.543
   41   HG22  VAL   5          HG22      VAL   5 -15.387  -5.061  -1.458
   42   HG23  VAL   5          HG23      VAL   5 -14.992  -4.300   0.084
   43    H    ASN   6           H        ASN   6 -13.035  -0.998  -1.957
   44    HA   ASN   6           HA       ASN   6 -10.520  -0.919  -3.361
   45    HB2  ASN   6           HB2      ASN   6 -12.991   0.377  -3.409
   46    HB3  ASN   6           HB3      ASN   6 -11.862   1.656  -2.956
   47   HD21  ASN   6          HD21      ASN   6 -10.030   2.084  -4.464
   48   HD22  ASN   6          HD22      ASN   6 -10.149   1.618  -6.092
   49    H    SER   7           H        SER   7 -11.639   0.555  -0.312
   50    HA   SER   7           HA       SER   7  -9.453   2.338   0.143
   51    HB2  SER   7           HB2      SER   7 -10.156   1.920   2.580
   52    HB3  SER   7           HB3      SER   7 -11.431   2.461   1.494
   53    HG   SER   7           HG       SER   7 -11.577   0.402   2.970
   54    H    TYR   8           H        TYR   8  -9.932  -1.062   1.164
   55    HA   TYR   8           HA       TYR   8  -7.327  -1.390   2.365
   56    HB2  TYR   8           HB2      TYR   8  -9.009  -2.926   2.994
   57    HB3  TYR   8           HB3      TYR   8  -9.536  -3.172   1.330
   58    HD1  TYR   8           HD1      TYR   8  -6.598  -3.711   3.592
   59    HD2  TYR   8           HD2      TYR   8  -8.740  -5.008   0.102
   60    HE1  TYR   8           HE2      TYR   8  -5.097  -5.676   3.401
   61    HE2  TYR   8           HE1      TYR   8  -7.240  -6.972  -0.089
   62    HH   TYR   8           HH       TYR   8  -5.697  -8.305   1.887
   63    H    LEU   9           H        LEU   9  -8.627  -1.938  -0.908
   64    HA   LEU   9           HA       LEU   9  -6.407  -3.273  -2.085
   65    HB2  LEU   9           HB2      LEU   9  -8.714  -1.587  -2.955
   66    HB3  LEU   9           HB3      LEU   9  -7.432  -1.845  -4.136
   67    HG   LEU   9           HG       LEU   9  -8.809  -4.075  -2.612
   68   HD11  LEU   9          HD11      LEU   9  -9.893  -4.543  -4.830
   69   HD12  LEU   9          HD12      LEU   9  -9.256  -3.006  -5.414
   70   HD13  LEU   9          HD13      LEU   9 -10.423  -3.032  -4.093
   71   HD21  LEU   9          HD21      LEU   9  -6.828  -3.989  -4.907
   72   HD22  LEU   9          HD22      LEU   9  -7.749  -5.434  -4.487
   73   HD23  LEU   9          HD23      LEU   9  -6.611  -4.745  -3.328
   74    H    TRP  10           H        TRP  10  -7.110   0.230  -1.805
   75    HA   TRP  10           HA       TRP  10  -4.776   1.178  -3.175
   76    HB2  TRP  10           HB2      TRP  10  -6.509   2.735  -2.823
   77    HB3  TRP  10           HB3      TRP  10  -6.731   2.249  -1.143
   78    HD1  TRP  10           HD1      TRP  10  -4.173   4.103  -3.362
   79    HE1  TRP  10           HE1      TRP  10  -2.903   5.797  -1.890
   80    HE3  TRP  10           HE3      TRP  10  -6.155   2.962   1.202
   81    HZ2  TRP  10           HZ2      TRP  10  -2.751   6.566   0.861
   82    HZ3  TRP  10           HZ3      TRP  10  -5.430   4.188   3.230
   83    HH2  TRP  10           HH2      TRP  10  -3.732   5.987   3.065
   84    H    GLN  11           H        GLN  11  -5.409   0.575   0.301
   85    HA   GLN  11           HA       GLN  11  -2.907   1.395   1.355
   86    HB2  GLN  11           HB2      GLN  11  -5.235  -0.196   2.115
   87    HB3  GLN  11           HB3      GLN  11  -3.755  -0.842   2.825
   88    HG2  GLN  11           HG2      GLN  11  -3.718   2.030   3.022
   89    HG3  GLN  11           HG3      GLN  11  -5.235   1.420   3.684
   90   HE21  GLN  11          HE21      GLN  11  -4.835  -0.683   5.149
   91   HE22  GLN  11          HE22      GLN  11  -3.527  -0.563   6.223
   92    H    ARG  12           H        ARG  12  -3.896  -1.728  -0.053
   93    HA   ARG  12           HA       ARG  12  -1.500  -3.200   0.498
   94    HB2  ARG  12           HB2      ARG  12  -3.836  -3.948  -0.299
   95    HB3  ARG  12           HB3      ARG  12  -3.296  -3.504  -1.918
   96    HG2  ARG  12           HG2      ARG  12  -1.393  -5.053  -1.724
   97    HG3  ARG  12           HG3      ARG  12  -1.904  -5.489  -0.093
   98    HD2  ARG  12           HD2      ARG  12  -2.883  -7.212  -1.344
   99    HD3  ARG  12           HD3      ARG  12  -4.207  -6.031  -1.318
  100    HE   ARG  12           HE       ARG  12  -3.213  -5.184  -3.534
  101   HH11  ARG  12          HH11      ARG  12  -0.946  -7.275  -3.326
  102   HH12  ARG  12          HH12      ARG  12  -1.498  -8.453  -4.469
  103   HH21  ARG  12          HH21      ARG  12  -4.733  -7.185  -4.605
  104   HH22  ARG  12          HH22      ARG  12  -3.651  -8.400  -5.198
  105    H    TRP  13           H        TRP  13  -2.446  -1.138  -2.269
  106    HA   TRP  13           HA       TRP  13  -0.188  -1.698  -3.938
  107    HB2  TRP  13           HB2      TRP  13  -1.498  -0.412  -5.260
  108    HB3  TRP  13           HB3      TRP  13  -2.509  -0.030  -3.875
  109    HD1  TRP  13           HD1      TRP  13  -2.642   2.426  -3.288
  110    HE1  TRP  13           HE1      TRP  13  -1.226   4.527  -3.760
  111    HE3  TRP  13           HE3      TRP  13   1.305   0.300  -5.731
  112    HZ2  TRP  13           HZ2      TRP  13   1.254   5.215  -5.008
  113    HZ3  TRP  13           HZ3      TRP  13   3.178   1.700  -6.553
  114    HH2  TRP  13           HH2      TRP  13   3.158   4.152  -6.193
  115    H    GLU  14           H        GLU  14  -0.699   0.867  -1.485
  116    HA   GLU  14           HA       GLU  14   1.959   2.007  -1.810
  117    HB2  GLU  14           HB2      GLU  14  -0.356   2.221   0.093
  118    HB3  GLU  14           HB3      GLU  14   1.190   2.937   0.551
  119    HG2  GLU  14           HG2      GLU  14   1.012   3.838  -1.994
  120    HG3  GLU  14           HG3      GLU  14  -0.703   3.735  -1.594
  121    H    ASN  15           H        ASN  15   0.478  -0.345   0.418
  122    HA   ASN  15           HA       ASN  15   2.565  -0.698   2.284
  123    HB2  ASN  15           HB2      ASN  15   0.177  -1.710   2.082
  124    HB3  ASN  15           HB3      ASN  15   0.947  -2.964   1.110
  125   HD21  ASN  15          HD21      ASN  15   2.899  -4.068   2.222
  126   HD22  ASN  15          HD22      ASN  15   2.808  -4.294   3.901
  127    H    TRP  16           H        TRP  16   2.138  -2.224  -0.932
  128    HA   TRP  16           HA       TRP  16   4.545  -3.839  -0.779
  129    HB2  TRP  16           HB2      TRP  16   2.982  -4.602  -2.339
  130    HB3  TRP  16           HB3      TRP  16   2.552  -2.971  -2.854
  131    HD1  TRP  16           HD1      TRP  16   5.477  -5.478  -3.156
  132    HE1  TRP  16           HE1      TRP  16   6.713  -5.013  -5.369
  133    HE3  TRP  16           HE3      TRP  16   2.927  -1.345  -4.738
  134    HZ2  TRP  16           HZ2      TRP  16   6.635  -3.134  -7.522
  135    HZ3  TRP  16           HZ3      TRP  16   3.530  -0.239  -6.871
  136    HH2  TRP  16           HH2      TRP  16   5.379  -1.126  -8.264
  137    H    PHE  17           H        PHE  17   3.762  -0.692  -2.298
  138    HA   PHE  17           HA       PHE  17   6.254  -0.120  -3.511
  139    HB2  PHE  17           HB2      PHE  17   4.150   1.160  -3.785
  140    HB3  PHE  17           HB3      PHE  17   4.269   1.713  -2.115
  141    HD1  PHE  17           HD1      PHE  17   5.992   1.791  -5.421
  142    HD2  PHE  17           HD2      PHE  17   5.626   3.572  -1.528
  143    HE1  PHE  17           HE1      PHE  17   7.443   3.669  -6.142
  144    HE2  PHE  17           HE2      PHE  17   7.076   5.448  -2.249
  145    HZ   PHE  17           HZ       PHE  17   7.985   5.497  -4.556
  146    H    TRP  18           H        TRP  18   5.136   0.590  -0.182
  147    HA   TRP  18           HA       TRP  18   7.655   1.769   0.664
  148    HB2  TRP  18           HB2      TRP  18   5.215   0.667   2.089
  149    HB3  TRP  18           HB3      TRP  18   6.547   1.448   2.938
  150    HD1  TRP  18           HD1      TRP  18   3.310   2.315   1.853
  151    HE1  TRP  18           HE1      TRP  18   3.074   4.805   1.222
  152    HE3  TRP  18           HE3      TRP  18   8.238   3.575   1.390
  153    HZ2  TRP  18           HZ2      TRP  18   4.757   7.033   0.607
  154    HZ3  TRP  18           HZ3      TRP  18   8.893   5.887   0.782
  155    HH2  TRP  18           HH2      TRP  18   7.159   7.615   0.391
  156    H    ASN  19           H        ASN  19   6.210  -1.486   0.851
  157    HA   ASN  19           HA       ASN  19   7.995  -2.763   2.627
  158    HB2  ASN  19           HB2      ASN  19   6.036  -3.439   0.625
  159    HB3  ASN  19           HB3      ASN  19   7.416  -4.521   0.458
  160   HD21  ASN  19          HD21      ASN  19   4.668  -5.114   1.559
  161   HD22  ASN  19          HD22      ASN  19   4.937  -5.714   3.124
  162    H    VAL  20           H        VAL  20   8.371  -2.238  -0.898
  163    HA   VAL  20           HA       VAL  20  11.033  -3.489  -0.904
  164    HB   VAL  20           HB       VAL  20  10.940  -2.950  -3.313
  165   HG11  VAL  20          HG11      VAL  20   8.160  -3.856  -2.662
  166   HG12  VAL  20          HG12      VAL  20   9.520  -4.830  -2.103
  167   HG13  VAL  20          HG13      VAL  20   9.310  -4.516  -3.826
  168   HG21  VAL  20          HG21      VAL  20   9.818  -0.730  -3.066
  169   HG22  VAL  20          HG22      VAL  20   8.320  -1.563  -2.655
  170   HG23  VAL  20          HG23      VAL  20   9.025  -1.760  -4.258
  171    H    THR  21           H        THR  21   9.712  -0.217  -0.751
  172    HA   THR  21           HA       THR  21  12.251   1.093  -1.390
  173    HB   THR  21           HB       THR  21   9.654   2.099  -0.180
  174    HG1  THR  21           HG1      THR  21   9.054   1.617  -2.146
  175   HG21  THR  21          HG21      THR  21  12.052   3.530  -1.346
  176   HG22  THR  21          HG22      THR  21  11.375   3.708   0.273
  177   HG23  THR  21          HG23      THR  21  10.483   4.304  -1.126
  178    H    LEU  22           H        LEU  22  10.670  -0.063   1.515
  179    HA   LEU  22           HA       LEU  22  12.499   1.470   3.284
  180    HB2  LEU  22           HB2      LEU  22  10.182  -0.422   3.759
  181    HB3  LEU  22           HB3      LEU  22  11.055   0.406   5.048
  182    HG   LEU  22           HG       LEU  22   9.663   1.830   2.758
  183   HD11  LEU  22          HD11      LEU  22   7.973   2.439   4.488
  184   HD12  LEU  22          HD12      LEU  22   8.771   1.344   5.617
  185   HD13  LEU  22          HD13      LEU  22   8.007   0.706   4.161
  186   HD21  LEU  22          HD21      LEU  22  11.180   2.680   5.211
  187   HD22  LEU  22          HD22      LEU  22   9.887   3.708   4.593
  188   HD23  LEU  22          HD23      LEU  22  11.270   3.321   3.570
  189    H    ARG  23           H        ARG  23  12.616  -1.468   1.639
  190    HA   ARG  23           HA       ARG  23  13.519  -3.427   3.407
  191    HB2  ARG  23           HB2      ARG  23  13.781  -2.744   0.584
  192    HB3  ARG  23           HB3      ARG  23  15.206  -3.596   1.175
  193    HG2  ARG  23           HG2      ARG  23  14.068  -5.542   1.505
  194    HG3  ARG  23           HG3      ARG  23  12.623  -4.714   2.085
  195    HD2  ARG  23           HD2      ARG  23  11.657  -5.009   0.062
  196    HD3  ARG  23           HD3      ARG  23  12.958  -4.065  -0.692
  197    HE   ARG  23           HE       ARG  23  13.071  -7.023  -0.234
  198   HH11  ARG  23          HH11      ARG  23  15.718  -5.567  -0.443
  199   HH12  ARG  23          HH12      ARG  23  16.067  -5.717  -2.134
  200   HH21  ARG  23          HH21      ARG  23  12.813  -6.593  -2.992
  201   HH22  ARG  23          HH22      ARG  23  14.415  -6.305  -3.583
  202    HA   PRO  24           HA       PRO  24  18.000  -1.739   3.274
  203    HB2  PRO  24           HB2      PRO  24  18.448   0.724   2.164
  204    HB3  PRO  24           HB3      PRO  24  18.512  -0.784   1.230
  205    HG2  PRO  24           HG2      PRO  24  16.336   1.237   1.412
  206    HG3  PRO  24           HG3      PRO  24  16.908   0.316   0.013
  207    HD2  PRO  24           HD2      PRO  24  14.649  -0.309   1.403
  208    HD3  PRO  24           HD3      PRO  24  15.621  -1.504   0.518
  209    H    GLU  25           H        GLU  25  17.630  -1.468   5.514
  210    HA   GLU  25           HA       GLU  25  16.360   0.930   6.608
  211    HB2  GLU  25           HB2      GLU  25  16.772  -0.173   8.719
  212    HB3  GLU  25           HB3      GLU  25  16.331  -1.423   7.560
  213    HG2  GLU  25           HG2      GLU  25  19.222  -0.875   7.631
  214    HG3  GLU  25           HG3      GLU  25  18.583  -1.469   9.163
  215    H    ARG  26           H        ARG  26  17.952   1.654   8.743
  216    HA   ARG  26           HA       ARG  26  20.470   2.663   7.455
  217    HB2  ARG  26           HB2      ARG  26  18.284   4.139   8.037
  218    HB3  ARG  26           HB3      ARG  26  19.099   4.216   9.600
  219    HG2  ARG  26           HG2      ARG  26  20.345   5.884   8.723
  220    HG3  ARG  26           HG3      ARG  26  21.156   4.639   7.773
  221    HD2  ARG  26           HD2      ARG  26  18.584   5.941   6.834
  222    HD3  ARG  26           HD3      ARG  26  20.182   6.596   6.428
  223    HE   ARG  26           HE       ARG  26  20.469   3.945   5.782
  224   HH11  ARG  26          HH11      ARG  26  19.778   6.457   3.958
  225   HH12  ARG  26          HH12      ARG  26  18.596   5.722   2.927
  226   HH21  ARG  26          HH21      ARG  26  18.205   2.913   4.935
  227   HH22  ARG  26          HH22      ARG  26  17.700   3.710   3.483
  Start of MODEL   19
    1    HA   ARG   1           HA       ARG   1 -19.924   2.997  -4.557
    2    HB2  ARG   1           HB2      ARG   1 -19.861   5.235  -5.813
    3    HB3  ARG   1           HB3      ARG   1 -18.175   5.353  -5.306
    4    HG2  ARG   1           HG2      ARG   1 -17.805   3.070  -6.340
    5    HG3  ARG   1           HG3      ARG   1 -19.430   3.190  -7.017
    6    HD2  ARG   1           HD2      ARG   1 -18.019   4.010  -8.751
    7    HD3  ARG   1           HD3      ARG   1 -18.623   5.484  -7.968
    8    HE   ARG   1           HE       ARG   1 -16.491   5.623  -6.735
    9   HH11  ARG   1          HH11      ARG   1 -15.693   5.598  -9.630
   10   HH12  ARG   1          HH12      ARG   1 -14.438   4.405  -9.648
   11   HH21  ARG   1          HH21      ARG   1 -15.309   3.057  -6.562
   12   HH22  ARG   1          HH22      ARG   1 -14.220   2.963  -7.908
   13    H    SER   2           H        SER   2 -18.297   1.485  -4.280
   14    HA   SER   2           HA       SER   2 -16.433   0.428  -3.312
   15    HB2  SER   2           HB2      SER   2 -15.325   3.217  -3.765
   16    HB3  SER   2           HB3      SER   2 -14.356   1.768  -3.498
   17    HG   SER   2           HG       SER   2 -15.134   0.925  -5.406
   18    H    ALA   3           H        ALA   3 -14.819   2.967  -1.812
   19    HA   ALA   3           HA       ALA   3 -14.689   3.779   0.397
   20    HB1  ALA   3           HB1      ALA   3 -17.242   2.389   1.120
   21    HB2  ALA   3           HB2      ALA   3 -17.315   3.705  -0.052
   22    HB3  ALA   3           HB3      ALA   3 -16.681   4.000   1.566
   23    H    LEU   4           H        LEU   4 -16.049   0.459   0.224
   24    HA   LEU   4           HA       LEU   4 -14.073  -0.354   2.328
   25    HB2  LEU   4           HB2      LEU   4 -16.856  -1.247   1.570
   26    HB3  LEU   4           HB3      LEU   4 -15.806  -2.286   2.533
   27    HG   LEU   4           HG       LEU   4 -16.097   0.571   3.373
   28   HD11  LEU   4          HD11      LEU   4 -18.174  -1.587   3.859
   29   HD12  LEU   4          HD12      LEU   4 -18.415  -0.099   2.943
   30   HD13  LEU   4          HD13      LEU   4 -18.125  -0.028   4.681
   31   HD21  LEU   4          HD21      LEU   4 -15.868  -2.085   4.827
   32   HD22  LEU   4          HD22      LEU   4 -15.916  -0.507   5.612
   33   HD23  LEU   4          HD23      LEU   4 -14.562  -0.929   4.564
   34    H    VAL   5           H        VAL   5 -14.233  -0.347  -0.919
   35    HA   VAL   5           HA       VAL   5 -13.199  -3.153  -1.213
   36    HB   VAL   5           HB       VAL   5 -14.574  -1.268  -3.165
   37   HG11  VAL   5          HG11      VAL   5 -12.867  -2.651  -4.297
   38   HG12  VAL   5          HG12      VAL   5 -14.494  -3.168  -4.743
   39   HG13  VAL   5          HG13      VAL   5 -13.563  -4.101  -3.573
   40   HG21  VAL   5          HG21      VAL   5 -15.436  -3.905  -1.927
   41   HG22  VAL   5          HG22      VAL   5 -16.360  -2.982  -3.113
   42   HG23  VAL   5          HG23      VAL   5 -16.075  -2.315  -1.506
   43    H    ASN   6           H        ASN   6 -12.827   0.198  -2.436
   44    HA   ASN   6           HA       ASN   6 -10.190  -0.370  -3.597
   45    HB2  ASN   6           HB2      ASN   6 -12.261   1.532  -3.863
   46    HB3  ASN   6           HB3      ASN   6 -10.865   2.433  -3.270
   47   HD21  ASN   6          HD21      ASN   6 -12.185   0.745  -6.031
   48   HD22  ASN   6          HD22      ASN   6 -10.863   0.998  -7.065
   49    H    SER   7           H        SER   7 -11.470   1.179  -0.656
   50    HA   SER   7           HA       SER   7  -9.182   2.506   0.316
   51    HB2  SER   7           HB2      SER   7 -11.478   1.015   1.578
   52    HB3  SER   7           HB3      SER   7 -10.240   1.755   2.588
   53    HG   SER   7           HG       SER   7 -12.248   2.998   1.811
   54    H    TYR   8           H        TYR   8 -10.096  -0.928   0.809
   55    HA   TYR   8           HA       TYR   8  -7.684  -1.624   2.256
   56    HB2  TYR   8           HB2      TYR   8  -9.597  -2.993   2.568
   57    HB3  TYR   8           HB3      TYR   8  -9.911  -3.095   0.837
   58    HD1  TYR   8           HD1      TYR   8  -7.299  -3.988   3.377
   59    HD2  TYR   8           HD2      TYR   8  -9.185  -4.975  -0.355
   60    HE1  TYR   8           HE1      TYR   8  -5.963  -6.073   3.252
   61    HE2  TYR   8           HE2      TYR   8  -7.850  -7.062  -0.476
   62    HH   TYR   8           HH       TYR   8  -6.606  -8.572   1.686
   63    H    LEU   9           H        LEU   9  -8.723  -1.954  -1.148
   64    HA   LEU   9           HA       LEU   9  -6.448  -3.336  -2.164
   65    HB2  LEU   9           HB2      LEU   9  -8.666  -1.624  -3.166
   66    HB3  LEU   9           HB3      LEU   9  -7.286  -1.797  -4.246
   67    HG   LEU   9           HG       LEU   9  -8.731  -4.130  -2.958
   68   HD11  LEU   9          HD11      LEU   9 -10.227  -2.980  -4.518
   69   HD12  LEU   9          HD12      LEU   9  -9.676  -4.495  -5.233
   70   HD13  LEU   9          HD13      LEU   9  -8.965  -2.966  -5.752
   71   HD21  LEU   9          HD21      LEU   9  -6.561  -4.853  -3.523
   72   HD22  LEU   9          HD22      LEU   9  -6.492  -3.828  -4.956
   73   HD23  LEU   9          HD23      LEU   9  -7.501  -5.275  -4.954
   74    H    TRP  10           H        TRP  10  -7.085   0.166  -1.836
   75    HA   TRP  10           HA       TRP  10  -4.671   1.113  -3.045
   76    HB2  TRP  10           HB2      TRP  10  -6.442   2.646  -2.724
   77    HB3  TRP  10           HB3      TRP  10  -6.684   2.153  -1.049
   78    HD1  TRP  10           HD1      TRP  10  -4.030   3.957  -3.207
   79    HE1  TRP  10           HE1      TRP  10  -2.816   5.674  -1.713
   80    HE3  TRP  10           HE3      TRP  10  -6.245   2.940   1.274
   81    HZ2  TRP  10           HZ2      TRP  10  -2.793   6.503   1.025
   82    HZ3  TRP  10           HZ3      TRP  10  -5.612   4.205   3.307
   83    HH2  TRP  10           HH2      TRP  10  -3.888   5.984   3.189
   84    H    GLN  11           H        GLN  11  -5.451   0.390   0.389
   85    HA   GLN  11           HA       GLN  11  -2.960   1.175   1.525
   86    HB2  GLN  11           HB2      GLN  11  -5.140  -0.789   2.215
   87    HB3  GLN  11           HB3      GLN  11  -3.699  -0.685   3.228
   88    HG2  GLN  11           HG2      GLN  11  -4.106   1.830   3.332
   89    HG3  GLN  11           HG3      GLN  11  -5.681   1.514   2.606
   90   HE21  GLN  11          HE21      GLN  11  -7.032  -0.228   3.850
   91   HE22  GLN  11          HE22      GLN  11  -6.931  -0.195   5.543
   92    H    ARG  12           H        ARG  12  -3.984  -1.948   0.124
   93    HA   ARG  12           HA       ARG  12  -1.612  -3.438   0.725
   94    HB2  ARG  12           HB2      ARG  12  -4.019  -3.617  -0.956
   95    HB3  ARG  12           HB3      ARG  12  -2.629  -4.451  -1.649
   96    HG2  ARG  12           HG2      ARG  12  -2.961  -4.904   1.241
   97    HG3  ARG  12           HG3      ARG  12  -4.297  -5.513   0.265
   98    HD2  ARG  12           HD2      ARG  12  -3.010  -7.140  -0.713
   99    HD3  ARG  12           HD3      ARG  12  -1.580  -6.092  -0.796
  100    HE   ARG  12           HE       ARG  12  -2.270  -6.743   1.950
  101   HH11  ARG  12          HH11      ARG  12   0.526  -6.511   0.855
  102   HH12  ARG  12          HH12      ARG  12   1.064  -8.157   0.899
  103   HH21  ARG  12          HH21      ARG  12  -2.138  -9.467   1.242
  104   HH22  ARG  12          HH22      ARG  12  -0.451  -9.837   1.118
  105    H    TRP  13           H        TRP  13  -2.481  -1.385  -2.071
  106    HA   TRP  13           HA       TRP  13  -0.202  -1.979  -3.697
  107    HB2  TRP  13           HB2      TRP  13  -1.507  -0.711  -5.038
  108    HB3  TRP  13           HB3      TRP  13  -2.497  -0.256  -3.660
  109    HD1  TRP  13           HD1      TRP  13  -2.565   2.224  -3.178
  110    HE1  TRP  13           HE1      TRP  13  -1.076   4.261  -3.706
  111    HE3  TRP  13           HE3      TRP  13   1.336  -0.111  -5.494
  112    HZ2  TRP  13           HZ2      TRP  13   1.437   4.825  -4.950
  113    HZ3  TRP  13           HZ3      TRP  13   3.263   1.197  -6.343
  114    HH2  TRP  13           HH2      TRP  13   3.317   3.661  -6.074
  115    H    GLU  14           H        GLU  14  -0.721   0.608  -1.268
  116    HA   GLU  14           HA       GLU  14   1.945   1.725  -1.572
  117    HB2  GLU  14           HB2      GLU  14  -0.359   1.960   0.353
  118    HB3  GLU  14           HB3      GLU  14   1.182   2.733   0.731
  119    HG2  GLU  14           HG2      GLU  14   0.906   3.517  -1.844
  120    HG3  GLU  14           HG3      GLU  14  -0.793   3.385  -1.392
  121    H    ASN  15           H        ASN  15   0.469  -0.704   0.565
  122    HA   ASN  15           HA       ASN  15   2.499  -1.016   2.512
  123    HB2  ASN  15           HB2      ASN  15   0.139  -2.160   2.051
  124    HB3  ASN  15           HB3      ASN  15   1.133  -3.396   1.284
  125   HD21  ASN  15          HD21      ASN  15   3.357  -3.587   2.934
  126   HD22  ASN  15          HD22      ASN  15   2.891  -3.996   4.512
  127    H    TRP  16           H        TRP  16   2.189  -2.608  -0.686
  128    HA   TRP  16           HA       TRP  16   4.757  -3.971  -0.491
  129    HB2  TRP  16           HB2      TRP  16   3.253  -5.039  -1.912
  130    HB3  TRP  16           HB3      TRP  16   2.585  -3.523  -2.512
  131    HD1  TRP  16           HD1      TRP  16   5.701  -5.755  -2.882
  132    HE1  TRP  16           HE1      TRP  16   6.786  -5.264  -5.167
  133    HE3  TRP  16           HE3      TRP  16   2.774  -1.866  -4.432
  134    HZ2  TRP  16           HZ2      TRP  16   6.460  -3.459  -7.359
  135    HZ3  TRP  16           HZ3      TRP  16   3.184  -0.782  -6.620
  136    HH2  TRP  16           HH2      TRP  16   5.021  -1.572  -8.085
  137    H    PHE  17           H        PHE  17   3.577  -1.011  -2.126
  138    HA   PHE  17           HA       PHE  17   5.895  -0.296  -3.576
  139    HB2  PHE  17           HB2      PHE  17   3.673   0.790  -3.709
  140    HB3  PHE  17           HB3      PHE  17   3.902   1.454  -2.093
  141    HD1  PHE  17           HD1      PHE  17   5.488   1.361  -5.485
  142    HD2  PHE  17           HD2      PHE  17   4.963   3.533  -1.814
  143    HE1  PHE  17           HE2      PHE  17   6.713   3.288  -6.449
  144    HE2  PHE  17           HE1      PHE  17   6.189   5.459  -2.780
  145    HZ   PHE  17           HZ       PHE  17   7.064   5.338  -5.098
  146    H    TRP  18           H        TRP  18   5.022   0.590  -0.211
  147    HA   TRP  18           HA       TRP  18   7.507   2.001   0.298
  148    HB2  TRP  18           HB2      TRP  18   5.212   0.928   1.941
  149    HB3  TRP  18           HB3      TRP  18   6.606   1.678   2.717
  150    HD1  TRP  18           HD1      TRP  18   3.339   2.624   1.747
  151    HE1  TRP  18           HE1      TRP  18   3.150   5.120   1.128
  152    HE3  TRP  18           HE3      TRP  18   8.281   3.754   1.121
  153    HZ2  TRP  18           HZ2      TRP  18   4.868   7.305   0.460
  154    HZ3  TRP  18           HZ3      TRP  18   8.976   6.047   0.494
  155    HH2  TRP  18           HH2      TRP  18   7.276   7.824   0.163
  156    H    ASN  19           H        ASN  19   6.393  -1.339   0.791
  157    HA   ASN  19           HA       ASN  19   8.448  -2.276   2.524
  158    HB2  ASN  19           HB2      ASN  19   6.465  -3.365   0.619
  159    HB3  ASN  19           HB3      ASN  19   7.850  -4.414   0.902
  160   HD21  ASN  19          HD21      ASN  19   5.532  -5.456   1.859
  161   HD22  ASN  19          HD22      ASN  19   5.410  -5.286   3.543
  162    H    VAL  20           H        VAL  20   8.490  -1.695  -0.975
  163    HA   VAL  20           HA       VAL  20  11.222  -2.882  -1.169
  164    HB   VAL  20           HB       VAL  20  10.819  -2.673  -3.609
  165   HG11  VAL  20          HG11      VAL  20   8.583  -3.934  -2.001
  166   HG12  VAL  20          HG12      VAL  20  10.065  -4.713  -2.557
  167   HG13  VAL  20          HG13      VAL  20   8.838  -4.219  -3.723
  168   HG21  VAL  20          HG21      VAL  20   9.390  -0.587  -3.399
  169   HG22  VAL  20          HG22      VAL  20   8.073  -1.628  -2.863
  170   HG23  VAL  20          HG23      VAL  20   8.741  -1.818  -4.481
  171    H    THR  21           H        THR  21   9.608   0.212  -1.036
  172    HA   THR  21           HA       THR  21  11.869   1.683  -2.235
  173    HB   THR  21           HB       THR  21   9.220   2.457  -0.981
  174    HG1  THR  21           HG1      THR  21   8.694   2.879  -3.122
  175   HG21  THR  21          HG21      THR  21  10.979   4.229  -0.672
  176   HG22  THR  21          HG22      THR  21   9.638   4.734  -1.698
  177   HG23  THR  21          HG23      THR  21  11.175   4.269  -2.424
  178    H    LEU  22           H        LEU  22  10.659   0.863   0.966
  179    HA   LEU  22           HA       LEU  22  12.353   2.837   2.337
  180    HB2  LEU  22           HB2      LEU  22  10.574   0.548   3.208
  181    HB3  LEU  22           HB3      LEU  22  11.458   1.553   4.354
  182    HG   LEU  22           HG       LEU  22   9.476   2.595   2.306
  183   HD11  LEU  22          HD11      LEU  22   9.258   1.944   5.246
  184   HD12  LEU  22          HD12      LEU  22   8.185   1.462   3.931
  185   HD13  LEU  22          HD13      LEU  22   8.198   3.134   4.489
  186   HD21  LEU  22          HD21      LEU  22  11.083   4.306   2.785
  187   HD22  LEU  22          HD22      LEU  22  11.104   3.902   4.502
  188   HD23  LEU  22          HD23      LEU  22   9.682   4.668   3.792
  189    H    ARG  23           H        ARG  23  12.649  -0.479   1.291
  190    HA   ARG  23           HA       ARG  23  14.599  -1.451   3.121
  191    HB2  ARG  23           HB2      ARG  23  13.265  -2.320   0.836
  192    HB3  ARG  23           HB3      ARG  23  14.959  -2.318   0.345
  193    HG2  ARG  23           HG2      ARG  23  14.724  -4.445   1.295
  194    HG3  ARG  23           HG3      ARG  23  15.365  -3.503   2.641
  195    HD2  ARG  23           HD2      ARG  23  12.908  -3.075   3.304
  196    HD3  ARG  23           HD3      ARG  23  12.507  -4.391   2.181
  197    HE   ARG  23           HE       ARG  23  14.052  -4.671   4.692
  198   HH11  ARG  23          HH11      ARG  23  11.701  -6.318   3.369
  199   HH12  ARG  23          HH12      ARG  23  12.528  -7.816   3.098
  200   HH21  ARG  23          HH21      ARG  23  15.690  -6.469   3.626
  201   HH22  ARG  23          HH22      ARG  23  14.796  -7.902   3.245
  202    HA   PRO  24           HA       PRO  24  18.003   0.342   0.386
  203    HB2  PRO  24           HB2      PRO  24  17.400   1.596  -1.965
  204    HB3  PRO  24           HB3      PRO  24  17.578  -0.163  -1.825
  205    HG2  PRO  24           HG2      PRO  24  15.155   1.447  -2.178
  206    HG3  PRO  24           HG3      PRO  24  15.441  -0.259  -2.538
  207    HD2  PRO  24           HD2      PRO  24  14.087   0.852  -0.285
  208    HD3  PRO  24           HD3      PRO  24  14.419  -0.857  -0.625
  209    H    GLU  25           H        GLU  25  15.822   1.984   1.944
  210    HA   GLU  25           HA       GLU  25  15.628   4.163   2.803
  211    HB2  GLU  25           HB2      GLU  25  18.386   3.660   2.074
  212    HB3  GLU  25           HB3      GLU  25  18.007   5.371   1.875
  213    HG2  GLU  25           HG2      GLU  25  16.988   4.065   4.348
  214    HG3  GLU  25           HG3      GLU  25  18.731   4.313   4.249
  215    H    ARG  26           H        ARG  26  16.004   6.632   1.983
  216    HA   ARG  26           HA       ARG  26  15.565   6.960  -0.918
  217    HB2  ARG  26           HB2      ARG  26  13.397   6.206   0.245
  218    HB3  ARG  26           HB3      ARG  26  13.403   7.784   1.033
  219    HG2  ARG  26           HG2      ARG  26  13.808   7.772  -1.916
  220    HG3  ARG  26           HG3      ARG  26  12.194   7.353  -1.343
  221    HD2  ARG  26           HD2      ARG  26  13.678   9.828  -0.393
  222    HD3  ARG  26           HD3      ARG  26  12.545   9.839  -1.759
  223    HE   ARG  26           HE       ARG  26  11.818   9.215   1.067
  224   HH11  ARG  26          HH11      ARG  26  10.233   7.699  -1.035
  225   HH12  ARG  26          HH12      ARG  26   8.876   8.751  -1.268
  226   HH21  ARG  26          HH21      ARG  26  10.399  11.478   0.258
  227   HH22  ARG  26          HH22      ARG  26   8.970  10.899  -0.531
  Start of MODEL   20
    1    HA   ARG   1           HA       ARG   1 -19.285  -0.554  -5.473
    2    HB2  ARG   1           HB2      ARG   1 -17.404   1.671  -6.103
    3    HB3  ARG   1           HB3      ARG   1 -16.747   0.332  -5.162
    4    HG2  ARG   1           HG2      ARG   1 -16.511  -0.802  -7.095
    5    HG3  ARG   1           HG3      ARG   1 -18.270  -0.890  -7.179
    6    HD2  ARG   1           HD2      ARG   1 -18.194   0.395  -9.044
    7    HD3  ARG   1           HD3      ARG   1 -17.538   1.721  -8.062
    8    HE   ARG   1           HE       ARG   1 -15.859  -0.349  -9.431
    9   HH11  ARG   1          HH11      ARG   1 -14.575   0.958  -7.057
   10   HH12  ARG   1          HH12      ARG   1 -13.760   2.305  -7.780
   11   HH21  ARG   1          HH21      ARG   1 -15.568   2.146 -10.743
   12   HH22  ARG   1          HH22      ARG   1 -14.325   2.981  -9.874
   13    H    SER   2           H        SER   2 -17.987  -1.290  -3.517
   14    HA   SER   2           HA       SER   2 -19.022   0.002  -1.094
   15    HB2  SER   2           HB2      SER   2 -18.347  -2.558  -1.898
   16    HB3  SER   2           HB3      SER   2 -17.019  -2.134  -0.822
   17    HG   SER   2           HG       SER   2 -18.372  -2.513   0.730
   18    H    ALA   3           H        ALA   3 -17.826   1.157   0.414
   19    HA   ALA   3           HA       ALA   3 -15.358   2.430  -0.434
   20    HB1  ALA   3           HB1      ALA   3 -17.083   3.508   0.952
   21    HB2  ALA   3           HB2      ALA   3 -15.544   3.476   1.813
   22    HB3  ALA   3           HB3      ALA   3 -16.811   2.323   2.230
   23    H    LEU   4           H        LEU   4 -16.078  -0.437   1.460
   24    HA   LEU   4           HA       LEU   4 -13.424  -0.547   2.722
   25    HB2  LEU   4           HB2      LEU   4 -16.031  -1.871   2.876
   26    HB3  LEU   4           HB3      LEU   4 -14.695  -3.012   3.002
   27    HG   LEU   4           HG       LEU   4 -15.440  -2.060   5.211
   28   HD11  LEU   4          HD11      LEU   4 -13.240  -1.887   6.060
   29   HD12  LEU   4          HD12      LEU   4 -12.629  -1.164   4.572
   30   HD13  LEU   4          HD13      LEU   4 -13.060  -2.874   4.610
   31   HD21  LEU   4          HD21      LEU   4 -15.105   0.225   5.737
   32   HD22  LEU   4          HD22      LEU   4 -15.828   0.263   4.128
   33   HD23  LEU   4          HD23      LEU   4 -14.090   0.492   4.319
   34    H    VAL   5           H        VAL   5 -14.271  -1.018  -0.415
   35    HA   VAL   5           HA       VAL   5 -12.659  -3.502  -0.800
   36    HB   VAL   5           HB       VAL   5 -14.464  -1.864  -2.618
   37   HG11  VAL   5          HG11      VAL   5 -14.248  -3.975  -4.075
   38   HG12  VAL   5          HG12      VAL   5 -12.829  -4.361  -3.102
   39   HG13  VAL   5          HG13      VAL   5 -12.866  -2.878  -4.058
   40   HG21  VAL   5          HG21      VAL   5 -14.887  -4.686  -1.624
   41   HG22  VAL   5          HG22      VAL   5 -16.077  -3.576  -2.306
   42   HG23  VAL   5          HG23      VAL   5 -15.432  -3.294  -0.689
   43    H    ASN   6           H        ASN   6 -12.918  -0.164  -2.115
   44    HA   ASN   6           HA       ASN   6 -10.382  -0.321  -3.535
   45    HB2  ASN   6           HB2      ASN   6 -12.369   1.119  -4.109
   46    HB3  ASN   6           HB3      ASN   6 -12.010   2.097  -2.685
   47   HD21  ASN   6          HD21      ASN   6 -10.720   1.121  -5.871
   48   HD22  ASN   6          HD22      ASN   6  -9.601   2.392  -5.986
   49    H    SER   7           H        SER   7 -11.414   1.127  -0.415
   50    HA   SER   7           HA       SER   7  -9.030   2.492   0.271
   51    HB2  SER   7           HB2      SER   7 -11.179   1.047   1.822
   52    HB3  SER   7           HB3      SER   7  -9.840   1.825   2.660
   53    HG   SER   7           HG       SER   7 -11.956   3.019   2.007
   54    H    TYR   8           H        TYR   8  -9.931  -0.892   1.082
   55    HA   TYR   8           HA       TYR   8  -7.412  -1.622   2.245
   56    HB2  TYR   8           HB2      TYR   8  -9.295  -3.008   2.671
   57    HB3  TYR   8           HB3      TYR   8  -9.730  -3.086   0.963
   58    HD1  TYR   8           HD1      TYR   8  -6.943  -4.001   3.304
   59    HD2  TYR   8           HD2      TYR   8  -9.066  -4.935  -0.312
   60    HE1  TYR   8           HE2      TYR   8  -5.592  -6.062   3.044
   61    HE2  TYR   8           HE1      TYR   8  -7.711  -6.997  -0.573
   62    HH   TYR   8           HH       TYR   8  -6.274  -8.527   1.499
   63    H    LEU   9           H        LEU   9  -8.683  -1.892  -1.088
   64    HA   LEU   9           HA       LEU   9  -6.492  -3.267  -2.281
   65    HB2  LEU   9           HB2      LEU   9  -8.746  -1.508  -3.101
   66    HB3  LEU   9           HB3      LEU   9  -7.432  -1.652  -4.266
   67    HG   LEU   9           HG       LEU   9  -8.844  -4.008  -2.980
   68   HD11  LEU   9          HD11      LEU   9 -10.330  -2.718  -4.493
   69   HD12  LEU   9          HD12      LEU   9  -9.934  -4.300  -5.162
   70   HD13  LEU   9          HD13      LEU   9  -9.127  -2.856  -5.775
   71   HD21  LEU   9          HD21      LEU   9  -7.695  -5.106  -5.062
   72   HD22  LEU   9          HD22      LEU   9  -6.718  -4.767  -3.633
   73   HD23  LEU   9          HD23      LEU   9  -6.652  -3.684  -5.024
   74    H    TRP  10           H        TRP  10  -7.072   0.234  -1.863
   75    HA   TRP  10           HA       TRP  10  -4.664   1.143  -3.140
   76    HB2  TRP  10           HB2      TRP  10  -6.318   2.763  -2.864
   77    HB3  TRP  10           HB3      TRP  10  -6.749   2.194  -1.254
   78    HD1  TRP  10           HD1      TRP  10  -3.610   3.784  -2.898
   79    HE1  TRP  10           HE1      TRP  10  -2.640   5.508  -1.245
   80    HE3  TRP  10           HE3      TRP  10  -6.889   3.229   0.975
   81    HZ2  TRP  10           HZ2      TRP  10  -3.188   6.520   1.376
   82    HZ3  TRP  10           HZ3      TRP  10  -6.645   4.585   3.035
   83    HH2  TRP  10           HH2      TRP  10  -4.800   6.228   3.240
   84    H    GLN  11           H        GLN  11  -5.439   0.398   0.280
   85    HA   GLN  11           HA       GLN  11  -2.936   1.174   1.425
   86    HB2  GLN  11           HB2      GLN  11  -5.014  -0.910   2.165
   87    HB3  GLN  11           HB3      GLN  11  -3.679  -0.459   3.226
   88    HG2  GLN  11           HG2      GLN  11  -5.473   1.668   2.076
   89    HG3  GLN  11           HG3      GLN  11  -5.981   0.760   3.500
   90   HE21  GLN  11          HE21      GLN  11  -3.479   2.992   2.279
   91   HE22  GLN  11          HE22      GLN  11  -2.911   3.452   3.811
   92    H    ARG  12           H        ARG  12  -4.000  -1.923  -0.009
   93    HA   ARG  12           HA       ARG  12  -1.661  -3.451   0.655
   94    HB2  ARG  12           HB2      ARG  12  -4.085  -3.978  -0.383
   95    HB3  ARG  12           HB3      ARG  12  -3.161  -3.934  -1.885
   96    HG2  ARG  12           HG2      ARG  12  -2.078  -5.499   0.435
   97    HG3  ARG  12           HG3      ARG  12  -3.385  -6.193  -0.524
   98    HD2  ARG  12           HD2      ARG  12  -1.096  -5.013  -2.039
   99    HD3  ARG  12           HD3      ARG  12  -0.808  -6.551  -1.204
  100    HE   ARG  12           HE       ARG  12  -2.408  -7.592  -2.631
  101   HH11  ARG  12          HH11      ARG  12  -1.329  -5.371  -4.525
  102   HH12  ARG  12          HH12      ARG  12  -2.816  -4.815  -5.218
  103   HH21  ARG  12          HH21      ARG  12  -4.811  -6.354  -2.825
  104   HH22  ARG  12          HH22      ARG  12  -4.792  -5.371  -4.251
  105    H    TRP  13           H        TRP  13  -2.439  -1.351  -2.128
  106    HA   TRP  13           HA       TRP  13  -0.123  -2.018  -3.705
  107    HB2  TRP  13           HB2      TRP  13  -1.344  -0.754  -5.129
  108    HB3  TRP  13           HB3      TRP  13  -2.432  -0.342  -3.812
  109    HD1  TRP  13           HD1      TRP  13  -2.611   2.129  -3.316
  110    HE1  TRP  13           HE1      TRP  13  -1.164   4.219  -3.734
  111    HE3  TRP  13           HE3      TRP  13   1.499  -0.048  -5.422
  112    HZ2  TRP  13           HZ2      TRP  13   1.398   4.882  -4.818
  113    HZ3  TRP  13           HZ3      TRP  13   3.427   1.336  -6.139
  114    HH2  TRP  13           HH2      TRP  13   3.380   3.795  -5.840
  115    H    GLU  14           H        GLU  14  -0.739   0.635  -1.371
  116    HA   GLU  14           HA       GLU  14   1.900   1.797  -1.586
  117    HB2  GLU  14           HB2      GLU  14  -0.423   1.919   0.331
  118    HB3  GLU  14           HB3      GLU  14   1.090   2.738   0.724
  119    HG2  GLU  14           HG2      GLU  14   0.741   3.504  -1.879
  120    HG3  GLU  14           HG3      GLU  14  -0.930   3.403  -1.326
  121    H    ASN  15           H        ASN  15   0.473  -0.710   0.493
  122    HA   ASN  15           HA       ASN  15   2.526  -0.987   2.431
  123    HB2  ASN  15           HB2      ASN  15   0.482  -2.181   2.705
  124    HB3  ASN  15           HB3      ASN  15   0.584  -2.885   1.092
  125   HD21  ASN  15          HD21      ASN  15   3.151  -2.737   3.625
  126   HD22  ASN  15          HD22      ASN  15   3.332  -4.421   3.742
  127    H    TRP  16           H        TRP  16   2.155  -2.739  -0.687
  128    HA   TRP  16           HA       TRP  16   4.725  -4.039  -0.579
  129    HB2  TRP  16           HB2      TRP  16   3.157  -4.993  -2.043
  130    HB3  TRP  16           HB3      TRP  16   2.630  -3.425  -2.654
  131    HD1  TRP  16           HD1      TRP  16   5.500  -5.948  -2.962
  132    HE1  TRP  16           HE1      TRP  16   6.783  -5.474  -5.145
  133    HE3  TRP  16           HE3      TRP  16   3.169  -1.647  -4.441
  134    HZ2  TRP  16           HZ2      TRP  16   6.821  -3.532  -7.240
  135    HZ3  TRP  16           HZ3      TRP  16   3.852  -0.509  -6.534
  136    HH2  TRP  16           HH2      TRP  16   5.672  -1.444  -7.934
  137    H    PHE  17           H        PHE  17   3.587  -1.013  -2.104
  138    HA   PHE  17           HA       PHE  17   5.924  -0.255  -3.497
  139    HB2  PHE  17           HB2      PHE  17   3.824   0.917  -3.731
  140    HB3  PHE  17           HB3      PHE  17   3.793   1.318  -2.016
  141    HD1  PHE  17           HD1      PHE  17   5.982   1.749  -5.037
  142    HD2  PHE  17           HD2      PHE  17   4.566   3.409  -1.337
  143    HE1  PHE  17           HE1      PHE  17   7.236   3.838  -5.493
  144    HE2  PHE  17           HE2      PHE  17   5.820   5.497  -1.795
  145    HZ   PHE  17           HZ       PHE  17   7.155   5.713  -3.872
  146    H    TRP  18           H        TRP  18   4.982   0.796  -0.189
  147    HA   TRP  18           HA       TRP  18   7.516   1.997   0.437
  148    HB2  TRP  18           HB2      TRP  18   5.186   0.931   2.046
  149    HB3  TRP  18           HB3      TRP  18   6.571   1.702   2.817
  150    HD1  TRP  18           HD1      TRP  18   3.304   2.628   1.921
  151    HE1  TRP  18           HE1      TRP  18   3.087   5.106   1.243
  152    HE3  TRP  18           HE3      TRP  18   8.217   3.748   1.080
  153    HZ2  TRP  18           HZ2      TRP  18   4.773   7.274   0.451
  154    HZ3  TRP  18           HZ3      TRP  18   8.881   6.025   0.365
  155    HH2  TRP  18           HH2      TRP  18   7.166   7.788   0.050
  156    H    ASN  19           H        ASN  19   6.277  -1.314   0.789
  157    HA   ASN  19           HA       ASN  19   8.215  -2.421   2.534
  158    HB2  ASN  19           HB2      ASN  19   6.113  -3.460   1.590
  159    HB3  ASN  19           HB3      ASN  19   6.982  -3.705   0.076
  160   HD21  ASN  19          HD21      ASN  19   8.866  -5.208   0.128
  161   HD22  ASN  19          HD22      ASN  19   8.980  -6.377   1.353
  162    H    VAL  20           H        VAL  20   8.430  -1.736  -0.961
  163    HA   VAL  20           HA       VAL  20  11.232  -2.789  -0.982
  164    HB   VAL  20           HB       VAL  20  10.920  -2.693  -3.460
  165   HG11  VAL  20          HG11      VAL  20   9.439  -4.575  -3.596
  166   HG12  VAL  20          HG12      VAL  20   8.594  -4.096  -2.124
  167   HG13  VAL  20          HG13      VAL  20  10.253  -4.687  -2.036
  168   HG21  VAL  20          HG21      VAL  20   9.006  -1.870  -4.474
  169   HG22  VAL  20          HG22      VAL  20   9.093  -0.790  -3.084
  170   HG23  VAL  20          HG23      VAL  20   7.998  -2.172  -3.061
  171    H    THR  21           H        THR  21   9.534   0.173  -0.762
  172    HA   THR  21           HA       THR  21  11.626   1.765  -2.133
  173    HB   THR  21           HB       THR  21   9.027   2.463  -0.726
  174    HG1  THR  21           HG1      THR  21   8.487   1.529  -2.584
  175   HG21  THR  21          HG21      THR  21  10.621   4.346  -0.662
  176   HG22  THR  21          HG22      THR  21   9.285   4.683  -1.764
  177   HG23  THR  21          HG23      THR  21  10.857   4.204  -2.404
  178    H    LEU  22           H        LEU  22  10.454   1.052   1.127
  179    HA   LEU  22           HA       LEU  22  12.195   3.040   2.408
  180    HB2  LEU  22           HB2      LEU  22  10.480   0.761   3.438
  181    HB3  LEU  22           HB3      LEU  22  11.291   1.930   4.477
  182    HG   LEU  22           HG       LEU  22   9.300   2.670   2.313
  183   HD11  LEU  22          HD11      LEU  22   8.166   1.430   4.078
  184   HD12  LEU  22          HD12      LEU  22   7.780   3.142   4.242
  185   HD13  LEU  22          HD13      LEU  22   8.966   2.400   5.315
  186   HD21  LEU  22          HD21      LEU  22   9.329   4.788   3.908
  187   HD22  LEU  22          HD22      LEU  22  10.561   4.596   2.661
  188   HD23  LEU  22          HD23      LEU  22  10.927   4.178   4.335
  189    H    ARG  23           H        ARG  23  12.479  -0.275   1.406
  190    HA   ARG  23           HA       ARG  23  14.440  -1.213   3.266
  191    HB2  ARG  23           HB2      ARG  23  12.984  -2.244   1.201
  192    HB3  ARG  23           HB3      ARG  23  14.581  -2.156   0.459
  193    HG2  ARG  23           HG2      ARG  23  14.386  -3.262   3.230
  194    HG3  ARG  23           HG3      ARG  23  13.844  -4.277   1.893
  195    HD2  ARG  23           HD2      ARG  23  15.973  -4.451   0.979
  196    HD3  ARG  23           HD3      ARG  23  16.491  -2.884   1.630
  197    HE   ARG  23           HE       ARG  23  16.954  -3.936   3.722
  198   HH11  ARG  23          HH11      ARG  23  17.923  -6.256   2.164
  199   HH12  ARG  23          HH12      ARG  23  17.013  -7.573   2.821
  200   HH21  ARG  23          HH21      ARG  23  14.629  -5.526   4.309
  201   HH22  ARG  23          HH22      ARG  23  15.140  -7.159   4.042
  202    HA   PRO  24           HA       PRO  24  17.790   0.270   0.225
  203    HB2  PRO  24           HB2      PRO  24  17.088   1.753  -1.960
  204    HB3  PRO  24           HB3      PRO  24  17.125  -0.020  -1.972
  205    HG2  PRO  24           HG2      PRO  24  14.813   1.822  -1.808
  206    HG3  PRO  24           HG3      PRO  24  14.939   0.228  -2.563
  207    HD2  PRO  24           HD2      PRO  24  13.759   0.757  -0.111
  208    HD3  PRO  24           HD3      PRO  24  14.302  -0.836  -0.671
  209    H    GLU  25           H        GLU  25  16.800   1.684   2.411
  210    HA   GLU  25           HA       GLU  25  17.885   4.361   1.974
  211    HB2  GLU  25           HB2      GLU  25  15.124   3.868   1.505
  212    HB3  GLU  25           HB3      GLU  25  15.222   4.746   3.031
  213    HG2  GLU  25           HG2      GLU  25  16.737   5.638   0.569
  214    HG3  GLU  25           HG3      GLU  25  15.090   6.175   0.903
  215    H    ARG  26           H        ARG  26  17.994   5.565   4.049
  216    HA   ARG  26           HA       ARG  26  17.317   4.030   6.507
  217    HB2  ARG  26           HB2      ARG  26  19.808   3.877   5.278
  218    HB3  ARG  26           HB3      ARG  26  20.050   5.097   6.526
  219    HG2  ARG  26           HG2      ARG  26  18.648   2.507   7.166
  220    HG3  ARG  26           HG3      ARG  26  20.409   2.600   7.164
  221    HD2  ARG  26           HD2      ARG  26  20.461   4.117   8.964
  222    HD3  ARG  26           HD3      ARG  26  18.784   4.633   8.696
  223    HE   ARG  26           HE       ARG  26  19.518   1.904   9.703
  224   HH11  ARG  26          HH11      ARG  26  18.652   3.830  11.765
  225   HH12  ARG  26          HH12      ARG  26  16.942   3.570  11.851
  226   HH21  ARG  26          HH21      ARG  26  16.780   1.905   8.803
  227   HH22  ARG  26          HH22      ARG  26  15.877   2.475  10.166
  Start of MODEL   21
    1    HA   ARG   1           HA       ARG   1 -13.720   7.670  -2.572
    2    HB2  ARG   1           HB2      ARG   1 -12.251   9.622  -1.199
    3    HB3  ARG   1           HB3      ARG   1 -12.041   8.163  -0.231
    4    HG2  ARG   1           HG2      ARG   1 -11.554   6.984  -2.489
    5    HG3  ARG   1           HG3      ARG   1 -11.330   8.612  -3.128
    6    HD2  ARG   1           HD2      ARG   1  -9.844   8.711  -0.801
    7    HD3  ARG   1           HD3      ARG   1  -9.566   7.048  -1.358
    8    HE   ARG   1           HE       ARG   1  -8.789   9.502  -2.802
    9   HH11  ARG   1          HH11      ARG   1  -6.962   7.178  -2.531
   10   HH12  ARG   1          HH12      ARG   1  -7.073   6.421  -4.084
   11   HH21  ARG   1          HH21      ARG   1 -10.001   8.077  -4.967
   12   HH22  ARG   1          HH22      ARG   1  -8.802   6.934  -5.471
   13    H    SER   2           H        SER   2 -14.231   5.604  -1.908
   14    HA   SER   2           HA       SER   2 -15.758   5.176   0.541
   15    HB2  SER   2           HB2      SER   2 -15.958   3.996  -1.729
   16    HB3  SER   2           HB3      SER   2 -14.505   3.106  -1.282
   17    HG   SER   2           HG       SER   2 -17.084   2.831  -0.410
   18    H    ALA   3           H        ALA   3 -15.072   3.996   2.394
   19    HA   ALA   3           HA       ALA   3 -12.101   3.821   2.732
   20    HB1  ALA   3           HB1      ALA   3 -14.407   4.155   4.674
   21    HB2  ALA   3           HB2      ALA   3 -13.244   5.392   4.195
   22    HB3  ALA   3           HB3      ALA   3 -12.718   4.015   5.162
   23    H    LEU   4           H        LEU   4 -14.798   1.809   2.256
   24    HA   LEU   4           HA       LEU   4 -13.480  -0.437   3.745
   25    HB2  LEU   4           HB2      LEU   4 -16.276   0.483   3.373
   26    HB3  LEU   4           HB3      LEU   4 -16.036  -1.263   3.318
   27    HG   LEU   4           HG       LEU   4 -14.923   0.479   5.530
   28   HD11  LEU   4          HD11      LEU   4 -17.418   0.588   5.448
   29   HD12  LEU   4          HD12      LEU   4 -16.820  -0.232   6.890
   30   HD13  LEU   4          HD13      LEU   4 -17.468  -1.172   5.546
   31   HD21  LEU   4          HD21      LEU   4 -13.763  -1.575   5.502
   32   HD22  LEU   4          HD22      LEU   4 -15.196  -2.482   5.021
   33   HD23  LEU   4          HD23      LEU   4 -15.057  -1.863   6.665
   34    H    VAL   5           H        VAL   5 -14.049   0.747   0.628
   35    HA   VAL   5           HA       VAL   5 -14.018  -2.015  -0.548
   36    HB   VAL   5           HB       VAL   5 -14.928   0.653  -1.690
   37   HG11  VAL   5          HG11      VAL   5 -15.880  -0.786  -3.507
   38   HG12  VAL   5          HG12      VAL   5 -15.038  -2.167  -2.805
   39   HG13  VAL   5          HG13      VAL   5 -14.117  -0.812  -3.459
   40   HG21  VAL   5          HG21      VAL   5 -16.518  -0.035  -0.045
   41   HG22  VAL   5          HG22      VAL   5 -16.404  -1.725  -0.536
   42   HG23  VAL   5          HG23      VAL   5 -17.190  -0.551  -1.592
   43    H    ASN   6           H        ASN   6 -12.839   1.315  -1.215
   44    HA   ASN   6           HA       ASN   6 -10.664   0.277  -2.908
   45    HB2  ASN   6           HB2      ASN   6 -11.687   2.978  -2.034
   46    HB3  ASN   6           HB3      ASN   6 -10.184   2.825  -2.943
   47   HD21  ASN   6          HD21      ASN   6 -10.575   1.084  -4.928
   48   HD22  ASN   6          HD22      ASN   6 -11.953   1.433  -5.855
   49    H    SER   7           H        SER   7 -11.052   0.994   0.455
   50    HA   SER   7           HA       SER   7  -8.419   1.931   1.106
   51    HB2  SER   7           HB2      SER   7 -10.780   0.752   2.452
   52    HB3  SER   7           HB3      SER   7  -9.255   0.525   3.302
   53    HG   SER   7           HG       SER   7 -10.432   2.525   3.757
   54    H    TYR   8           H        TYR   8  -9.772  -1.389   1.417
   55    HA   TYR   8           HA       TYR   8  -7.203  -2.631   1.893
   56    HB2  TYR   8           HB2      TYR   8  -9.363  -3.545   2.631
   57    HB3  TYR   8           HB3      TYR   8  -9.880  -3.717   0.955
   58    HD1  TYR   8           HD1      TYR   8  -6.913  -4.635   3.071
   59    HD2  TYR   8           HD2      TYR   8  -9.695  -5.837   0.027
   60    HE1  TYR   8           HE2      TYR   8  -5.833  -6.863   2.966
   61    HE2  TYR   8           HE1      TYR   8  -8.614  -8.065  -0.080
   62    HH   TYR   8           HH       TYR   8  -6.874  -9.369   2.110
   63    H    LEU   9           H        LEU   9  -8.727  -1.537  -1.015
   64    HA   LEU   9           HA       LEU   9  -7.226  -3.431  -2.739
   65    HB2  LEU   9           HB2      LEU   9  -9.587  -1.683  -2.885
   66    HB3  LEU   9           HB3      LEU   9  -8.600  -1.643  -4.344
   67    HG   LEU   9           HG       LEU   9 -10.401  -3.425  -4.327
   68   HD11  LEU   9          HD11      LEU   9  -8.796  -5.252  -5.081
   69   HD12  LEU   9          HD12      LEU   9  -7.483  -4.185  -4.584
   70   HD13  LEU   9          HD13      LEU   9  -8.585  -3.688  -5.867
   71   HD21  LEU   9          HD21      LEU   9  -8.609  -5.007  -2.508
   72   HD22  LEU   9          HD22      LEU   9 -10.322  -5.234  -2.860
   73   HD23  LEU   9          HD23      LEU   9  -9.807  -3.921  -1.805
   74    H    TRP  10           H        TRP  10  -7.173  -0.025  -1.752
   75    HA   TRP  10           HA       TRP  10  -5.048   0.568  -3.760
   76    HB2  TRP  10           HB2      TRP  10  -6.971   2.089  -3.550
   77    HB3  TRP  10           HB3      TRP  10  -6.637   2.298  -1.832
   78    HD1  TRP  10           HD1      TRP  10  -4.270   2.439  -4.896
   79    HE1  TRP  10           HE1      TRP  10  -2.948   4.648  -4.784
   80    HE3  TRP  10           HE3      TRP  10  -6.381   4.520  -0.736
   81    HZ2  TRP  10           HZ2      TRP  10  -2.809   6.991  -3.151
   82    HZ3  TRP  10           HZ3      TRP  10  -5.636   6.741   0.073
   83    HH2  TRP  10           HH2      TRP  10  -3.854   7.978  -1.129
   84    H    GLN  11           H        GLN  11  -5.598   0.875  -0.210
   85    HA   GLN  11           HA       GLN  11  -3.034   1.809   0.526
   86    HB2  GLN  11           HB2      GLN  11  -5.393   0.851   1.752
   87    HB3  GLN  11           HB3      GLN  11  -4.080  -0.106   2.433
   88    HG2  GLN  11           HG2      GLN  11  -3.756   1.658   3.819
   89    HG3  GLN  11           HG3      GLN  11  -3.018   2.444   2.424
   90   HE21  GLN  11          HE21      GLN  11  -6.205   2.030   4.053
   91   HE22  GLN  11          HE22      GLN  11  -6.835   3.515   3.522
   92    H    ARG  12           H        ARG  12  -4.072  -1.500  -0.245
   93    HA   ARG  12           HA       ARG  12  -1.802  -2.929   0.744
   94    HB2  ARG  12           HB2      ARG  12  -3.963  -3.302  -1.288
   95    HB3  ARG  12           HB3      ARG  12  -2.583  -4.396  -1.378
   96    HG2  ARG  12           HG2      ARG  12  -3.117  -4.367   1.326
   97    HG3  ARG  12           HG3      ARG  12  -4.733  -4.256   0.628
   98    HD2  ARG  12           HD2      ARG  12  -2.846  -6.259  -0.561
   99    HD3  ARG  12           HD3      ARG  12  -3.580  -6.635   1.009
  100    HE   ARG  12           HE       ARG  12  -5.783  -5.861  -0.296
  101   HH11  ARG  12          HH11      ARG  12  -4.414  -5.998  -2.948
  102   HH12  ARG  12          HH12      ARG  12  -4.751  -7.619  -3.458
  103   HH21  ARG  12          HH21      ARG  12  -5.665  -8.703  -0.282
  104   HH22  ARG  12          HH22      ARG  12  -5.467  -9.155  -1.942
  105    H    TRP  13           H        TRP  13  -2.371  -1.256  -2.355
  106    HA   TRP  13           HA       TRP  13  -0.037  -2.120  -3.746
  107    HB2  TRP  13           HB2      TRP  13  -1.125  -0.877  -5.298
  108    HB3  TRP  13           HB3      TRP  13  -2.226  -0.316  -4.051
  109    HD1  TRP  13           HD1      TRP  13  -2.255   2.181  -3.678
  110    HE1  TRP  13           HE1      TRP  13  -0.679   4.153  -4.187
  111    HE3  TRP  13           HE3      TRP  13   1.747  -0.355  -5.580
  112    HZ2  TRP  13           HZ2      TRP  13   1.936   4.599  -5.255
  113    HZ3  TRP  13           HZ3      TRP  13   3.768   0.869  -6.333
  114    HH2  TRP  13           HH2      TRP  13   3.866   3.339  -6.172
  115    H    GLU  14           H        GLU  14  -0.543   0.710  -1.608
  116    HA   GLU  14           HA       GLU  14   2.165   1.702  -1.832
  117    HB2  GLU  14           HB2      GLU  14  -0.192   2.091   0.002
  118    HB3  GLU  14           HB3      GLU  14   1.358   2.835   0.396
  119    HG2  GLU  14           HG2      GLU  14   1.343   3.721  -2.028
  120    HG3  GLU  14           HG3      GLU  14  -0.366   3.286  -2.038
  121    H    ASN  15           H        ASN  15   0.536  -0.555   0.386
  122    HA   ASN  15           HA       ASN  15   2.493  -0.825   2.403
  123    HB2  ASN  15           HB2      ASN  15   0.115  -1.916   1.938
  124    HB3  ASN  15           HB3      ASN  15   1.085  -3.224   1.262
  125   HD21  ASN  15          HD21      ASN  15   3.161  -3.647   2.886
  126   HD22  ASN  15          HD22      ASN  15   2.700  -3.851   4.506
  127    H    TRP  16           H        TRP  16   2.230  -2.628  -0.690
  128    HA   TRP  16           HA       TRP  16   4.737  -4.047  -0.365
  129    HB2  TRP  16           HB2      TRP  16   3.210  -5.037  -1.851
  130    HB3  TRP  16           HB3      TRP  16   2.755  -3.491  -2.565
  131    HD1  TRP  16           HD1      TRP  16   5.635  -6.038  -2.558
  132    HE1  TRP  16           HE1      TRP  16   7.000  -5.738  -4.722
  133    HE3  TRP  16           HE3      TRP  16   3.326  -1.912  -4.494
  134    HZ2  TRP  16           HZ2      TRP  16   7.102  -3.982  -6.974
  135    HZ3  TRP  16           HZ3      TRP  16   4.079  -0.950  -6.649
  136    HH2  TRP  16           HH2      TRP  16   5.963  -1.978  -7.892
  137    H    PHE  17           H        PHE  17   3.765  -1.094  -2.132
  138    HA   PHE  17           HA       PHE  17   6.214  -0.486  -3.417
  139    HB2  PHE  17           HB2      PHE  17   4.002   0.605  -3.763
  140    HB3  PHE  17           HB3      PHE  17   4.152   1.375  -2.184
  141    HD1  PHE  17           HD1      PHE  17   6.016   0.985  -5.416
  142    HD2  PHE  17           HD2      PHE  17   5.156   3.480  -2.027
  143    HE1  PHE  17           HE2      PHE  17   7.331   2.824  -6.436
  144    HE2  PHE  17           HE1      PHE  17   6.470   5.319  -3.047
  145    HZ   PHE  17           HZ       PHE  17   7.558   4.991  -5.251
  146    H    TRP  18           H        TRP  18   5.040   0.715  -0.236
  147    HA   TRP  18           HA       TRP  18   7.473   2.065   0.476
  148    HB2  TRP  18           HB2      TRP  18   5.218   0.865   2.118
  149    HB3  TRP  18           HB3      TRP  18   6.444   1.949   2.773
  150    HD1  TRP  18           HD1      TRP  18   3.108   2.305   2.066
  151    HE1  TRP  18           HE1      TRP  18   2.458   4.561   0.999
  152    HE3  TRP  18           HE3      TRP  18   7.690   3.863   0.427
  153    HZ2  TRP  18           HZ2      TRP  18   3.713   6.734  -0.365
  154    HZ3  TRP  18           HZ3      TRP  18   7.932   6.028  -0.751
  155    HH2  TRP  18           HH2      TRP  18   5.952   7.465  -1.148
  156    H    ASN  19           H        ASN  19   6.339  -1.269   1.008
  157    HA   ASN  19           HA       ASN  19   8.312  -2.156   2.848
  158    HB2  ASN  19           HB2      ASN  19   6.458  -3.318   0.842
  159    HB3  ASN  19           HB3      ASN  19   7.790  -4.359   1.340
  160   HD21  ASN  19          HD21      ASN  19   6.892  -5.763   2.882
  161   HD22  ASN  19          HD22      ASN  19   5.970  -5.261   4.216
  162    H    VAL  20           H        VAL  20   8.501  -1.823  -0.701
  163    HA   VAL  20           HA       VAL  20  11.283  -2.920  -0.633
  164    HB   VAL  20           HB       VAL  20  10.991  -3.105  -3.073
  165   HG11  VAL  20          HG11      VAL  20   9.394  -4.862  -3.065
  166   HG12  VAL  20          HG12      VAL  20   8.457  -4.112  -1.773
  167   HG13  VAL  20          HG13      VAL  20  10.034  -4.823  -1.422
  168   HG21  VAL  20          HG21      VAL  20   8.854  -2.496  -4.127
  169   HG22  VAL  20          HG22      VAL  20   9.597  -1.077  -3.391
  170   HG23  VAL  20          HG23      VAL  20   8.253  -1.885  -2.587
  171    H    THR  21           H        THR  21   9.481   0.056  -1.254
  172    HA   THR  21           HA       THR  21  11.708   1.459  -2.509
  173    HB   THR  21           HB       THR  21   9.094   2.366  -1.264
  174    HG1  THR  21           HG1      THR  21   8.377   1.548  -3.048
  175   HG21  THR  21          HG21      THR  21   9.636   4.331  -2.966
  176   HG22  THR  21          HG22      THR  21  11.299   3.840  -2.650
  177   HG23  THR  21          HG23      THR  21  10.266   4.362  -1.320
  178    H    LEU  22           H        LEU  22  10.302   1.402   0.770
  179    HA   LEU  22           HA       LEU  22  12.034   3.425   1.875
  180    HB2  LEU  22           HB2      LEU  22  10.475   1.129   3.100
  181    HB3  LEU  22           HB3      LEU  22  11.249   2.399   4.047
  182    HG   LEU  22           HG       LEU  22   9.128   2.854   1.921
  183   HD11  LEU  22          HD11      LEU  22   7.728   3.509   3.891
  184   HD12  LEU  22          HD12      LEU  22   9.012   2.930   4.952
  185   HD13  LEU  22          HD13      LEU  22   8.166   1.800   3.895
  186   HD21  LEU  22          HD21      LEU  22  10.670   4.690   3.769
  187   HD22  LEU  22          HD22      LEU  22   9.132   5.165   3.049
  188   HD23  LEU  22          HD23      LEU  22  10.511   4.796   2.015
  189    H    ARG  23           H        ARG  23  12.316  -0.089   1.566
  190    HA   ARG  23           HA       ARG  23  15.162   0.123   2.477
  191    HB2  ARG  23           HB2      ARG  23  13.335  -0.870   4.077
  192    HB3  ARG  23           HB3      ARG  23  13.425  -2.278   3.019
  193    HG2  ARG  23           HG2      ARG  23  15.680  -2.688   3.544
  194    HG3  ARG  23           HG3      ARG  23  15.933  -1.048   4.143
  195    HD2  ARG  23           HD2      ARG  23  13.932  -1.944   5.813
  196    HD3  ARG  23           HD3      ARG  23  14.899  -3.412   5.566
  197    HE   ARG  23           HE       ARG  23  16.918  -1.906   6.120
  198   HH11  ARG  23          HH11      ARG  23  15.037  -2.736   8.447
  199   HH12  ARG  23          HH12      ARG  23  14.954  -1.245   9.323
  200   HH21  ARG  23          HH21      ARG  23  16.251   0.659   6.720
  201   HH22  ARG  23          HH22      ARG  23  15.643   0.684   8.341
  202    HA   PRO  24           HA       PRO  24  14.990  -1.823  -1.688
  203    HB2  PRO  24           HB2      PRO  24  17.342  -0.724  -2.557
  204    HB3  PRO  24           HB3      PRO  24  15.783   0.119  -2.661
  205    HG2  PRO  24           HG2      PRO  24  17.977   0.437  -0.675
  206    HG3  PRO  24           HG3      PRO  24  16.944   1.666  -1.422
  207    HD2  PRO  24           HD2      PRO  24  16.562   0.725   1.105
  208    HD3  PRO  24           HD3      PRO  24  15.249   1.344   0.082
  209    H    GLU  25           H        GLU  25  16.259  -3.591  -2.458
  210    HA   GLU  25           HA       GLU  25  18.667  -4.383  -0.893
  211    HB2  GLU  25           HB2      GLU  25  17.647  -6.632  -0.524
  212    HB3  GLU  25           HB3      GLU  25  16.736  -5.348   0.268
  213    HG2  GLU  25           HG2      GLU  25  14.902  -6.074  -0.823
  214    HG3  GLU  25           HG3      GLU  25  15.651  -5.537  -2.327
  215    H    ARG  26           H        ARG  26  19.972  -5.987  -2.018
  216    HA   ARG  26           HA       ARG  26  19.169  -6.890  -4.704
  217    HB2  ARG  26           HB2      ARG  26  20.535  -4.405  -4.250
  218    HB3  ARG  26           HB3      ARG  26  21.636  -5.507  -5.077
  219    HG2  ARG  26           HG2      ARG  26  19.791  -5.989  -6.726
  220    HG3  ARG  26           HG3      ARG  26  18.853  -4.704  -5.965
  221    HD2  ARG  26           HD2      ARG  26  20.222  -3.025  -6.795
  222    HD3  ARG  26           HD3      ARG  26  21.655  -4.072  -6.832
  223    HE   ARG  26           HE       ARG  26  19.397  -4.257  -8.792
  224   HH11  ARG  26          HH11      ARG  26  20.919  -6.767  -8.634
  225   HH12  ARG  26          HH12      ARG  26  22.192  -6.534  -9.786
  226   HH21  ARG  26          HH21      ARG  26  21.791  -3.083  -9.919
  227   HH22  ARG  26          HH22      ARG  26  22.688  -4.439 -10.514
  Start of MODEL   22
    1    HA   ARG   1           HA       ARG   1 -21.085   0.340  -3.032
    2    HB2  ARG   1           HB2      ARG   1 -23.070  -0.821  -4.162
    3    HB3  ARG   1           HB3      ARG   1 -22.587  -2.281  -3.298
    4    HG2  ARG   1           HG2      ARG   1 -22.821  -1.117  -1.151
    5    HG3  ARG   1           HG3      ARG   1 -23.240   0.378  -1.988
    6    HD2  ARG   1           HD2      ARG   1 -25.405  -0.268  -2.169
    7    HD3  ARG   1           HD3      ARG   1 -24.929  -1.817  -2.895
    8    HE   ARG   1           HE       ARG   1 -24.761  -1.385   0.066
    9   HH11  ARG   1          HH11      ARG   1 -27.430  -2.316  -0.661
   10   HH12  ARG   1          HH12      ARG   1 -27.273  -4.040  -0.681
   11   HH21  ARG   1          HH21      ARG   1 -23.800  -3.984  -0.849
   12   HH22  ARG   1          HH22      ARG   1 -25.209  -4.989  -0.787
   13    H    SER   2           H        SER   2 -18.859  -0.115  -2.222
   14    HA   SER   2           HA       SER   2 -18.866  -2.360  -0.271
   15    HB2  SER   2           HB2      SER   2 -17.313  -2.171  -2.763
   16    HB3  SER   2           HB3      SER   2 -16.319  -2.487  -1.344
   17    HG   SER   2           HG       SER   2 -17.347  -4.351  -1.021
   18    H    ALA   3           H        ALA   3 -17.483  -1.946   1.524
   19    HA   ALA   3           HA       ALA   3 -16.365   0.837   1.637
   20    HB1  ALA   3           HB1      ALA   3 -16.920  -0.802   4.072
   21    HB2  ALA   3           HB2      ALA   3 -18.308  -0.247   3.134
   22    HB3  ALA   3           HB3      ALA   3 -17.169   0.923   3.800
   23    H    LEU   4           H        LEU   4 -15.638  -2.584   2.322
   24    HA   LEU   4           HA       LEU   4 -12.883  -1.805   3.185
   25    HB2  LEU   4           HB2      LEU   4 -14.852  -3.800   3.925
   26    HB3  LEU   4           HB3      LEU   4 -13.320  -4.570   3.512
   27    HG   LEU   4           HG       LEU   4 -12.193  -2.848   5.020
   28   HD11  LEU   4          HD11      LEU   4 -13.910  -1.183   5.208
   29   HD12  LEU   4          HD12      LEU   4 -13.776  -1.934   6.797
   30   HD13  LEU   4          HD13      LEU   4 -15.102  -2.377   5.722
   31   HD21  LEU   4          HD21      LEU   4 -12.913  -4.066   7.116
   32   HD22  LEU   4          HD22      LEU   4 -12.452  -5.126   5.784
   33   HD23  LEU   4          HD23      LEU   4 -14.157  -4.862   6.151
   34    H    VAL   5           H        VAL   5 -14.154  -2.272   0.284
   35    HA   VAL   5           HA       VAL   5 -12.235  -4.339  -0.689
   36    HB   VAL   5           HB       VAL   5 -14.605  -2.871  -1.889
   37   HG11  VAL   5          HG11      VAL   5 -14.293  -4.289  -3.884
   38   HG12  VAL   5          HG12      VAL   5 -12.815  -4.953  -3.187
   39   HG13  VAL   5          HG13      VAL   5 -12.891  -3.249  -3.634
   40   HG21  VAL   5          HG21      VAL   5 -15.553  -5.173  -1.952
   41   HG22  VAL   5          HG22      VAL   5 -15.151  -4.671  -0.309
   42   HG23  VAL   5          HG23      VAL   5 -14.088  -5.778  -1.178
   43    H    ASN   6           H        ASN   6 -12.965  -0.875  -0.931
   44    HA   ASN   6           HA       ASN   6 -10.826  -0.410  -2.914
   45    HB2  ASN   6           HB2      ASN   6 -13.051   1.075  -1.608
   46    HB3  ASN   6           HB3      ASN   6 -11.662   2.044  -2.099
   47   HD21  ASN   6          HD21      ASN   6 -10.912   1.596  -4.476
   48   HD22  ASN   6          HD22      ASN   6 -12.139   1.330  -5.618
   49    H    SER   7           H        SER   7 -11.297  -0.208   0.574
   50    HA   SER   7           HA       SER   7  -9.182   1.573   1.272
   51    HB2  SER   7           HB2      SER   7 -10.457  -0.801   2.660
   52    HB3  SER   7           HB3      SER   7  -9.332   0.293   3.462
   53    HG   SER   7           HG       SER   7 -11.962   0.629   2.843
   54    H    TYR   8           H        TYR   8  -9.124  -2.037   1.268
   55    HA   TYR   8           HA       TYR   8  -6.279  -2.187   1.698
   56    HB2  TYR   8           HB2      TYR   8  -6.672  -4.463   1.718
   57    HB3  TYR   8           HB3      TYR   8  -8.316  -3.894   1.958
   58    HD1  TYR   8           HD1      TYR   8  -5.919  -5.264  -0.517
   59    HD2  TYR   8           HD2      TYR   8 -10.005  -4.178   0.251
   60    HE1  TYR   8           HE1      TYR   8  -6.627  -6.488  -2.553
   61    HE2  TYR   8           HE2      TYR   8 -10.711  -5.399  -1.787
   62    HH   TYR   8           HH       TYR   8  -9.525  -6.080  -4.032
   63    H    LEU   9           H        LEU   9  -8.238  -1.823  -1.197
   64    HA   LEU   9           HA       LEU   9  -6.379  -2.689  -3.181
   65    HB2  LEU   9           HB2      LEU   9  -8.903  -1.408  -2.982
   66    HB3  LEU   9           HB3      LEU   9  -7.899  -0.356  -3.976
   67    HG   LEU   9           HG       LEU   9  -7.456  -2.104  -5.549
   68   HD11  LEU   9          HD11      LEU   9  -7.043  -4.047  -4.314
   69   HD12  LEU   9          HD12      LEU   9  -8.613  -4.408  -5.032
   70   HD13  LEU   9          HD13      LEU   9  -8.513  -3.867  -3.357
   71   HD21  LEU   9          HD21      LEU   9  -9.712  -1.061  -5.689
   72   HD22  LEU   9          HD22      LEU   9 -10.351  -2.355  -4.675
   73   HD23  LEU   9          HD23      LEU   9  -9.714  -2.723  -6.278
   74    H    TRP  10           H        TRP  10  -6.810   0.496  -1.600
   75    HA   TRP  10           HA       TRP  10  -4.611   1.714  -3.087
   76    HB2  TRP  10           HB2      TRP  10  -6.667   2.865  -2.147
   77    HB3  TRP  10           HB3      TRP  10  -5.977   2.633  -0.543
   78    HD1  TRP  10           HD1      TRP  10  -5.624   5.204  -0.117
   79    HE1  TRP  10           HE1      TRP  10  -3.928   6.913  -1.030
   80    HE3  TRP  10           HE3      TRP  10  -3.751   2.582  -4.096
   81    HZ2  TRP  10           HZ2      TRP  10  -2.037   7.146  -3.155
   82    HZ3  TRP  10           HZ3      TRP  10  -2.008   3.578  -5.541
   83    HH2  TRP  10           HH2      TRP  10  -1.148   5.855  -5.077
   84    H    GLN  11           H        GLN  11  -5.055   0.274   0.135
   85    HA   GLN  11           HA       GLN  11  -2.477   1.000   1.198
   86    HB2  GLN  11           HB2      GLN  11  -4.514  -1.169   1.767
   87    HB3  GLN  11           HB3      GLN  11  -3.047  -0.994   2.730
   88    HG2  GLN  11           HG2      GLN  11  -4.609   1.492   2.285
   89    HG3  GLN  11           HG3      GLN  11  -5.360   0.283   3.326
   90   HE21  GLN  11          HE21      GLN  11  -2.276   2.100   2.913
   91   HE22  GLN  11          HE22      GLN  11  -1.869   2.070   4.560
   92    H    ARG  12           H        ARG  12  -3.665  -1.992  -0.384
   93    HA   ARG  12           HA       ARG  12  -1.224  -3.463  -0.326
   94    HB2  ARG  12           HB2      ARG  12  -3.518  -4.291  -0.881
   95    HB3  ARG  12           HB3      ARG  12  -3.429  -3.427  -2.414
   96    HG2  ARG  12           HG2      ARG  12  -1.059  -5.042  -2.077
   97    HG3  ARG  12           HG3      ARG  12  -2.495  -6.043  -1.860
   98    HD2  ARG  12           HD2      ARG  12  -1.898  -4.254  -4.249
   99    HD3  ARG  12           HD3      ARG  12  -1.929  -6.028  -4.236
  100    HE   ARG  12           HE       ARG  12  -4.392  -5.686  -3.413
  101   HH11  ARG  12          HH11      ARG  12  -3.491  -2.667  -4.216
  102   HH12  ARG  12          HH12      ARG  12  -4.530  -2.472  -5.586
  103   HH21  ARG  12          HH21      ARG  12  -5.389  -5.835  -5.749
  104   HH22  ARG  12          HH22      ARG  12  -5.605  -4.270  -6.458
  105    H    TRP  13           H        TRP  13  -2.098  -0.662  -2.174
  106    HA   TRP  13           HA       TRP  13  -0.199  -1.111  -4.366
  107    HB2  TRP  13           HB2      TRP  13  -2.452   0.495  -3.774
  108    HB3  TRP  13           HB3      TRP  13  -1.107   1.618  -3.942
  109    HD1  TRP  13           HD1      TRP  13  -3.581   1.163  -6.000
  110    HE1  TRP  13           HE1      TRP  13  -3.014   0.720  -8.478
  111    HE3  TRP  13           HE3      TRP  13   1.250  -0.418  -5.527
  112    HZ2  TRP  13           HZ2      TRP  13  -0.802  -0.185 -10.047
  113    HZ3  TRP  13           HZ3      TRP  13   2.561  -1.058  -7.527
  114    HH2  TRP  13           HH2      TRP  13   1.545  -0.945  -9.784
  115    H    GLU  14           H        GLU  14  -0.500   1.358  -1.793
  116    HA   GLU  14           HA       GLU  14   2.287   2.203  -2.100
  117    HB2  GLU  14           HB2      GLU  14   0.015   2.906  -0.221
  118    HB3  GLU  14           HB3      GLU  14   1.570   3.738  -0.223
  119    HG2  GLU  14           HG2      GLU  14   0.955   3.809  -2.884
  120    HG3  GLU  14           HG3      GLU  14  -0.656   3.896  -2.170
  121    H    ASN  15           H        ASN  15   0.402   0.620   0.538
  122    HA   ASN  15           HA       ASN  15   2.473   0.388   2.440
  123    HB2  ASN  15           HB2      ASN  15  -0.119  -0.329   2.309
  124    HB3  ASN  15           HB3      ASN  15   0.613  -1.915   2.061
  125   HD21  ASN  15          HD21      ASN  15   2.720  -2.096   3.721
  126   HD22  ASN  15          HD22      ASN  15   2.311  -1.741   5.329
  127    H    TRP  16           H        TRP  16   1.742  -1.755  -0.339
  128    HA   TRP  16           HA       TRP  16   3.868  -3.649   0.318
  129    HB2  TRP  16           HB2      TRP  16   2.131  -4.560  -0.972
  130    HB3  TRP  16           HB3      TRP  16   1.986  -3.114  -1.969
  131    HD1  TRP  16           HD1      TRP  16   4.248  -6.183  -1.474
  132    HE1  TRP  16           HE1      TRP  16   5.600  -6.557  -3.637
  133    HE3  TRP  16           HE3      TRP  16   2.859  -2.037  -4.118
  134    HZ2  TRP  16           HZ2      TRP  16   6.034  -5.277  -6.153
  135    HZ3  TRP  16           HZ3      TRP  16   3.763  -1.640  -6.390
  136    HH2  TRP  16           HH2      TRP  16   5.344  -3.252  -7.410
  137    H    PHE  17           H        PHE  17   3.485  -1.051  -2.135
  138    HA   PHE  17           HA       PHE  17   6.031  -1.264  -3.358
  139    HB2  PHE  17           HB2      PHE  17   4.013   0.102  -4.052
  140    HB3  PHE  17           HB3      PHE  17   4.462   1.275  -2.812
  141    HD1  PHE  17           HD1      PHE  17   5.738  -0.477  -5.855
  142    HD2  PHE  17           HD2      PHE  17   6.138   2.893  -3.223
  143    HE1  PHE  17           HE1      PHE  17   7.376   0.544  -7.411
  144    HE2  PHE  17           HE2      PHE  17   7.777   3.915  -4.779
  145    HZ   PHE  17           HZ       PHE  17   8.396   2.741  -6.874
  146    H    TRP  18           H        TRP  18   5.054   0.846  -0.609
  147    HA   TRP  18           HA       TRP  18   7.690   1.912  -0.163
  148    HB2  TRP  18           HB2      TRP  18   5.302   1.550   1.676
  149    HB3  TRP  18           HB3      TRP  18   6.692   2.573   2.033
  150    HD1  TRP  18           HD1      TRP  18   3.496   3.361   1.365
  151    HE1  TRP  18           HE1      TRP  18   3.123   5.263  -0.333
  152    HE3  TRP  18           HE3      TRP  18   8.057   3.396  -0.945
  153    HZ2  TRP  18           HZ2      TRP  18   4.565   6.621  -2.390
  154    HZ3  TRP  18           HZ3      TRP  18   8.526   5.006  -2.766
  155    HH2  TRP  18           HH2      TRP  18   6.788   6.618  -3.492
  156    H    ASN  19           H        ASN  19   6.024  -0.982   1.081
  157    HA   ASN  19           HA       ASN  19   8.053  -1.641   3.046
  158    HB2  ASN  19           HB2      ASN  19   5.614  -2.389   2.895
  159    HB3  ASN  19           HB3      ASN  19   6.136  -3.517   1.644
  160   HD21  ASN  19          HD21      ASN  19   7.567  -5.292   2.294
  161   HD22  ASN  19          HD22      ASN  19   7.769  -5.702   3.929
  162    H    VAL  20           H        VAL  20   7.530  -2.536  -0.366
  163    HA   VAL  20           HA       VAL  20   9.860  -4.358  -0.346
  164    HB   VAL  20           HB       VAL  20   7.596  -4.691  -1.524
  165   HG11  VAL  20          HG11      VAL  20   7.788  -2.281  -2.515
  166   HG12  VAL  20          HG12      VAL  20   7.129  -3.567  -3.523
  167   HG13  VAL  20          HG13      VAL  20   8.800  -3.047  -3.737
  168   HG21  VAL  20          HG21      VAL  20   8.588  -6.043  -3.159
  169   HG22  VAL  20          HG22      VAL  20   9.886  -5.861  -1.978
  170   HG23  VAL  20          HG23      VAL  20   9.896  -4.897  -3.455
  171    H    THR  21           H        THR  21   9.172  -1.025  -1.176
  172    HA   THR  21           HA       THR  21  11.761  -0.820  -2.663
  173    HB   THR  21           HB       THR  21   9.407   1.089  -2.482
  174    HG1  THR  21           HG1      THR  21   8.783   0.228  -4.401
  175   HG21  THR  21          HG21      THR  21  11.799   1.024  -4.343
  176   HG22  THR  21          HG22      THR  21  11.547   2.183  -3.038
  177   HG23  THR  21          HG23      THR  21  10.462   2.170  -4.428
  178    H    LEU  22           H        LEU  22   9.833   1.172  -0.391
  179    HA   LEU  22           HA       LEU  22  12.082   2.731   0.518
  180    HB2  LEU  22           HB2      LEU  22   9.220   2.408   1.060
  181    HB3  LEU  22           HB3      LEU  22  10.137   2.801   2.512
  182    HG   LEU  22           HG       LEU  22  10.411   4.344  -0.080
  183   HD11  LEU  22          HD11      LEU  22   8.772   5.844   0.616
  184   HD12  LEU  22          HD12      LEU  22   8.921   5.379   2.310
  185   HD13  LEU  22          HD13      LEU  22   8.084   4.320   1.177
  186   HD21  LEU  22          HD21      LEU  22  11.438   6.026   1.395
  187   HD22  LEU  22          HD22      LEU  22  12.290   4.489   1.538
  188   HD23  LEU  22          HD23      LEU  22  11.156   4.988   2.793
  189    H    ARG  23           H        ARG  23  10.637  -0.291   1.602
  190    HA   ARG  23           HA       ARG  23  11.275  -1.843   3.254
  191    HB2  ARG  23           HB2      ARG  23  13.667  -0.642   2.020
  192    HB3  ARG  23           HB3      ARG  23  13.979  -1.393   3.583
  193    HG2  ARG  23           HG2      ARG  23  14.206  -3.249   2.228
  194    HG3  ARG  23           HG3      ARG  23  12.473  -3.334   2.541
  195    HD2  ARG  23           HD2      ARG  23  12.430  -3.465   0.224
  196    HD3  ARG  23           HD3      ARG  23  12.423  -1.700   0.394
  197    HE   ARG  23           HE       ARG  23  15.132  -2.486   0.482
  198   HH11  ARG  23          HH11      ARG  23  14.145  -0.537  -1.519
  199   HH12  ARG  23          HH12      ARG  23  14.371  -1.378  -3.019
  200   HH21  ARG  23          HH21      ARG  23  14.680  -4.498  -1.519
  201   HH22  ARG  23          HH22      ARG  23  14.668  -3.629  -3.017
  202    HA   PRO  24           HA       PRO  24  11.410   1.566   6.486
  203    HB2  PRO  24           HB2      PRO  24   8.874   1.218   7.452
  204    HB3  PRO  24           HB3      PRO  24   9.252   2.315   6.109
  205    HG2  PRO  24           HG2      PRO  24   8.103  -0.428   6.046
  206    HG3  PRO  24           HG3      PRO  24   7.713   0.982   5.051
  207    HD2  PRO  24           HD2      PRO  24   9.283  -1.083   4.200
  208    HD3  PRO  24           HD3      PRO  24   9.412   0.577   3.582
  209    H    GLU  25           H        GLU  25  11.018   1.175   8.909
  210    HA   GLU  25           HA       GLU  25  11.372  -0.141  10.835
  211    HB2  GLU  25           HB2      GLU  25   9.293  -1.222   9.263
  212    HB3  GLU  25           HB3      GLU  25  10.262  -2.605   9.768
  213    HG2  GLU  25           HG2      GLU  25   9.628  -2.401  11.936
  214    HG3  GLU  25           HG3      GLU  25   9.809  -0.646  11.915
  215    H    ARG  26           H        ARG  26  11.898  -2.955  11.008
  216    HA   ARG  26           HA       ARG  26  14.653  -3.017   9.880
  217    HB2  ARG  26           HB2      ARG  26  14.289  -3.289  12.309
  218    HB3  ARG  26           HB3      ARG  26  13.231  -4.665  12.003
  219    HG2  ARG  26           HG2      ARG  26  15.419  -5.523  12.585
  220    HG3  ARG  26           HG3      ARG  26  15.164  -5.807  10.865
  221    HD2  ARG  26           HD2      ARG  26  16.317  -3.350  10.746
  222    HD3  ARG  26           HD3      ARG  26  17.097  -3.991  12.206
  223    HE   ARG  26           HE       ARG  26  18.069  -5.736  10.887
  224   HH11  ARG  26          HH11      ARG  26  18.404  -3.563   8.852
  225   HH12  ARG  26          HH12      ARG  26  17.727  -4.284   7.431
  226   HH21  ARG  26          HH21      ARG  26  16.070  -6.791   9.177
  227   HH22  ARG  26          HH22      ARG  26  16.398  -6.118   7.616
  Start of MODEL   23
    1    HA   ARG   1           HA       ARG   1 -18.321   1.044  -5.399
    2    HB2  ARG   1           HB2      ARG   1 -21.125   2.103  -5.070
    3    HB3  ARG   1           HB3      ARG   1 -19.768   2.977  -4.360
    4    HG2  ARG   1           HG2      ARG   1 -18.665   2.848  -6.669
    5    HG3  ARG   1           HG3      ARG   1 -20.240   2.335  -7.276
    6    HD2  ARG   1           HD2      ARG   1 -20.797   4.578  -5.671
    7    HD3  ARG   1           HD3      ARG   1 -19.345   5.016  -6.593
    8    HE   ARG   1           HE       ARG   1 -20.566   4.578  -8.652
    9   HH11  ARG   1          HH11      ARG   1 -22.473   6.207  -6.802
   10   HH12  ARG   1          HH12      ARG   1 -23.969   5.395  -7.121
   11   HH21  ARG   1          HH21      ARG   1 -22.459   2.648  -8.624
   12   HH22  ARG   1          HH22      ARG   1 -23.961   3.373  -8.157
   13    H    SER   2           H        SER   2 -17.213   0.798  -3.488
   14    HA   SER   2           HA       SER   2 -18.745   0.384  -0.957
   15    HB2  SER   2           HB2      SER   2 -16.796  -1.451  -2.321
   16    HB3  SER   2           HB3      SER   2 -16.892  -1.452  -0.562
   17    HG   SER   2           HG       SER   2 -19.046  -1.993  -0.703
   18    H    ALA   3           H        ALA   3 -17.423   0.801   0.961
   19    HA   ALA   3           HA       ALA   3 -15.257   2.777   0.439
   20    HB1  ALA   3           HB1      ALA   3 -16.996   3.556   1.869
   21    HB2  ALA   3           HB2      ALA   3 -15.667   3.152   2.956
   22    HB3  ALA   3           HB3      ALA   3 -17.029   2.045   2.778
   23    H    LEU   4           H        LEU   4 -15.840  -0.318   2.106
   24    HA   LEU   4           HA       LEU   4 -13.067  -0.414   3.131
   25    HB2  LEU   4           HB2      LEU   4 -15.322  -1.205   4.219
   26    HB3  LEU   4           HB3      LEU   4 -15.087  -2.644   3.226
   27    HG   LEU   4           HG       LEU   4 -12.615  -2.458   4.262
   28   HD11  LEU   4          HD11      LEU   4 -13.074  -0.451   5.575
   29   HD12  LEU   4          HD12      LEU   4 -12.827  -1.816   6.665
   30   HD13  LEU   4          HD13      LEU   4 -14.459  -1.235   6.337
   31   HD21  LEU   4          HD21      LEU   4 -13.310  -4.136   5.907
   32   HD22  LEU   4          HD22      LEU   4 -14.177  -4.397   4.394
   33   HD23  LEU   4          HD23      LEU   4 -14.990  -3.621   5.753
   34    H    VAL   5           H        VAL   5 -14.029  -0.733   0.098
   35    HA   VAL   5           HA       VAL   5 -12.627  -3.325  -0.441
   36    HB   VAL   5           HB       VAL   5 -14.545  -1.606  -2.058
   37   HG11  VAL   5          HG11      VAL   5 -14.505  -3.536  -3.666
   38   HG12  VAL   5          HG12      VAL   5 -13.152  -4.210  -2.757
   39   HG13  VAL   5          HG13      VAL   5 -12.974  -2.663  -3.586
   40   HG21  VAL   5          HG21      VAL   5 -16.010  -3.624  -1.811
   41   HG22  VAL   5          HG22      VAL   5 -15.634  -2.859  -0.267
   42   HG23  VAL   5          HG23      VAL   5 -14.795  -4.333  -0.747
   43    H    ASN   6           H        ASN   6 -12.934  -0.008  -1.791
   44    HA   ASN   6           HA       ASN   6 -10.531  -0.178  -3.395
   45    HB2  ASN   6           HB2      ASN   6 -12.230   2.109  -2.341
   46    HB3  ASN   6           HB3      ASN   6 -10.910   2.335  -3.490
   47   HD21  ASN   6          HD21      ASN   6 -11.106   0.793  -5.519
   48   HD22  ASN   6          HD22      ASN   6 -12.669   0.599  -6.152
   49    H    SER   7           H        SER   7 -11.231   1.276  -0.184
   50    HA   SER   7           HA       SER   7  -8.660   2.397   0.320
   51    HB2  SER   7           HB2      SER   7 -10.886   1.265   2.019
   52    HB3  SER   7           HB3      SER   7  -9.425   1.905   2.764
   53    HG   SER   7           HG       SER   7 -10.234   3.808   2.444
   54    H    TYR   8           H        TYR   8  -9.952  -0.852   1.083
   55    HA   TYR   8           HA       TYR   8  -7.620  -1.951   2.304
   56    HB2  TYR   8           HB2      TYR   8  -9.633  -3.150   2.533
   57    HB3  TYR   8           HB3      TYR   8 -10.042  -2.974   0.830
   58    HD1  TYR   8           HD1      TYR   8  -7.424  -4.518   3.026
   59    HD2  TYR   8           HD2      TYR   8  -9.696  -4.784  -0.609
   60    HE1  TYR   8           HE2      TYR   8  -6.421  -6.737   2.563
   61    HE2  TYR   8           HE1      TYR   8  -8.693  -7.004  -1.073
   62    HH   TYR   8           HH       TYR   8  -7.635  -8.902   0.463
   63    H    LEU   9           H        LEU   9  -8.696  -1.927  -1.103
   64    HA   LEU   9           HA       LEU   9  -6.451  -3.388  -2.174
   65    HB2  LEU   9           HB2      LEU   9  -8.873  -2.066  -3.026
   66    HB3  LEU   9           HB3      LEU   9  -7.559  -1.596  -4.096
   67    HG   LEU   9           HG       LEU   9  -7.153  -3.812  -4.780
   68   HD11  LEU   9          HD11      LEU   9  -8.451  -5.709  -3.491
   69   HD12  LEU   9          HD12      LEU   9  -8.483  -4.530  -2.181
   70   HD13  LEU   9          HD13      LEU   9  -6.940  -5.085  -2.831
   71   HD21  LEU   9          HD21      LEU   9  -9.466  -4.782  -5.217
   72   HD22  LEU   9          HD22      LEU   9  -9.237  -3.114  -5.742
   73   HD23  LEU   9          HD23      LEU   9 -10.113  -3.456  -4.250
   74    H    TRP  10           H        TRP  10  -7.157   0.102  -1.877
   75    HA   TRP  10           HA       TRP  10  -4.800   1.087  -3.163
   76    HB2  TRP  10           HB2      TRP  10  -6.580   2.597  -2.802
   77    HB3  TRP  10           HB3      TRP  10  -6.784   2.097  -1.125
   78    HD1  TRP  10           HD1      TRP  10  -4.188   3.945  -3.321
   79    HE1  TRP  10           HE1      TRP  10  -2.988   5.687  -1.844
   80    HE3  TRP  10           HE3      TRP  10  -6.339   2.902   1.188
   81    HZ2  TRP  10           HZ2      TRP  10  -2.950   6.525   0.891
   82    HZ3  TRP  10           HZ3      TRP  10  -5.705   4.183   3.211
   83    HH2  TRP  10           HH2      TRP  10  -4.015   5.992   3.069
   84    H    GLN  11           H        GLN  11  -5.479   0.375   0.288
   85    HA   GLN  11           HA       GLN  11  -2.987   1.202   1.380
   86    HB2  GLN  11           HB2      GLN  11  -5.201  -0.679   2.083
   87    HB3  GLN  11           HB3      GLN  11  -3.703  -0.824   3.002
   88    HG2  GLN  11           HG2      GLN  11  -3.949   1.231   3.997
   89    HG3  GLN  11           HG3      GLN  11  -4.745   1.933   2.589
   90   HE21  GLN  11          HE21      GLN  11  -5.422  -0.645   5.045
   91   HE22  GLN  11          HE22      GLN  11  -7.062  -0.242   5.216
   92    H    ARG  12           H        ARG  12  -3.946  -1.907  -0.089
   93    HA   ARG  12           HA       ARG  12  -1.544  -3.365   0.504
   94    HB2  ARG  12           HB2      ARG  12  -3.708  -3.529  -1.604
   95    HB3  ARG  12           HB3      ARG  12  -2.397  -4.705  -1.534
   96    HG2  ARG  12           HG2      ARG  12  -3.814  -4.132   1.022
   97    HG3  ARG  12           HG3      ARG  12  -4.708  -5.045  -0.194
   98    HD2  ARG  12           HD2      ARG  12  -2.755  -6.626  -0.363
   99    HD3  ARG  12           HD3      ARG  12  -2.009  -5.767   0.999
  100    HE   ARG  12           HE       ARG  12  -4.659  -7.160   1.161
  101   HH11  ARG  12          HH11      ARG  12  -2.384  -8.545   2.419
  102   HH12  ARG  12          HH12      ARG  12  -2.424  -7.971   4.053
  103   HH21  ARG  12          HH21      ARG  12  -4.470  -5.256   3.322
  104   HH22  ARG  12          HH22      ARG  12  -3.616  -6.104   4.567
  105    H    TRP  13           H        TRP  13  -2.497  -1.400  -2.336
  106    HA   TRP  13           HA       TRP  13  -0.206  -1.901  -3.950
  107    HB2  TRP  13           HB2      TRP  13  -1.526  -0.640  -5.284
  108    HB3  TRP  13           HB3      TRP  13  -2.543  -0.250  -3.906
  109    HD1  TRP  13           HD1      TRP  13  -2.699   2.212  -3.359
  110    HE1  TRP  13           HE1      TRP  13  -1.287   4.315  -3.838
  111    HE3  TRP  13           HE3      TRP  13   1.284   0.077  -5.733
  112    HZ2  TRP  13           HZ2      TRP  13   1.205   4.999  -5.066
  113    HZ3  TRP  13           HZ3      TRP  13   3.161   1.475  -6.548
  114    HH2  TRP  13           HH2      TRP  13   3.126   3.931  -6.217
  115    H    GLU  14           H        GLU  14  -0.760   0.652  -1.491
  116    HA   GLU  14           HA       GLU  14   1.888   1.821  -1.817
  117    HB2  GLU  14           HB2      GLU  14  -0.452   2.057   0.047
  118    HB3  GLU  14           HB3      GLU  14   1.086   2.782   0.523
  119    HG2  GLU  14           HG2      GLU  14   0.992   3.681  -2.001
  120    HG3  GLU  14           HG3      GLU  14  -0.739   3.509  -1.721
  121    H    ASN  15           H        ASN  15   0.446  -0.591   0.372
  122    HA   ASN  15           HA       ASN  15   2.514  -0.821   2.294
  123    HB2  ASN  15           HB2      ASN  15   0.133  -2.047   1.763
  124    HB3  ASN  15           HB3      ASN  15   1.258  -3.329   1.319
  125   HD21  ASN  15          HD21      ASN  15   3.222  -3.385   3.108
  126   HD22  ASN  15          HD22      ASN  15   2.661  -3.433   4.709
  127    H    TRP  16           H        TRP  16   2.157  -2.544  -0.837
  128    HA   TRP  16           HA       TRP  16   4.656  -3.979  -0.649
  129    HB2  TRP  16           HB2      TRP  16   3.109  -4.851  -2.183
  130    HB3  TRP  16           HB3      TRP  16   2.656  -3.256  -2.780
  131    HD1  TRP  16           HD1      TRP  16   5.587  -5.757  -2.942
  132    HE1  TRP  16           HE1      TRP  16   6.892  -5.336  -5.123
  133    HE3  TRP  16           HE3      TRP  16   3.119  -1.628  -4.665
  134    HZ2  TRP  16           HZ2      TRP  16   6.895  -3.492  -7.306
  135    HZ3  TRP  16           HZ3      TRP  16   3.797  -0.561  -6.795
  136    HH2  TRP  16           HH2      TRP  16   5.679  -1.486  -8.118
  137    H    PHE  17           H        PHE  17   3.711  -0.942  -2.298
  138    HA   PHE  17           HA       PHE  17   6.179  -0.280  -3.510
  139    HB2  PHE  17           HB2      PHE  17   4.211   0.968  -4.019
  140    HB3  PHE  17           HB3      PHE  17   3.895   1.312  -2.320
  141    HD1  PHE  17           HD1      PHE  17   6.558   1.842  -4.916
  142    HD2  PHE  17           HD2      PHE  17   4.520   3.389  -1.466
  143    HE1  PHE  17           HE2      PHE  17   7.853   3.949  -5.094
  144    HE2  PHE  17           HE1      PHE  17   5.814   5.495  -1.645
  145    HZ   PHE  17           HZ       PHE  17   7.482   5.775  -3.458
  146    H    TRP  18           H        TRP  18   4.975   0.726  -0.276
  147    HA   TRP  18           HA       TRP  18   7.430   1.992   0.545
  148    HB2  TRP  18           HB2      TRP  18   4.977   0.895   1.929
  149    HB3  TRP  18           HB3      TRP  18   6.296   1.615   2.850
  150    HD1  TRP  18           HD1      TRP  18   3.134   2.616   1.689
  151    HE1  TRP  18           HE1      TRP  18   3.004   5.124   1.100
  152    HE3  TRP  18           HE3      TRP  18   8.114   3.709   1.375
  153    HZ2  TRP  18           HZ2      TRP  18   4.779   7.301   0.568
  154    HZ3  TRP  18           HZ3      TRP  18   8.865   6.003   0.826
  155    HH2  TRP  18           HH2      TRP  18   7.205   7.801   0.423
  156    H    ASN  19           H        ASN  19   6.238  -1.342   0.726
  157    HA   ASN  19           HA       ASN  19   8.039  -2.417   2.644
  158    HB2  ASN  19           HB2      ASN  19   6.007  -3.443   1.435
  159    HB3  ASN  19           HB3      ASN  19   7.118  -3.803   0.114
  160   HD21  ASN  19          HD21      ASN  19   8.853  -5.371   0.535
  161   HD22  ASN  19          HD22      ASN  19   8.774  -6.418   1.868
  162    H    VAL  20           H        VAL  20   8.435  -2.087  -0.910
  163    HA   VAL  20           HA       VAL  20  11.221  -3.048  -0.767
  164    HB   VAL  20           HB       VAL  20  11.124  -2.615  -3.239
  165   HG11  VAL  20          HG11      VAL  20  10.132  -4.688  -1.932
  166   HG12  VAL  20          HG12      VAL  20   9.858  -4.513  -3.666
  167   HG13  VAL  20          HG13      VAL  20   8.595  -4.057  -2.523
  168   HG21  VAL  20          HG21      VAL  20   8.208  -1.930  -2.821
  169   HG22  VAL  20          HG22      VAL  20   9.171  -1.768  -4.288
  170   HG23  VAL  20          HG23      VAL  20   9.443  -0.677  -2.931
  171    H    THR  21           H        THR  21   9.537   0.042  -0.851
  172    HA   THR  21           HA       THR  21  11.828   1.646  -1.656
  173    HB   THR  21           HB       THR  21   9.200   2.271  -0.267
  174    HG1  THR  21           HG1      THR  21   8.630   1.800  -2.249
  175   HG21  THR  21          HG21      THR  21   9.649   4.619  -1.008
  176   HG22  THR  21          HG22      THR  21  11.276   4.124  -1.470
  177   HG23  THR  21          HG23      THR  21  10.780   4.054   0.221
  178    H    LEU  22           H        LEU  22  10.403   0.683   1.449
  179    HA   LEU  22           HA       LEU  22  12.320   2.281   3.007
  180    HB2  LEU  22           HB2      LEU  22  10.259   0.187   3.777
  181    HB3  LEU  22           HB3      LEU  22  11.115   1.225   4.914
  182    HG   LEU  22           HG       LEU  22   9.382   2.273   2.655
  183   HD11  LEU  22          HD11      LEU  22   7.857   1.193   4.102
  184   HD12  LEU  22          HD12      LEU  22   7.858   2.865   4.660
  185   HD13  LEU  22          HD13      LEU  22   8.770   1.641   5.542
  186   HD21  LEU  22          HD21      LEU  22  11.051   3.878   3.391
  187   HD22  LEU  22          HD22      LEU  22  10.675   3.556   5.084
  188   HD23  LEU  22          HD23      LEU  22   9.490   4.364   4.056
  189    H    ARG  23           H        ARG  23  11.853  -1.126   2.126
  190    HA   ARG  23           HA       ARG  23  14.646  -1.675   3.018
  191    HB2  ARG  23           HB2      ARG  23  13.740  -3.816   4.064
  192    HB3  ARG  23           HB3      ARG  23  13.288  -2.329   4.895
  193    HG2  ARG  23           HG2      ARG  23  11.108  -2.346   3.705
  194    HG3  ARG  23           HG3      ARG  23  11.561  -3.863   2.926
  195    HD2  ARG  23           HD2      ARG  23  11.742  -4.954   5.141
  196    HD3  ARG  23           HD3      ARG  23  11.263  -3.431   5.921
  197    HE   ARG  23           HE       ARG  23   9.495  -4.711   3.869
  198   HH11  ARG  23          HH11      ARG  23   9.008  -2.077   5.458
  199   HH12  ARG  23          HH12      ARG  23   7.830  -2.627   6.603
  200   HH21  ARG  23          HH21      ARG  23   8.440  -5.998   6.004
  201   HH22  ARG  23          HH22      ARG  23   7.504  -4.855   6.909
  202    HA   PRO  24           HA       PRO  24  13.715  -3.408  -1.164
  203    HB2  PRO  24           HB2      PRO  24  16.150  -2.739  -2.235
  204    HB3  PRO  24           HB3      PRO  24  14.763  -1.631  -2.208
  205    HG2  PRO  24           HG2      PRO  24  17.127  -1.749  -0.396
  206    HG3  PRO  24           HG3      PRO  24  16.296  -0.340  -1.076
  207    HD2  PRO  24           HD2      PRO  24  15.918  -1.181   1.473
  208    HD3  PRO  24           HD3      PRO  24  14.650  -0.370   0.527
  209    H    GLU  25           H        GLU  25  14.586  -5.355  -2.068
  210    HA   GLU  25           HA       GLU  25  16.262  -6.935  -0.190
  211    HB2  GLU  25           HB2      GLU  25  14.369  -7.455  -2.465
  212    HB3  GLU  25           HB3      GLU  25  15.520  -8.712  -2.014
  213    HG2  GLU  25           HG2      GLU  25  13.778  -7.357   0.050
  214    HG3  GLU  25           HG3      GLU  25  13.214  -8.762  -0.855
  215    H    ARG  26           H        ARG  26  16.146  -6.333  -3.736
  216    HA   ARG  26           HA       ARG  26  19.136  -6.467  -3.782
  217    HB2  ARG  26           HB2      ARG  26  17.090  -8.065  -5.315
  218    HB3  ARG  26           HB3      ARG  26  18.682  -7.769  -6.013
  219    HG2  ARG  26           HG2      ARG  26  19.295  -9.632  -4.862
  220    HG3  ARG  26           HG3      ARG  26  19.351  -8.546  -3.472
  221    HD2  ARG  26           HD2      ARG  26  16.675  -9.172  -3.551
  222    HD3  ARG  26           HD3      ARG  26  17.417 -10.691  -4.089
  223    HE   ARG  26           HE       ARG  26  18.234  -9.278  -1.572
  224   HH11  ARG  26          HH11      ARG  26  19.948 -11.498  -2.801
  225   HH12  ARG  26          HH12      ARG  26  19.434 -12.867  -1.874
  226   HH21  ARG  26          HH21      ARG  26  16.577 -11.292  -0.656
  227   HH22  ARG  26          HH22      ARG  26  17.516 -12.751  -0.653
  Start of MODEL   24
    1    HA   ARG   1           HA       ARG   1 -12.793   4.020  -6.132
    2    HB2  ARG   1           HB2      ARG   1 -13.229   6.149  -4.932
    3    HB3  ARG   1           HB3      ARG   1 -12.839   6.436  -6.626
    4    HG2  ARG   1           HG2      ARG   1 -15.072   6.940  -7.184
    5    HG3  ARG   1           HG3      ARG   1 -15.709   6.146  -5.744
    6    HD2  ARG   1           HD2      ARG   1 -15.876   8.437  -5.190
    7    HD3  ARG   1           HD3      ARG   1 -14.329   7.979  -4.449
    8    HE   ARG   1           HE       ARG   1 -14.588   9.358  -7.095
    9   HH11  ARG   1          HH11      ARG   1 -13.530  10.741  -4.608
   10   HH12  ARG   1          HH12      ARG   1 -11.819  10.636  -4.856
   11   HH21  ARG   1          HH21      ARG   1 -12.063   8.183  -7.306
   12   HH22  ARG   1          HH22      ARG   1 -10.985   9.180  -6.388
   13    H    SER   2           H        SER   2 -13.424   3.635  -3.865
   14    HA   SER   2           HA       SER   2 -16.332   3.198  -3.365
   15    HB2  SER   2           HB2      SER   2 -14.504   1.197  -4.151
   16    HB3  SER   2           HB3      SER   2 -14.729   0.970  -2.419
   17    HG   SER   2           HG       SER   2 -16.652   0.971  -4.493
   18    H    ALA   3           H        ALA   3 -16.180   1.973  -0.905
   19    HA   ALA   3           HA       ALA   3 -14.663   3.971   0.739
   20    HB1  ALA   3           HB1      ALA   3 -17.220   2.401   1.164
   21    HB2  ALA   3           HB2      ALA   3 -17.053   4.147   0.977
   22    HB3  ALA   3           HB3      ALA   3 -16.457   3.356   2.436
   23    H    LEU   4           H        LEU   4 -15.815   0.564   0.898
   24    HA   LEU   4           HA       LEU   4 -13.480  -0.054   2.667
   25    HB2  LEU   4           HB2      LEU   4 -14.852  -1.903   3.453
   26    HB3  LEU   4           HB3      LEU   4 -15.829  -0.436   3.471
   27    HG   LEU   4           HG       LEU   4 -16.154  -1.526   0.887
   28   HD11  LEU   4          HD11      LEU   4 -15.225  -3.647   1.803
   29   HD12  LEU   4          HD12      LEU   4 -16.918  -3.808   1.337
   30   HD13  LEU   4          HD13      LEU   4 -16.484  -3.641   3.038
   31   HD21  LEU   4          HD21      LEU   4 -17.838  -0.307   2.230
   32   HD22  LEU   4          HD22      LEU   4 -17.956  -1.683   3.327
   33   HD23  LEU   4          HD23      LEU   4 -18.479  -1.843   1.650
   34    H    VAL   5           H        VAL   5 -14.301  -0.277  -0.557
   35    HA   VAL   5           HA       VAL   5 -13.023  -2.943  -0.971
   36    HB   VAL   5           HB       VAL   5 -14.465  -1.052  -2.867
   37   HG11  VAL   5          HG11      VAL   5 -14.576  -3.020  -4.351
   38   HG12  VAL   5          HG12      VAL   5 -13.660  -3.963  -3.176
   39   HG13  VAL   5          HG13      VAL   5 -12.900  -2.599  -3.998
   40   HG21  VAL   5          HG21      VAL   5 -15.374  -3.357  -1.152
   41   HG22  VAL   5          HG22      VAL   5 -16.214  -2.985  -2.657
   42   HG23  VAL   5          HG23      VAL   5 -16.129  -1.778  -1.373
   43    H    ASN   6           H        ASN   6 -12.850   0.382  -2.325
   44    HA   ASN   6           HA       ASN   6 -10.331  -0.027  -3.676
   45    HB2  ASN   6           HB2      ASN   6 -12.011   1.694  -4.266
   46    HB3  ASN   6           HB3      ASN   6 -11.733   2.495  -2.720
   47   HD21  ASN   6          HD21      ASN   6  -9.530   1.166  -5.279
   48   HD22  ASN   6          HD22      ASN   6  -8.584   2.570  -5.386
   49    H    SER   7           H        SER   7 -11.185   1.396  -0.494
   50    HA   SER   7           HA       SER   7  -8.631   2.361   0.264
   51    HB2  SER   7           HB2      SER   7 -11.053   2.335   1.385
   52    HB3  SER   7           HB3      SER   7 -10.388   0.948   2.244
   53    HG   SER   7           HG       SER   7  -9.757   3.637   2.407
   54    H    TYR   8           H        TYR   8 -10.045  -0.894   0.794
   55    HA   TYR   8           HA       TYR   8  -7.773  -2.089   2.052
   56    HB2  TYR   8           HB2      TYR   8  -9.849  -3.222   2.167
   57    HB3  TYR   8           HB3      TYR   8 -10.141  -3.049   0.438
   58    HD1  TYR   8           HD1      TYR   8  -7.692  -4.610   2.817
   59    HD2  TYR   8           HD2      TYR   8  -9.704  -4.862  -0.970
   60    HE1  TYR   8           HE2      TYR   8  -6.663  -6.830   2.418
   61    HE2  TYR   8           HE1      TYR   8  -8.674  -7.083  -1.369
   62    HH   TYR   8           HH       TYR   8  -7.640  -9.006   0.594
   63    H    LEU   9           H        LEU   9  -8.733  -1.891  -1.386
   64    HA   LEU   9           HA       LEU   9  -6.524  -3.397  -2.453
   65    HB2  LEU   9           HB2      LEU   9  -8.809  -1.840  -3.332
   66    HB3  LEU   9           HB3      LEU   9  -7.409  -1.469  -4.334
   67    HG   LEU   9           HG       LEU   9  -8.660  -3.363  -5.276
   68   HD11  LEU   9          HD11      LEU   9  -6.234  -4.654  -4.085
   69   HD12  LEU   9          HD12      LEU   9  -6.017  -3.227  -5.101
   70   HD13  LEU   9          HD13      LEU   9  -6.802  -4.665  -5.755
   71   HD21  LEU   9          HD21      LEU   9  -9.284  -5.236  -4.072
   72   HD22  LEU   9          HD22      LEU   9  -9.333  -4.036  -2.782
   73   HD23  LEU   9          HD23      LEU   9  -7.932  -5.094  -2.948
   74    H    TRP  10           H        TRP  10  -7.047   0.095  -1.949
   75    HA   TRP  10           HA       TRP  10  -4.556   1.002  -3.062
   76    HB2  TRP  10           HB2      TRP  10  -6.253   2.609  -2.815
   77    HB3  TRP  10           HB3      TRP  10  -6.682   2.047  -1.202
   78    HD1  TRP  10           HD1      TRP  10  -3.803   3.890  -3.000
   79    HE1  TRP  10           HE1      TRP  10  -2.675   5.470  -1.302
   80    HE3  TRP  10           HE3      TRP  10  -6.409   2.657   1.211
   81    HZ2  TRP  10           HZ2      TRP  10  -2.860   6.126   1.475
   82    HZ3  TRP  10           HZ3      TRP  10  -5.916   3.774   3.368
   83    HH2  TRP  10           HH2      TRP  10  -4.147   5.504   3.505
   84    H    GLN  11           H        GLN  11  -5.538   0.167   0.285
   85    HA   GLN  11           HA       GLN  11  -3.198   0.913   1.681
   86    HB2  GLN  11           HB2      GLN  11  -5.347  -1.160   1.959
   87    HB3  GLN  11           HB3      GLN  11  -3.957  -1.260   3.040
   88    HG2  GLN  11           HG2      GLN  11  -4.483   0.699   4.127
   89    HG3  GLN  11           HG3      GLN  11  -5.219   1.419   2.696
   90   HE21  GLN  11          HE21      GLN  11  -7.336   1.886   3.457
   91   HE22  GLN  11          HE22      GLN  11  -8.382   0.715   4.097
   92    H    ARG  12           H        ARG  12  -3.919  -2.190   0.051
   93    HA   ARG  12           HA       ARG  12  -1.452  -3.511   0.662
   94    HB2  ARG  12           HB2      ARG  12  -3.802  -4.244  -0.346
   95    HB3  ARG  12           HB3      ARG  12  -2.968  -3.992  -1.880
   96    HG2  ARG  12           HG2      ARG  12  -1.209  -5.553  -1.228
   97    HG3  ARG  12           HG3      ARG  12  -1.933  -5.744   0.370
   98    HD2  ARG  12           HD2      ARG  12  -3.737  -6.996  -0.447
   99    HD3  ARG  12           HD3      ARG  12  -3.582  -6.329  -2.086
  100    HE   ARG  12           HE       ARG  12  -1.481  -8.127  -0.928
  101   HH11  ARG  12          HH11      ARG  12  -3.857  -9.310  -2.462
  102   HH12  ARG  12          HH12      ARG  12  -3.173  -9.483  -4.044
  103   HH21  ARG  12          HH21      ARG  12  -0.476  -7.387  -3.393
  104   HH22  ARG  12          HH22      ARG  12  -1.251  -8.389  -4.574
  105    H    TRP  13           H        TRP  13  -2.375  -1.317  -1.983
  106    HA   TRP  13           HA       TRP  13  -0.080  -1.803  -3.646
  107    HB2  TRP  13           HB2      TRP  13  -1.418  -0.548  -4.966
  108    HB3  TRP  13           HB3      TRP  13  -2.456  -0.207  -3.588
  109    HD1  TRP  13           HD1      TRP  13  -2.644   2.229  -2.950
  110    HE1  TRP  13           HE1      TRP  13  -1.279   4.373  -3.384
  111    HE3  TRP  13           HE3      TRP  13   1.350   0.243  -5.428
  112    HZ2  TRP  13           HZ2      TRP  13   1.187   5.140  -4.616
  113    HZ3  TRP  13           HZ3      TRP  13   3.191   1.698  -6.220
  114    HH2  TRP  13           HH2      TRP  13   3.116   4.143  -5.818
  115    H    GLU  14           H        GLU  14  -0.714   0.681  -1.133
  116    HA   GLU  14           HA       GLU  14   1.909   1.914  -1.445
  117    HB2  GLU  14           HB2      GLU  14  -0.509   2.159   0.266
  118    HB3  GLU  14           HB3      GLU  14   0.997   2.764   0.959
  119    HG2  GLU  14           HG2      GLU  14   1.307   3.902  -1.383
  120    HG3  GLU  14           HG3      GLU  14  -0.432   3.662  -1.526
  121    H    ASN  15           H        ASN  15   0.474  -0.183   1.109
  122    HA   ASN  15           HA       ASN  15   2.710  -0.405   2.805
  123    HB2  ASN  15           HB2      ASN  15   0.226  -1.427   2.753
  124    HB3  ASN  15           HB3      ASN  15   1.104  -2.855   2.205
  125   HD21  ASN  15          HD21      ASN  15   3.473  -2.741   3.691
  126   HD22  ASN  15          HD22      ASN  15   3.120  -2.806   5.350
  127    H    TRP  16           H        TRP  16   2.011  -2.219  -0.193
  128    HA   TRP  16           HA       TRP  16   4.403  -3.890   0.020
  129    HB2  TRP  16           HB2      TRP  16   2.656  -4.866  -1.204
  130    HB3  TRP  16           HB3      TRP  16   2.220  -3.346  -1.980
  131    HD1  TRP  16           HD1      TRP  16   4.890  -6.106  -2.119
  132    HE1  TRP  16           HE1      TRP  16   6.000  -6.051  -4.444
  133    HE3  TRP  16           HE3      TRP  16   2.678  -1.926  -4.051
  134    HZ2  TRP  16           HZ2      TRP  16   5.960  -4.445  -6.807
  135    HZ3  TRP  16           HZ3      TRP  16   3.235  -1.156  -6.340
  136    HH2  TRP  16           HH2      TRP  16   4.871  -2.408  -7.720
  137    H    PHE  17           H        PHE  17   3.441  -1.035  -1.924
  138    HA   PHE  17           HA       PHE  17   5.780  -0.725  -3.481
  139    HB2  PHE  17           HB2      PHE  17   3.594   0.504  -3.657
  140    HB3  PHE  17           HB3      PHE  17   4.050   1.436  -2.232
  141    HD1  PHE  17           HD1      PHE  17   5.410   0.445  -5.590
  142    HD2  PHE  17           HD2      PHE  17   5.182   3.453  -2.532
  143    HE1  PHE  17           HE2      PHE  17   6.699   2.002  -7.025
  144    HE2  PHE  17           HE1      PHE  17   6.469   5.011  -3.969
  145    HZ   PHE  17           HZ       PHE  17   7.228   4.286  -6.216
  146    H    TRP  18           H        TRP  18   5.035   0.854  -0.334
  147    HA   TRP  18           HA       TRP  18   7.588   2.083   0.032
  148    HB2  TRP  18           HB2      TRP  18   5.562   1.030   2.037
  149    HB3  TRP  18           HB3      TRP  18   6.848   2.173   2.415
  150    HD1  TRP  18           HD1      TRP  18   3.482   2.524   2.278
  151    HE1  TRP  18           HE1      TRP  18   2.624   4.642   1.086
  152    HE3  TRP  18           HE3      TRP  18   7.649   3.780  -0.405
  153    HZ2  TRP  18           HZ2      TRP  18   3.579   6.606  -0.757
  154    HZ3  TRP  18           HZ3      TRP  18   7.644   5.778  -1.867
  155    HH2  TRP  18           HH2      TRP  18   5.616   7.193  -2.046
  156    H    ASN  19           H        ASN  19   6.443  -1.193   0.749
  157    HA   ASN  19           HA       ASN  19   8.558  -2.107   2.418
  158    HB2  ASN  19           HB2      ASN  19   6.250  -3.093   1.280
  159    HB3  ASN  19           HB3      ASN  19   7.493  -4.010   0.432
  160   HD21  ASN  19          HD21      ASN  19   5.635  -3.975   3.259
  161   HD22  ASN  19          HD22      ASN  19   6.590  -5.020   4.197
  162    H    VAL  20           H        VAL  20   8.336  -1.951  -1.146
  163    HA   VAL  20           HA       VAL  20  11.123  -3.016  -1.349
  164    HB   VAL  20           HB       VAL  20  10.505  -3.338  -3.740
  165   HG11  VAL  20          HG11      VAL  20   9.142  -5.214  -3.368
  166   HG12  VAL  20          HG12      VAL  20   8.249  -4.426  -2.067
  167   HG13  VAL  20          HG13      VAL  20   9.907  -4.965  -1.798
  168   HG21  VAL  20          HG21      VAL  20   8.892  -1.375  -3.791
  169   HG22  VAL  20          HG22      VAL  20   7.739  -2.394  -2.928
  170   HG23  VAL  20          HG23      VAL  20   8.285  -2.852  -4.540
  171    H    THR  21           H        THR  21   9.220  -0.099  -1.911
  172    HA   THR  21           HA       THR  21  11.288   1.200  -3.538
  173    HB   THR  21           HB       THR  21   8.781   2.234  -2.175
  174    HG1  THR  21           HG1      THR  21   9.314   1.238  -4.776
  175   HG21  THR  21          HG21      THR  21  10.810   3.474  -3.973
  176   HG22  THR  21          HG22      THR  21   9.840   4.207  -2.696
  177   HG23  THR  21          HG23      THR  21   9.117   3.871  -4.268
  178    H    LEU  22           H        LEU  22  10.012   1.652  -0.223
  179    HA   LEU  22           HA       LEU  22  12.080   3.615   0.437
  180    HB2  LEU  22           HB2      LEU  22   9.877   2.181   1.924
  181    HB3  LEU  22           HB3      LEU  22  11.010   3.236   2.766
  182    HG   LEU  22           HG       LEU  22   9.398   4.115   0.356
  183   HD11  LEU  22          HD11      LEU  22   7.762   5.002   1.785
  184   HD12  LEU  22          HD12      LEU  22   8.816   4.923   3.197
  185   HD13  LEU  22          HD13      LEU  22   8.116   3.447   2.536
  186   HD21  LEU  22          HD21      LEU  22   9.978   6.382   1.522
  187   HD22  LEU  22          HD22      LEU  22  11.232   5.571   0.584
  188   HD23  LEU  22          HD23      LEU  22  11.230   5.450   2.344
  189    H    ARG  23           H        ARG  23  11.298   0.660   2.265
  190    HA   ARG  23           HA       ARG  23  12.711  -0.873   3.373
  191    HB2  ARG  23           HB2      ARG  23  12.997  -1.150   0.777
  192    HB3  ARG  23           HB3      ARG  23  14.593  -0.453   1.056
  193    HG2  ARG  23           HG2      ARG  23  15.311  -2.262   2.339
  194    HG3  ARG  23           HG3      ARG  23  13.669  -2.721   2.792
  195    HD2  ARG  23           HD2      ARG  23  14.211  -4.380   1.212
  196    HD3  ARG  23           HD3      ARG  23  13.398  -3.175   0.194
  197    HE   ARG  23           HE       ARG  23  15.920  -2.255   0.039
  198   HH11  ARG  23          HH11      ARG  23  17.081  -4.797   1.045
  199   HH12  ARG  23          HH12      ARG  23  17.330  -5.703  -0.409
  200   HH21  ARG  23          HH21      ARG  23  15.216  -3.712  -2.322
  201   HH22  ARG  23          HH22      ARG  23  16.272  -5.086  -2.325
  202    HA   PRO  24           HA       PRO  24  15.578   2.489   4.787
  203    HB2  PRO  24           HB2      PRO  24  14.602   2.717   7.331
  204    HB3  PRO  24           HB3      PRO  24  13.935   3.619   5.957
  205    HG2  PRO  24           HG2      PRO  24  12.867   1.241   7.351
  206    HG3  PRO  24           HG3      PRO  24  12.011   2.564   6.549
  207    HD2  PRO  24           HD2      PRO  24  12.427   0.017   5.500
  208    HD3  PRO  24           HD3      PRO  24  11.943   1.456   4.578
  209    H    GLU  25           H        GLU  25  16.781   0.239   4.500
  210    HA   GLU  25           HA       GLU  25  18.220  -1.401   5.396
  211    HB2  GLU  25           HB2      GLU  25  18.603   1.071   6.585
  212    HB3  GLU  25           HB3      GLU  25  18.457  -0.002   7.975
  213    HG2  GLU  25           HG2      GLU  25  20.299  -1.312   7.316
  214    HG3  GLU  25           HG3      GLU  25  20.225  -0.740   5.649
  215    H    ARG  26           H        ARG  26  15.783  -2.432   5.591
  216    HA   ARG  26           HA       ARG  26  14.430  -3.951   6.771
  217    HB2  ARG  26           HB2      ARG  26  16.772  -4.846   7.131
  218    HB3  ARG  26           HB3      ARG  26  16.799  -3.990   8.672
  219    HG2  ARG  26           HG2      ARG  26  16.094  -6.169   9.251
  220    HG3  ARG  26           HG3      ARG  26  14.595  -5.242   9.186
  221    HD2  ARG  26           HD2      ARG  26  14.413  -6.012   6.730
  222    HD3  ARG  26           HD3      ARG  26  15.667  -7.200   7.141
  223    HE   ARG  26           HE       ARG  26  14.116  -7.919   9.033
  224   HH11  ARG  26          HH11      ARG  26  13.080  -8.810   6.346
  225   HH12  ARG  26          HH12      ARG  26  11.424  -8.314   6.421
  226   HH21  ARG  26          HH21      ARG  26  11.918  -6.163   9.106
  227   HH22  ARG  26          HH22      ARG  26  10.761  -6.809   7.990
  Start of MODEL   25
    1    HA   ARG   1           HA       ARG   1 -17.617  -0.809  -7.491
    2    HB2  ARG   1           HB2      ARG   1 -20.228   0.195  -8.187
    3    HB3  ARG   1           HB3      ARG   1 -19.651   1.045  -6.754
    4    HG2  ARG   1           HG2      ARG   1 -17.667   1.772  -7.858
    5    HG3  ARG   1           HG3      ARG   1 -17.913   0.651  -9.198
    6    HD2  ARG   1           HD2      ARG   1 -19.861   1.898  -9.963
    7    HD3  ARG   1           HD3      ARG   1 -19.780   2.961  -8.544
    8    HE   ARG   1           HE       ARG   1 -17.254   2.913  -9.974
    9   HH11  ARG   1          HH11      ARG   1 -18.225   5.403  -8.773
   10   HH12  ARG   1          HH12      ARG   1 -18.779   6.319 -10.134
   11   HH21  ARG   1          HH21      ARG   1 -18.929   3.567 -12.254
   12   HH22  ARG   1          HH22      ARG   1 -19.178   5.275 -12.113
   13    H    SER   2           H        SER   2 -16.847  -0.178  -5.430
   14    HA   SER   2           HA       SER   2 -18.602  -0.550  -3.057
   15    HB2  SER   2           HB2      SER   2 -16.882  -2.541  -4.042
   16    HB3  SER   2           HB3      SER   2 -16.012  -1.828  -2.688
   17    HG   SER   2           HG       SER   2 -18.455  -3.193  -2.757
   18    H    ALA   3           H        ALA   3 -17.729   0.502  -1.154
   19    HA   ALA   3           HA       ALA   3 -15.753   2.644  -1.786
   20    HB1  ALA   3           HB1      ALA   3 -16.727   3.698   0.213
   21    HB2  ALA   3           HB2      ALA   3 -17.638   2.227   0.558
   22    HB3  ALA   3           HB3      ALA   3 -18.009   3.178  -0.881
   23    H    LEU   4           H        LEU   4 -16.288  -0.063   0.466
   24    HA   LEU   4           HA       LEU   4 -13.874   0.534   2.022
   25    HB2  LEU   4           HB2      LEU   4 -14.537  -1.477   3.252
   26    HB3  LEU   4           HB3      LEU   4 -15.951  -0.467   2.968
   27    HG   LEU   4           HG       LEU   4 -15.680  -2.210   0.722
   28   HD11  LEU   4          HD11      LEU   4 -14.309  -3.638   2.216
   29   HD12  LEU   4          HD12      LEU   4 -15.846  -4.404   1.817
   30   HD13  LEU   4          HD13      LEU   4 -15.622  -3.647   3.394
   31   HD21  LEU   4          HD21      LEU   4 -17.622  -2.209   3.056
   32   HD22  LEU   4          HD22      LEU   4 -17.894  -2.992   1.499
   33   HD23  LEU   4          HD23      LEU   4 -17.775  -1.235   1.593
   34    H    VAL   5           H        VAL   5 -14.638  -1.362  -0.801
   35    HA   VAL   5           HA       VAL   5 -12.448  -3.248  -0.641
   36    HB   VAL   5           HB       VAL   5 -14.141  -2.161  -2.916
   37   HG11  VAL   5          HG11      VAL   5 -13.341  -4.298  -4.080
   38   HG12  VAL   5          HG12      VAL   5 -12.069  -4.366  -2.860
   39   HG13  VAL   5          HG13      VAL   5 -12.161  -2.993  -3.962
   40   HG21  VAL   5          HG21      VAL   5 -15.433  -3.418  -1.297
   41   HG22  VAL   5          HG22      VAL   5 -14.219  -4.696  -1.250
   42   HG23  VAL   5          HG23      VAL   5 -15.186  -4.452  -2.704
   43    H    ASN   6           H        ASN   6 -12.857  -0.137  -2.379
   44    HA   ASN   6           HA       ASN   6 -10.276  -0.066  -3.605
   45    HB2  ASN   6           HB2      ASN   6 -12.555   1.424  -3.658
   46    HB3  ASN   6           HB3      ASN   6 -11.516   2.477  -2.697
   47   HD21  ASN   6          HD21      ASN   6 -12.383   1.841  -5.865
   48   HD22  ASN   6          HD22      ASN   6 -10.988   2.412  -6.646
   49    H    SER   7           H        SER   7 -11.397   1.026  -0.399
   50    HA   SER   7           HA       SER   7  -9.018   2.398   0.418
   51    HB2  SER   7           HB2      SER   7 -11.403   2.274   1.436
   52    HB3  SER   7           HB3      SER   7 -10.847   0.797   2.217
   53    HG   SER   7           HG       SER   7 -10.403   2.455   3.608
   54    H    TYR   8           H        TYR   8 -10.049  -1.003   0.914
   55    HA   TYR   8           HA       TYR   8  -7.647  -1.816   2.297
   56    HB2  TYR   8           HB2      TYR   8  -9.138  -3.478   2.676
   57    HB3  TYR   8           HB3      TYR   8 -10.176  -2.891   1.386
   58    HD1  TYR   8           HD1      TYR   8  -7.136  -4.973   2.035
   59    HD2  TYR   8           HD2      TYR   8 -10.389  -4.093  -0.629
   60    HE1  TYR   8           HE2      TYR   8  -6.545  -6.950   0.658
   61    HE2  TYR   8           HE1      TYR   8  -9.799  -6.068  -2.004
   62    HH   TYR   8           HH       TYR   8  -8.614  -8.192  -1.769
   63    H    LEU   9           H        LEU   9  -8.642  -1.899  -1.131
   64    HA   LEU   9           HA       LEU   9  -6.343  -3.342  -2.118
   65    HB2  LEU   9           HB2      LEU   9  -8.753  -2.441  -3.088
   66    HB3  LEU   9           HB3      LEU   9  -7.631  -1.330  -3.865
   67    HG   LEU   9           HG       LEU   9  -8.008  -3.314  -5.275
   68   HD11  LEU   9          HD11      LEU   9  -5.750  -2.164  -5.155
   69   HD12  LEU   9          HD12      LEU   9  -5.708  -3.832  -5.727
   70   HD13  LEU   9          HD13      LEU   9  -5.235  -3.455  -4.070
   71   HD21  LEU   9          HD21      LEU   9  -7.313  -5.534  -4.524
   72   HD22  LEU   9          HD22      LEU   9  -8.512  -4.887  -3.405
   73   HD23  LEU   9          HD23      LEU   9  -6.803  -4.877  -2.969
   74    H    TRP  10           H        TRP  10  -7.089   0.148  -1.857
   75    HA   TRP  10           HA       TRP  10  -4.699   1.147  -3.054
   76    HB2  TRP  10           HB2      TRP  10  -6.772   2.430  -2.540
   77    HB3  TRP  10           HB3      TRP  10  -6.398   2.311  -0.823
   78    HD1  TRP  10           HD1      TRP  10  -5.936   4.825  -0.369
   79    HE1  TRP  10           HE1      TRP  10  -4.104   6.470  -1.129
   80    HE3  TRP  10           HE3      TRP  10  -3.757   2.079  -4.086
   81    HZ2  TRP  10           HZ2      TRP  10  -2.000   6.609  -3.058
   82    HZ3  TRP  10           HZ3      TRP  10  -1.846   2.991  -5.367
   83    HH2  TRP  10           HH2      TRP  10  -0.963   5.251  -4.858
   84    H    GLN  11           H        GLN  11  -5.402   0.182   0.308
   85    HA   GLN  11           HA       GLN  11  -2.966   1.126   1.486
   86    HB2  GLN  11           HB2      GLN  11  -5.052   0.383   2.667
   87    HB3  GLN  11           HB3      GLN  11  -4.679  -1.280   2.210
   88    HG2  GLN  11           HG2      GLN  11  -2.307  -0.482   3.332
   89    HG3  GLN  11           HG3      GLN  11  -3.474   0.408   4.310
   90   HE21  GLN  11          HE21      GLN  11  -4.433  -0.763   5.988
   91   HE22  GLN  11          HE22      GLN  11  -4.456  -2.456   6.096
   92    H    ARG  12           H        ARG  12  -3.844  -2.121   0.219
   93    HA   ARG  12           HA       ARG  12  -1.307  -3.375   0.621
   94    HB2  ARG  12           HB2      ARG  12  -3.829  -3.830  -0.776
   95    HB3  ARG  12           HB3      ARG  12  -2.465  -4.459  -1.698
   96    HG2  ARG  12           HG2      ARG  12  -2.203  -6.177  -0.265
   97    HG3  ARG  12           HG3      ARG  12  -2.157  -5.083   1.117
   98    HD2  ARG  12           HD2      ARG  12  -4.717  -4.955   0.914
   99    HD3  ARG  12           HD3      ARG  12  -4.584  -6.354  -0.171
  100    HE   ARG  12           HE       ARG  12  -3.278  -7.455   1.752
  101   HH11  ARG  12          HH11      ARG  12  -3.540  -4.900   3.457
  102   HH12  ARG  12          HH12      ARG  12  -4.808  -5.368   4.539
  103   HH21  ARG  12          HH21      ARG  12  -5.810  -8.082   2.612
  104   HH22  ARG  12          HH22      ARG  12  -6.099  -7.176   4.059
  105    H    TRP  13           H        TRP  13  -2.561  -1.374  -2.026
  106    HA   TRP  13           HA       TRP  13  -0.565  -1.731  -4.004
  107    HB2  TRP  13           HB2      TRP  13  -2.771  -0.073  -3.453
  108    HB3  TRP  13           HB3      TRP  13  -1.422   1.039  -3.649
  109    HD1  TRP  13           HD1      TRP  13  -3.881   0.593  -5.712
  110    HE1  TRP  13           HE1      TRP  13  -3.313   0.057  -8.172
  111    HE3  TRP  13           HE3      TRP  13   0.899  -1.105  -5.160
  112    HZ2  TRP  13           HZ2      TRP  13  -1.117  -0.957  -9.698
  113    HZ3  TRP  13           HZ3      TRP  13   2.207  -1.848  -7.130
  114    HH2  TRP  13           HH2      TRP  13   1.206  -1.774  -9.396
  115    H    GLU  14           H        GLU  14  -0.705   0.681  -1.384
  116    HA   GLU  14           HA       GLU  14   2.000   1.670  -1.867
  117    HB2  GLU  14           HB2      GLU  14   0.125   2.053   0.491
  118    HB3  GLU  14           HB3      GLU  14   1.444   3.119   0.006
  119    HG2  GLU  14           HG2      GLU  14   0.251   3.434  -2.209
  120    HG3  GLU  14           HG3      GLU  14  -1.121   2.570  -1.516
  121    H    ASN  15           H        ASN  15   0.464  -0.646   0.331
  122    HA   ASN  15           HA       ASN  15   2.389  -0.996   2.337
  123    HB2  ASN  15           HB2      ASN  15   0.091  -2.229   1.529
  124    HB3  ASN  15           HB3      ASN  15   1.277  -3.461   1.103
  125   HD21  ASN  15          HD21      ASN  15   3.139  -3.371   3.124
  126   HD22  ASN  15          HD22      ASN  15   2.412  -3.635   4.633
  127    H    TRP  16           H        TRP  16   2.324  -2.584  -0.883
  128    HA   TRP  16           HA       TRP  16   4.908  -3.877  -0.535
  129    HB2  TRP  16           HB2      TRP  16   3.511  -4.932  -2.089
  130    HB3  TRP  16           HB3      TRP  16   2.910  -3.405  -2.734
  131    HD1  TRP  16           HD1      TRP  16   5.973  -5.715  -2.878
  132    HE1  TRP  16           HE1      TRP  16   7.315  -5.168  -5.011
  133    HE3  TRP  16           HE3      TRP  16   3.388  -1.629  -4.529
  134    HZ2  TRP  16           HZ2      TRP  16   7.294  -3.255  -7.136
  135    HZ3  TRP  16           HZ3      TRP  16   4.071  -0.465  -6.606
  136    HH2  TRP  16           HH2      TRP  16   6.019  -1.272  -7.911
  137    H    PHE  17           H        PHE  17   3.770  -0.960  -2.270
  138    HA   PHE  17           HA       PHE  17   6.169  -0.134  -3.493
  139    HB2  PHE  17           HB2      PHE  17   3.821   0.816  -3.682
  140    HB3  PHE  17           HB3      PHE  17   4.108   1.643  -2.151
  141    HD1  PHE  17           HD1      PHE  17   5.235   1.346  -5.675
  142    HD2  PHE  17           HD2      PHE  17   5.512   3.587  -2.021
  143    HE1  PHE  17           HE2      PHE  17   6.419   3.162  -6.878
  144    HE2  PHE  17           HE1      PHE  17   6.697   5.402  -3.224
  145    HZ   PHE  17           HZ       PHE  17   7.150   5.191  -5.653
  146    H    TRP  18           H        TRP  18   4.971   0.709  -0.214
  147    HA   TRP  18           HA       TRP  18   7.351   2.188   0.523
  148    HB2  TRP  18           HB2      TRP  18   5.137   0.865   2.128
  149    HB3  TRP  18           HB3      TRP  18   6.332   1.963   2.814
  150    HD1  TRP  18           HD1      TRP  18   3.006   2.281   2.232
  151    HE1  TRP  18           HE1      TRP  18   2.266   4.531   1.217
  152    HE3  TRP  18           HE3      TRP  18   7.480   3.935   0.397
  153    HZ2  TRP  18           HZ2      TRP  18   3.419   6.739  -0.187
  154    HZ3  TRP  18           HZ3      TRP  18   7.627   6.113  -0.772
  155    HH2  TRP  18           HH2      TRP  18   5.604   7.516  -1.066
  156    H    ASN  19           H        ASN  19   6.272  -1.180   1.019
  157    HA   ASN  19           HA       ASN  19   8.405  -2.010   2.736
  158    HB2  ASN  19           HB2      ASN  19   6.167  -3.139   2.037
  159    HB3  ASN  19           HB3      ASN  19   7.075  -3.749   0.654
  160   HD21  ASN  19          HD21      ASN  19   6.723  -3.967   4.170
  161   HD22  ASN  19          HD22      ASN  19   7.748  -5.307   4.366
  162    H    VAL  20           H        VAL  20   8.069  -2.488  -0.819
  163    HA   VAL  20           HA       VAL  20  10.742  -3.483  -1.187
  164    HB   VAL  20           HB       VAL  20   8.686  -3.739  -2.665
  165   HG11  VAL  20          HG11      VAL  20   9.504  -1.165  -3.974
  166   HG12  VAL  20          HG12      VAL  20   8.398  -1.114  -2.603
  167   HG13  VAL  20          HG13      VAL  20   7.962  -2.018  -4.052
  168   HG21  VAL  20          HG21      VAL  20   9.988  -3.856  -4.706
  169   HG22  VAL  20          HG22      VAL  20  11.034  -4.316  -3.361
  170   HG23  VAL  20          HG23      VAL  20  11.167  -2.706  -4.073
  171    H    THR  21           H        THR  21   9.518  -0.193  -0.928
  172    HA   THR  21           HA       THR  21  11.948   0.958  -2.164
  173    HB   THR  21           HB       THR  21   9.459   2.135  -0.896
  174    HG1  THR  21           HG1      THR  21   8.760   1.567  -2.792
  175   HG21  THR  21          HG21      THR  21  11.788   3.471  -2.298
  176   HG22  THR  21          HG22      THR  21  11.243   3.745  -0.643
  177   HG23  THR  21          HG23      THR  21  10.239   4.260  -1.998
  178    H    LEU  22           H        LEU  22  10.495   0.623   1.058
  179    HA   LEU  22           HA       LEU  22  12.678   2.154   2.329
  180    HB2  LEU  22           HB2      LEU  22  10.314   0.614   3.449
  181    HB3  LEU  22           HB3      LEU  22  11.355   1.690   4.378
  182    HG   LEU  22           HG       LEU  22   9.903   2.656   1.910
  183   HD11  LEU  22          HD11      LEU  22   8.899   2.768   4.771
  184   HD12  LEU  22          HD12      LEU  22   8.249   1.708   3.519
  185   HD13  LEU  22          HD13      LEU  22   8.104   3.458   3.356
  186   HD21  LEU  22          HD21      LEU  22  11.291   3.894   4.282
  187   HD22  LEU  22          HD22      LEU  22  10.086   4.808   3.376
  188   HD23  LEU  22          HD23      LEU  22  11.536   4.217   2.566
  189    H    ARG  23           H        ARG  23  11.548  -1.213   2.167
  190    HA   ARG  23           HA       ARG  23  14.261  -2.160   2.904
  191    HB2  ARG  23           HB2      ARG  23  12.395  -1.724   4.863
  192    HB3  ARG  23           HB3      ARG  23  12.061  -3.405   4.455
  193    HG2  ARG  23           HG2      ARG  23  13.717  -3.565   6.129
  194    HG3  ARG  23           HG3      ARG  23  14.626  -3.746   4.631
  195    HD2  ARG  23           HD2      ARG  23  15.825  -2.163   6.033
  196    HD3  ARG  23           HD3      ARG  23  15.072  -1.236   4.723
  197    HE   ARG  23           HE       ARG  23  13.244  -0.651   6.312
  198   HH11  ARG  23          HH11      ARG  23  13.733  -2.766   8.368
  199   HH12  ARG  23          HH12      ARG  23  14.540  -1.882   9.620
  200   HH21  ARG  23          HH21      ARG  23  15.328   0.812   7.570
  201   HH22  ARG  23          HH22      ARG  23  15.448   0.152   9.166
  202    HA   PRO  24           HA       PRO  24  12.198  -4.804  -0.226
  203    HB2  PRO  24           HB2      PRO  24  14.457  -5.264  -1.701
  204    HB3  PRO  24           HB3      PRO  24  13.441  -3.824  -1.907
  205    HG2  PRO  24           HG2      PRO  24  16.033  -4.124  -0.492
  206    HG3  PRO  24           HG3      PRO  24  15.411  -2.764  -1.438
  207    HD2  PRO  24           HD2      PRO  24  15.450  -2.861   1.310
  208    HD3  PRO  24           HD3      PRO  24  14.347  -1.848   0.354
  209    H    GLU  25           H        GLU  25  12.260  -6.147   1.935
  210    HA   GLU  25           HA       GLU  25  14.450  -8.167   1.989
  211    HB2  GLU  25           HB2      GLU  25  12.217  -7.283   3.819
  212    HB3  GLU  25           HB3      GLU  25  13.055  -8.808   4.105
  213    HG2  GLU  25           HG2      GLU  25  15.231  -7.531   4.048
  214    HG3  GLU  25           HG3      GLU  25  14.287  -6.042   3.996
  215    H    ARG  26           H        ARG  26  10.893  -7.952   1.685
  216    HA   ARG  26           HA       ARG  26  10.858 -10.415   0.062
  217    HB2  ARG  26           HB2      ARG  26  10.808 -10.880   2.647
  218    HB3  ARG  26           HB3      ARG  26   9.137 -10.326   2.535
  219    HG2  ARG  26           HG2      ARG  26   9.591 -12.128   0.369
  220    HG3  ARG  26           HG3      ARG  26  10.206 -12.892   1.834
  221    HD2  ARG  26           HD2      ARG  26   7.891 -13.501   1.739
  222    HD3  ARG  26           HD3      ARG  26   7.962 -12.180   2.923
  223    HE   ARG  26           HE       ARG  26   7.039 -10.683   1.267
  224   HH11  ARG  26          HH11      ARG  26   5.477 -13.346   0.859
  225   HH12  ARG  26          HH12      ARG  26   5.422 -13.402  -0.871
  226   HH21  ARG  26          HH21      ARG  26   7.876 -10.972  -1.287
  227   HH22  ARG  26          HH22      ARG  26   6.787 -12.054  -2.091
  Start of MODEL   26
    1    HA   ARG   1           HA       ARG   1 -16.917   3.533  -4.635
    2    HB2  ARG   1           HB2      ARG   1 -14.386   3.667  -5.700
    3    HB3  ARG   1           HB3      ARG   1 -14.323   2.126  -4.846
    4    HG2  ARG   1           HG2      ARG   1 -16.326   1.355  -6.018
    5    HG3  ARG   1           HG3      ARG   1 -16.486   2.918  -6.818
    6    HD2  ARG   1           HD2      ARG   1 -14.246   2.567  -7.884
    7    HD3  ARG   1           HD3      ARG   1 -14.199   0.945  -7.165
    8    HE   ARG   1           HE       ARG   1 -16.375   0.510  -8.410
    9   HH11  ARG   1          HH11      ARG   1 -16.784   3.316  -9.395
   10   HH12  ARG   1          HH12      ARG   1 -16.196   3.220 -11.022
   11   HH21  ARG   1          HH21      ARG   1 -14.496   0.232 -10.509
   12   HH22  ARG   1          HH22      ARG   1 -14.897   1.467 -11.656
   13    H    SER   2           H        SER   2 -17.934   2.226  -3.166
   14    HA   SER   2           HA       SER   2 -18.302   0.825  -1.306
   15    HB2  SER   2           HB2      SER   2 -16.680  -0.453  -2.846
   16    HB3  SER   2           HB3      SER   2 -15.410   0.029  -1.724
   17    HG   SER   2           HG       SER   2 -16.614  -2.064  -1.388
   18    H    ALA   3           H        ALA   3 -16.151   0.010   0.595
   19    HA   ALA   3           HA       ALA   3 -15.266   2.583   1.792
   20    HB1  ALA   3           HB1      ALA   3 -17.531   2.279   2.613
   21    HB2  ALA   3           HB2      ALA   3 -16.418   1.918   3.933
   22    HB3  ALA   3           HB3      ALA   3 -17.193   0.604   3.047
   23    H    LEU   4           H        LEU   4 -15.579  -0.933   2.524
   24    HA   LEU   4           HA       LEU   4 -12.860  -0.874   3.749
   25    HB2  LEU   4           HB2      LEU   4 -15.088  -1.828   4.760
   26    HB3  LEU   4           HB3      LEU   4 -14.753  -3.214   3.722
   27    HG   LEU   4           HG       LEU   4 -12.301  -2.841   4.849
   28   HD11  LEU   4          HD11      LEU   4 -12.629  -2.410   7.250
   29   HD12  LEU   4          HD12      LEU   4 -14.350  -2.137   6.975
   30   HD13  LEU   4          HD13      LEU   4 -13.162  -1.023   6.299
   31   HD21  LEU   4          HD21      LEU   4 -14.565  -4.408   6.127
   32   HD22  LEU   4          HD22      LEU   4 -12.841  -4.760   6.245
   33   HD23  LEU   4          HD23      LEU   4 -13.673  -4.939   4.701
   34    H    VAL   5           H        VAL   5 -14.029  -1.375   0.697
   35    HA   VAL   5           HA       VAL   5 -12.321  -3.753   0.116
   36    HB   VAL   5           HB       VAL   5 -14.350  -2.203  -1.538
   37   HG11  VAL   5          HG11      VAL   5 -14.223  -4.359  -2.941
   38   HG12  VAL   5          HG12      VAL   5 -12.715  -4.685  -2.086
   39   HG13  VAL   5          HG13      VAL   5 -12.869  -3.238  -3.082
   40   HG21  VAL   5          HG21      VAL   5 -15.611  -4.444  -1.209
   41   HG22  VAL   5          HG22      VAL   5 -15.555  -3.335   0.162
   42   HG23  VAL   5          HG23      VAL   5 -14.479  -4.732   0.112
   43    H    ASN   6           H        ASN   6 -12.955  -0.507  -1.300
   44    HA   ASN   6           HA       ASN   6 -10.582  -0.449  -2.924
   45    HB2  ASN   6           HB2      ASN   6 -12.875   1.134  -2.380
   46    HB3  ASN   6           HB3      ASN   6 -11.477   2.172  -2.102
   47   HD21  ASN   6          HD21      ASN   6 -12.895  -0.042  -4.554
   48   HD22  ASN   6          HD22      ASN   6 -12.163   0.721  -5.883
   49    H    SER   7           H        SER   7 -11.232   0.609   0.417
   50    HA   SER   7           HA       SER   7  -8.895   2.136   0.922
   51    HB2  SER   7           HB2      SER   7 -10.630   0.304   2.592
   52    HB3  SER   7           HB3      SER   7  -9.300   1.215   3.303
   53    HG   SER   7           HG       SER   7 -11.750   2.051   2.721
   54    H    TYR   8           H        TYR   8  -9.425  -1.389   1.285
   55    HA   TYR   8           HA       TYR   8  -6.682  -1.981   2.023
   56    HB2  TYR   8           HB2      TYR   8  -8.322  -3.551   2.684
   57    HB3  TYR   8           HB3      TYR   8  -9.119  -3.515   1.112
   58    HD1  TYR   8           HD1      TYR   8  -5.865  -4.456   2.722
   59    HD2  TYR   8           HD2      TYR   8  -8.642  -5.171  -0.477
   60    HE1  TYR   8           HE1      TYR   8  -4.507  -6.393   1.975
   61    HE2  TYR   8           HE2      TYR   8  -7.287  -7.110  -1.221
   62    HH   TYR   8           HH       TYR   8  -5.169  -8.660   0.549
   63    H    LEU   9           H        LEU   9  -8.530  -2.013  -1.031
   64    HA   LEU   9           HA       LEU   9  -6.592  -3.189  -2.744
   65    HB2  LEU   9           HB2      LEU   9  -8.876  -1.257  -2.997
   66    HB3  LEU   9           HB3      LEU   9  -7.842  -1.508  -4.399
   67    HG   LEU   9           HG       LEU   9  -9.152  -3.763  -2.854
   68   HD11  LEU   9          HD11      LEU   9 -10.001  -2.723  -5.561
   69   HD12  LEU   9          HD12      LEU   9 -10.720  -2.115  -4.070
   70   HD13  LEU   9          HD13      LEU   9 -10.871  -3.821  -4.490
   71   HD21  LEU   9          HD21      LEU   9  -7.319  -4.665  -4.022
   72   HD22  LEU   9          HD22      LEU   9  -7.504  -3.543  -5.370
   73   HD23  LEU   9          HD23      LEU   9  -8.643  -4.874  -5.168
   74    H    TRP  10           H        TRP  10  -7.082   0.249  -1.866
   75    HA   TRP  10           HA       TRP  10  -4.799   1.201  -3.401
   76    HB2  TRP  10           HB2      TRP  10  -6.499   2.780  -3.021
   77    HB3  TRP  10           HB3      TRP  10  -6.723   2.280  -1.346
   78    HD1  TRP  10           HD1      TRP  10  -4.217   4.190  -3.563
   79    HE1  TRP  10           HE1      TRP  10  -2.893   5.823  -2.071
   80    HE3  TRP  10           HE3      TRP  10  -6.027   2.861   1.023
   81    HZ2  TRP  10           HZ2      TRP  10  -2.636   6.477   0.701
   82    HZ3  TRP  10           HZ3      TRP  10  -5.225   4.001   3.070
   83    HH2  TRP  10           HH2      TRP  10  -3.533   5.807   2.915
   84    H    GLN  11           H        GLN  11  -5.389   0.658   0.106
   85    HA   GLN  11           HA       GLN  11  -2.839   1.422   1.080
   86    HB2  GLN  11           HB2      GLN  11  -5.025   0.788   2.291
   87    HB3  GLN  11           HB3      GLN  11  -4.493  -0.885   2.129
   88    HG2  GLN  11           HG2      GLN  11  -3.592  -0.350   4.203
   89    HG3  GLN  11           HG3      GLN  11  -2.241   0.063   3.148
   90   HE21  GLN  11          HE21      GLN  11  -1.574   2.258   3.099
   91   HE22  GLN  11          HE22      GLN  11  -2.375   3.504   3.927
   92    H    ARG  12           H        ARG  12  -3.938  -1.730  -0.194
   93    HA   ARG  12           HA       ARG  12  -1.587  -3.248   0.381
   94    HB2  ARG  12           HB2      ARG  12  -3.946  -3.929  -0.429
   95    HB3  ARG  12           HB3      ARG  12  -3.353  -3.570  -2.051
   96    HG2  ARG  12           HG2      ARG  12  -1.481  -5.215  -0.514
   97    HG3  ARG  12           HG3      ARG  12  -3.054  -5.988  -0.712
   98    HD2  ARG  12           HD2      ARG  12  -1.618  -4.718  -3.056
   99    HD3  ARG  12           HD3      ARG  12  -1.346  -6.409  -2.591
  100    HE   ARG  12           HE       ARG  12  -4.078  -5.335  -3.205
  101   HH11  ARG  12          HH11      ARG  12  -2.618  -6.648  -5.447
  102   HH12  ARG  12          HH12      ARG  12  -3.156  -8.290  -5.332
  103   HH21  ARG  12          HH21      ARG  12  -4.358  -7.937  -2.084
  104   HH22  ARG  12          HH22      ARG  12  -4.148  -9.023  -3.416
  105    H    TRP  13           H        TRP  13  -2.420  -1.173  -2.407
  106    HA   TRP  13           HA       TRP  13  -0.133  -1.856  -4.019
  107    HB2  TRP  13           HB2      TRP  13  -1.396  -0.608  -5.427
  108    HB3  TRP  13           HB3      TRP  13  -2.439  -0.157  -4.087
  109    HD1  TRP  13           HD1      TRP  13  -2.578   2.325  -3.653
  110    HE1  TRP  13           HE1      TRP  13  -1.105   4.384  -4.142
  111    HE3  TRP  13           HE3      TRP  13   1.466   0.040  -5.774
  112    HZ2  TRP  13           HZ2      TRP  13   1.450   4.983  -5.277
  113    HZ3  TRP  13           HZ3      TRP  13   3.403   1.377  -6.550
  114    HH2  TRP  13           HH2      TRP  13   3.400   3.843  -6.304
  115    H    GLU  14           H        GLU  14  -0.727   0.849  -1.739
  116    HA   GLU  14           HA       GLU  14   1.937   1.958  -1.962
  117    HB2  GLU  14           HB2      GLU  14  -0.420   2.205  -0.105
  118    HB3  GLU  14           HB3      GLU  14   1.105   2.990   0.308
  119    HG2  GLU  14           HG2      GLU  14   0.827   3.669  -2.340
  120    HG3  GLU  14           HG3      GLU  14  -0.848   3.675  -1.789
  121    H    ASN  15           H        ASN  15   0.455  -0.530   0.082
  122    HA   ASN  15           HA       ASN  15   2.407  -0.769   2.126
  123    HB2  ASN  15           HB2      ASN  15   0.160  -1.964   1.817
  124    HB3  ASN  15           HB3      ASN  15   0.997  -3.055   0.714
  125   HD21  ASN  15          HD21      ASN  15   2.957  -4.232   1.683
  126   HD22  ASN  15          HD22      ASN  15   2.911  -4.618   3.335
  127    H    TRP  16           H        TRP  16   2.265  -2.382  -1.076
  128    HA   TRP  16           HA       TRP  16   4.871  -3.635  -0.839
  129    HB2  TRP  16           HB2      TRP  16   3.349  -4.622  -2.353
  130    HB3  TRP  16           HB3      TRP  16   2.858  -3.065  -3.018
  131    HD1  TRP  16           HD1      TRP  16   5.662  -5.657  -3.186
  132    HE1  TRP  16           HE1      TRP  16   7.097  -5.196  -5.276
  133    HE3  TRP  16           HE3      TRP  16   3.593  -1.244  -4.723
  134    HZ2  TRP  16           HZ2      TRP  16   7.328  -3.227  -7.335
  135    HZ3  TRP  16           HZ3      TRP  16   4.442  -0.103  -6.754
  136    HH2  TRP  16           HH2      TRP  16   6.304  -1.088  -8.057
  137    H    PHE  17           H        PHE  17   3.663  -0.653  -2.390
  138    HA   PHE  17           HA       PHE  17   5.996   0.244  -3.694
  139    HB2  PHE  17           HB2      PHE  17   3.681   1.196  -3.788
  140    HB3  PHE  17           HB3      PHE  17   3.924   1.866  -2.177
  141    HD1  PHE  17           HD1      PHE  17   5.959   1.683  -5.337
  142    HD2  PHE  17           HD2      PHE  17   4.380   4.143  -2.188
  143    HE1  PHE  17           HE1      PHE  17   7.071   3.665  -6.326
  144    HE2  PHE  17           HE2      PHE  17   5.493   6.125  -3.178
  145    HZ   PHE  17           HZ       PHE  17   6.838   5.887  -5.248
  146    H    TRP  18           H        TRP  18   5.160   0.385  -0.247
  147    HA   TRP  18           HA       TRP  18   7.658   1.922   0.313
  148    HB2  TRP  18           HB2      TRP  18   5.146   1.268   1.873
  149    HB3  TRP  18           HB3      TRP  18   6.534   2.077   2.600
  150    HD1  TRP  18           HD1      TRP  18   3.392   3.005   1.320
  151    HE1  TRP  18           HE1      TRP  18   3.374   5.348   0.244
  152    HE3  TRP  18           HE3      TRP  18   8.411   3.735   0.727
  153    HZ2  TRP  18           HZ2      TRP  18   5.245   7.278  -0.733
  154    HZ3  TRP  18           HZ3      TRP  18   9.265   5.833  -0.277
  155    HH2  TRP  18           HH2      TRP  18   7.690   7.604  -1.006
  156    H    ASN  19           H        ASN  19   5.968  -1.091   1.304
  157    HA   ASN  19           HA       ASN  19   7.873  -2.036   3.182
  158    HB2  ASN  19           HB2      ASN  19   5.548  -2.905   2.578
  159    HB3  ASN  19           HB3      ASN  19   6.314  -3.740   1.225
  160   HD21  ASN  19          HD21      ASN  19   7.597  -5.618   1.695
  161   HD22  ASN  19          HD22      ASN  19   7.728  -6.270   3.255
  162    H    VAL  20           H        VAL  20   7.852  -2.369  -0.377
  163    HA   VAL  20           HA       VAL  20  10.073  -4.196  -0.560
  164    HB   VAL  20           HB       VAL  20   8.987  -2.091  -2.467
  165   HG11  VAL  20          HG11      VAL  20  11.262  -2.850  -3.097
  166   HG12  VAL  20          HG12      VAL  20  10.048  -3.428  -4.238
  167   HG13  VAL  20          HG13      VAL  20  10.713  -4.525  -3.027
  168   HG21  VAL  20          HG21      VAL  20   7.352  -3.564  -3.008
  169   HG22  VAL  20          HG22      VAL  20   7.725  -4.326  -1.462
  170   HG23  VAL  20          HG23      VAL  20   8.448  -4.944  -2.947
  171    H    THR  21           H        THR  21   9.876  -0.663  -0.320
  172    HA   THR  21           HA       THR  21  12.800  -0.364  -0.718
  173    HB   THR  21           HB       THR  21  10.857   1.821   0.006
  174    HG1  THR  21           HG1      THR  21   9.802   1.522  -1.769
  175   HG21  THR  21          HG21      THR  21  13.359   2.179  -0.309
  176   HG22  THR  21          HG22      THR  21  12.313   3.188  -1.308
  177   HG23  THR  21          HG23      THR  21  13.111   1.780  -2.008
  178    H    LEU  22           H        LEU  22  10.471  -0.482   1.885
  179    HA   LEU  22           HA       LEU  22  12.373   0.703   3.838
  180    HB2  LEU  22           HB2      LEU  22   9.521  -0.304   4.019
  181    HB3  LEU  22           HB3      LEU  22  10.386   0.466   5.348
  182    HG   LEU  22           HG       LEU  22   9.993   1.792   2.649
  183   HD11  LEU  22          HD11      LEU  22   8.411   2.340   5.170
  184   HD12  LEU  22          HD12      LEU  22   7.832   1.259   3.903
  185   HD13  LEU  22          HD13      LEU  22   8.114   2.962   3.547
  186   HD21  LEU  22          HD21      LEU  22  10.452   3.841   4.072
  187   HD22  LEU  22          HD22      LEU  22  11.822   2.744   3.900
  188   HD23  LEU  22          HD23      LEU  22  10.876   2.746   5.388
  189    H    ARG  23           H        ARG  23  11.822  -2.352   2.558
  190    HA   ARG  23           HA       ARG  23  11.725  -4.160   4.703
  191    HB2  ARG  23           HB2      ARG  23  12.533  -4.102   1.908
  192    HB3  ARG  23           HB3      ARG  23  13.536  -5.222   2.831
  193    HG2  ARG  23           HG2      ARG  23  11.693  -6.518   3.502
  194    HG3  ARG  23           HG3      ARG  23  10.540  -5.229   3.152
  195    HD2  ARG  23           HD2      ARG  23  10.316  -5.905   0.995
  196    HD3  ARG  23           HD3      ARG  23  12.074  -6.016   0.778
  197    HE   ARG  23           HE       ARG  23  11.994  -8.257   1.811
  198   HH11  ARG  23          HH11      ARG  23  10.227  -8.615  -0.522
  199   HH12  ARG  23          HH12      ARG  23   8.781  -9.264   0.173
  200   HH21  ARG  23          HH21      ARG  23   9.592  -8.295   3.412
  201   HH22  ARG  23          HH22      ARG  23   8.420  -9.083   2.410
  202    HA   PRO  24           HA       PRO  24  16.481  -3.953   5.182
  203    HB2  PRO  24           HB2      PRO  24  17.860  -1.970   3.893
  204    HB3  PRO  24           HB3      PRO  24  17.541  -3.557   3.165
  205    HG2  PRO  24           HG2      PRO  24  16.191  -0.954   2.698
  206    HG3  PRO  24           HG3      PRO  24  16.552  -2.262   1.562
  207    HD2  PRO  24           HD2      PRO  24  14.080  -1.803   2.667
  208    HD3  PRO  24           HD3      PRO  24  14.623  -3.372   2.036
  209    H    GLU  25           H        GLU  25  15.383  -3.109   7.175
  210    HA   GLU  25           HA       GLU  25  16.422  -0.418   7.899
  211    HB2  GLU  25           HB2      GLU  25  13.805  -0.846   7.063
  212    HB3  GLU  25           HB3      GLU  25  13.672  -0.890   8.820
  213    HG2  GLU  25           HG2      GLU  25  14.570   1.292   9.056
  214    HG3  GLU  25           HG3      GLU  25  15.200   1.298   7.408
  215    H    ARG  26           H        ARG  26  17.846  -2.042   9.088
  216    HA   ARG  26           HA       ARG  26  18.500  -3.122  11.076
  217    HB2  ARG  26           HB2      ARG  26  16.140  -1.464  12.032
  218    HB3  ARG  26           HB3      ARG  26  17.322  -2.219  13.098
  219    HG2  ARG  26           HG2      ARG  26  18.678  -0.445  12.833
  220    HG3  ARG  26           HG3      ARG  26  18.778  -0.794  11.107
  221    HD2  ARG  26           HD2      ARG  26  16.365   0.396  11.122
  222    HD3  ARG  26           HD3      ARG  26  17.075   1.201  12.535
  223    HE   ARG  26           HE       ARG  26  19.101   1.275  10.631
  224   HH11  ARG  26          HH11      ARG  26  17.006   1.376   8.541
  225   HH12  ARG  26          HH12      ARG  26  16.660   3.068   8.422
  226   HH21  ARG  26          HH21      ARG  26  18.150   3.855  11.461
  227   HH22  ARG  26          HH22      ARG  26  17.307   4.475  10.080
  Start of MODEL   27
    1    HA   ARG   1           HA       ARG   1 -18.947   1.062  -5.802
    2    HB2  ARG   1           HB2      ARG   1 -20.323  -0.344  -7.503
    3    HB3  ARG   1           HB3      ARG   1 -20.675  -1.400  -6.134
    4    HG2  ARG   1           HG2      ARG   1 -21.927   0.215  -5.031
    5    HG3  ARG   1           HG3      ARG   1 -21.073   1.551  -5.802
    6    HD2  ARG   1           HD2      ARG   1 -23.199   1.553  -6.866
    7    HD3  ARG   1           HD3      ARG   1 -22.167   0.675  -8.012
    8    HE   ARG   1           HE       ARG   1 -23.279  -1.151  -6.074
    9   HH11  ARG   1          HH11      ARG   1 -23.150  -1.908  -8.899
   10   HH12  ARG   1          HH12      ARG   1 -24.796  -1.798  -9.423
   11   HH21  ARG   1          HH21      ARG   1 -25.800   0.140  -6.715
   12   HH22  ARG   1          HH22      ARG   1 -26.304  -0.634  -8.181
   13    H    SER   2           H        SER   2 -17.108   0.124  -4.144
   14    HA   SER   2           HA       SER   2 -18.644  -0.955  -1.825
   15    HB2  SER   2           HB2      SER   2 -16.055  -2.065  -2.953
   16    HB3  SER   2           HB3      SER   2 -16.787  -2.582  -1.438
   17    HG   SER   2           HG       SER   2 -18.396  -3.527  -2.525
   18    H    ALA   3           H        ALA   3 -17.527  -0.545   0.231
   19    HA   ALA   3           HA       ALA   3 -15.768   1.859   0.104
   20    HB1  ALA   3           HB1      ALA   3 -17.810   2.018   1.418
   21    HB2  ALA   3           HB2      ALA   3 -16.440   1.999   2.528
   22    HB3  ALA   3           HB3      ALA   3 -17.405   0.542   2.294
   23    H    LEU   4           H        LEU   4 -15.866  -1.470   1.355
   24    HA   LEU   4           HA       LEU   4 -13.226  -1.199   2.652
   25    HB2  LEU   4           HB2      LEU   4 -15.356  -2.546   3.374
   26    HB3  LEU   4           HB3      LEU   4 -14.769  -3.751   2.229
   27    HG   LEU   4           HG       LEU   4 -12.469  -3.225   3.565
   28   HD11  LEU   4          HD11      LEU   4 -12.848  -2.851   5.881
   29   HD12  LEU   4          HD12      LEU   4 -14.582  -3.137   5.724
   30   HD13  LEU   4          HD13      LEU   4 -13.868  -1.666   5.064
   31   HD21  LEU   4          HD21      LEU   4 -14.621  -5.144   4.517
   32   HD22  LEU   4          HD22      LEU   4 -12.885  -5.307   4.779
   33   HD23  LEU   4          HD23      LEU   4 -13.547  -5.442   3.150
   34    H    VAL   5           H        VAL   5 -13.989  -1.414  -0.519
   35    HA   VAL   5           HA       VAL   5 -12.049  -3.565  -1.209
   36    HB   VAL   5           HB       VAL   5 -14.054  -1.904  -2.769
   37   HG11  VAL   5          HG11      VAL   5 -12.346  -2.291  -4.357
   38   HG12  VAL   5          HG12      VAL   5 -13.460  -3.634  -4.606
   39   HG13  VAL   5          HG13      VAL   5 -11.970  -3.882  -3.696
   40   HG21  VAL   5          HG21      VAL   5 -15.147  -4.118  -3.059
   41   HG22  VAL   5          HG22      VAL   5 -15.004  -3.681  -1.356
   42   HG23  VAL   5          HG23      VAL   5 -13.892  -4.854  -2.063
   43    H    ASN   6           H        ASN   6 -12.632  -0.083  -1.870
   44    HA   ASN   6           HA       ASN   6 -10.240   0.383  -3.378
   45    HB2  ASN   6           HB2      ASN   6 -12.347   1.816  -3.108
   46    HB3  ASN   6           HB3      ASN   6 -11.668   2.350  -1.570
   47   HD21  ASN   6          HD21      ASN   6 -11.044   2.324  -5.097
   48   HD22  ASN   6          HD22      ASN   6  -9.962   3.632  -5.074
   49    H    SER   7           H        SER   7 -10.897   0.658   0.141
   50    HA   SER   7           HA       SER   7  -8.406   1.779   0.943
   51    HB2  SER   7           HB2      SER   7 -10.529   1.379   2.294
   52    HB3  SER   7           HB3      SER   7 -10.037  -0.308   2.425
   53    HG   SER   7           HG       SER   7  -9.152   0.624   4.179
   54    H    TYR   8           H        TYR   8  -9.359  -1.634   0.469
   55    HA   TYR   8           HA       TYR   8  -6.772  -2.726   1.213
   56    HB2  TYR   8           HB2      TYR   8  -8.692  -4.128   1.390
   57    HB3  TYR   8           HB3      TYR   8  -9.251  -3.705  -0.226
   58    HD1  TYR   8           HD1      TYR   8  -6.473  -5.423   1.593
   59    HD2  TYR   8           HD2      TYR   8  -8.645  -5.014  -2.088
   60    HE1  TYR   8           HE2      TYR   8  -5.251  -7.365   0.656
   61    HE2  TYR   8           HE1      TYR   8  -7.422  -6.956  -3.027
   62    HH   TYR   8           HH       TYR   8  -4.667  -8.094  -1.925
   63    H    LEU   9           H        LEU   9  -8.340  -1.845  -1.866
   64    HA   LEU   9           HA       LEU   9  -6.223  -2.811  -3.585
   65    HB2  LEU   9           HB2      LEU   9  -8.769  -1.389  -3.726
   66    HB3  LEU   9           HB3      LEU   9  -7.609  -0.755  -4.888
   67    HG   LEU   9           HG       LEU   9  -8.900  -2.591  -5.889
   68   HD11  LEU   9          HD11      LEU   9  -6.406  -2.248  -6.364
   69   HD12  LEU   9          HD12      LEU   9  -7.066  -3.831  -6.771
   70   HD13  LEU   9          HD13      LEU   9  -6.120  -3.623  -5.298
   71   HD21  LEU   9          HD21      LEU   9  -9.086  -3.691  -3.483
   72   HD22  LEU   9          HD22      LEU   9  -7.637  -4.552  -4.005
   73   HD23  LEU   9          HD23      LEU   9  -9.130  -4.695  -4.933
   74    H    TRP  10           H        TRP  10  -6.664   0.139  -1.740
   75    HA   TRP  10           HA       TRP  10  -4.451   1.481  -3.228
   76    HB2  TRP  10           HB2      TRP  10  -6.594   2.660  -2.939
   77    HB3  TRP  10           HB3      TRP  10  -6.480   2.460  -1.192
   78    HD1  TRP  10           HD1      TRP  10  -3.815   3.653  -3.743
   79    HE1  TRP  10           HE1      TRP  10  -2.895   5.921  -2.929
   80    HE3  TRP  10           HE3      TRP  10  -6.736   4.358   0.386
   81    HZ2  TRP  10           HZ2      TRP  10  -3.342   7.786  -0.807
   82    HZ3  TRP  10           HZ3      TRP  10  -6.469   6.386   1.784
   83    HH2  TRP  10           HH2      TRP  10  -4.777   8.101   1.193
   84    H    GLN  11           H        GLN  11  -5.472   0.954   0.195
   85    HA   GLN  11           HA       GLN  11  -3.002   1.783   1.371
   86    HB2  GLN  11           HB2      GLN  11  -5.393   1.295   2.344
   87    HB3  GLN  11           HB3      GLN  11  -4.772  -0.341   2.558
   88    HG2  GLN  11           HG2      GLN  11  -2.753   0.751   3.718
   89    HG3  GLN  11           HG3      GLN  11  -3.728   2.220   3.774
   90   HE21  GLN  11          HE21      GLN  11  -3.350  -1.006   5.135
   91   HE22  GLN  11          HE22      GLN  11  -4.568  -0.856   6.308
   92    H    ARG  12           H        ARG  12  -4.168  -1.544   0.620
   93    HA   ARG  12           HA       ARG  12  -1.826  -2.924   1.507
   94    HB2  ARG  12           HB2      ARG  12  -4.217  -3.717   0.765
   95    HB3  ARG  12           HB3      ARG  12  -3.496  -3.802  -0.843
   96    HG2  ARG  12           HG2      ARG  12  -2.792  -5.869  -0.247
   97    HG3  ARG  12           HG3      ARG  12  -1.595  -5.041   0.746
   98    HD2  ARG  12           HD2      ARG  12  -4.345  -5.452   1.885
   99    HD3  ARG  12           HD3      ARG  12  -3.217  -6.823   1.853
  100    HE   ARG  12           HE       ARG  12  -2.575  -4.187   3.130
  101   HH11  ARG  12          HH11      ARG  12  -3.335  -6.269   5.033
  102   HH12  ARG  12          HH12      ARG  12  -1.835  -7.046   5.417
  103   HH21  ARG  12          HH21      ARG  12  -0.160  -5.761   2.654
  104   HH22  ARG  12          HH22      ARG  12  -0.030  -6.752   4.068
  105    H    TRP  13           H        TRP  13  -2.646  -1.484  -1.655
  106    HA   TRP  13           HA       TRP  13  -0.377  -2.474  -3.103
  107    HB2  TRP  13           HB2      TRP  13  -1.637  -1.491  -4.708
  108    HB3  TRP  13           HB3      TRP  13  -2.646  -0.764  -3.469
  109    HD1  TRP  13           HD1      TRP  13  -2.725   1.754  -3.529
  110    HE1  TRP  13           HE1      TRP  13  -1.215   3.645  -4.413
  111    HE3  TRP  13           HE3      TRP  13   1.236  -0.991  -5.199
  112    HZ2  TRP  13           HZ2      TRP  13   1.336   3.952  -5.668
  113    HZ3  TRP  13           HZ3      TRP  13   3.193   0.122  -6.236
  114    HH2  TRP  13           HH2      TRP  13   3.248   2.589  -6.472
  115    H    GLU  14           H        GLU  14  -0.880   0.552  -1.254
  116    HA   GLU  14           HA       GLU  14   1.754   1.630  -1.777
  117    HB2  GLU  14           HB2      GLU  14  -0.415   2.100   0.279
  118    HB3  GLU  14           HB3      GLU  14   1.079   3.038   0.270
  119    HG2  GLU  14           HG2      GLU  14   0.633   3.661  -2.105
  120    HG3  GLU  14           HG3      GLU  14  -0.906   2.808  -2.009
  121    H    ASN  15           H        ASN  15   0.366  -0.201   0.982
  122    HA   ASN  15           HA       ASN  15   2.605  -0.230   2.700
  123    HB2  ASN  15           HB2      ASN  15   0.115  -1.330   2.670
  124    HB3  ASN  15           HB3      ASN  15   1.090  -2.768   2.367
  125   HD21  ASN  15          HD21      ASN  15   3.412  -2.120   3.920
  126   HD22  ASN  15          HD22      ASN  15   2.964  -2.054   5.554
  127    H    TRP  16           H        TRP  16   1.866  -2.369  -0.071
  128    HA   TRP  16           HA       TRP  16   4.285  -3.967   0.208
  129    HB2  TRP  16           HB2      TRP  16   2.505  -5.000  -0.952
  130    HB3  TRP  16           HB3      TRP  16   2.126  -3.536  -1.860
  131    HD1  TRP  16           HD1      TRP  16   4.805  -6.294  -1.660
  132    HE1  TRP  16           HE1      TRP  16   5.970  -6.466  -3.953
  133    HE3  TRP  16           HE3      TRP  16   2.581  -2.380  -4.072
  134    HZ2  TRP  16           HZ2      TRP  16   5.959  -5.120  -6.477
  135    HZ3  TRP  16           HZ3      TRP  16   3.177  -1.848  -6.417
  136    HH2  TRP  16           HH2      TRP  16   4.861  -3.211  -7.622
  137    H    PHE  17           H        PHE  17   3.281  -1.216  -1.844
  138    HA   PHE  17           HA       PHE  17   5.599  -0.935  -3.445
  139    HB2  PHE  17           HB2      PHE  17   3.509   0.277  -3.805
  140    HB3  PHE  17           HB3      PHE  17   3.678   1.099  -2.256
  141    HD1  PHE  17           HD1      PHE  17   5.428   0.610  -5.531
  142    HD2  PHE  17           HD2      PHE  17   4.798   3.158  -2.130
  143    HE1  PHE  17           HE1      PHE  17   6.760   2.394  -6.619
  144    HE2  PHE  17           HE2      PHE  17   6.130   4.943  -3.220
  145    HZ   PHE  17           HZ       PHE  17   7.111   4.561  -5.466
  146    H    TRP  18           H        TRP  18   4.834   0.731  -0.354
  147    HA   TRP  18           HA       TRP  18   7.349   2.030  -0.006
  148    HB2  TRP  18           HB2      TRP  18   5.275   0.982   1.950
  149    HB3  TRP  18           HB3      TRP  18   6.598   2.048   2.416
  150    HD1  TRP  18           HD1      TRP  18   3.170   2.394   1.868
  151    HE1  TRP  18           HE1      TRP  18   2.501   4.657   0.830
  152    HE3  TRP  18           HE3      TRP  18   7.713   3.937   0.111
  153    HZ2  TRP  18           HZ2      TRP  18   3.730   6.833  -0.558
  154    HZ3  TRP  18           HZ3      TRP  18   7.933   6.108  -1.062
  155    HH2  TRP  18           HH2      TRP  18   5.950   7.556  -1.398
  156    H    ASN  19           H        ASN  19   6.288  -1.262   0.753
  157    HA   ASN  19           HA       ASN  19   8.442  -2.084   2.438
  158    HB2  ASN  19           HB2      ASN  19   6.127  -3.142   1.458
  159    HB3  ASN  19           HB3      ASN  19   7.311  -4.021   0.493
  160   HD21  ASN  19          HD21      ASN  19   8.360  -5.762   1.507
  161   HD22  ASN  19          HD22      ASN  19   8.283  -6.086   3.172
  162    H    VAL  20           H        VAL  20   8.173  -1.938  -1.119
  163    HA   VAL  20           HA       VAL  20  11.006  -2.908  -1.320
  164    HB   VAL  20           HB       VAL  20  10.351  -3.438  -3.675
  165   HG11  VAL  20          HG11      VAL  20   9.228  -5.416  -3.118
  166   HG12  VAL  20          HG12      VAL  20   8.270  -4.633  -1.861
  167   HG13  VAL  20          HG13      VAL  20   9.980  -4.968  -1.587
  168   HG21  VAL  20          HG21      VAL  20   8.486  -1.605  -3.585
  169   HG22  VAL  20          HG22      VAL  20   7.496  -2.885  -2.886
  170   HG23  VAL  20          HG23      VAL  20   8.180  -3.082  -4.498
  171    H    THR  21           H        THR  21   9.508   0.001  -1.129
  172    HA   THR  21           HA       THR  21  11.232   1.246  -3.244
  173    HB   THR  21           HB       THR  21   8.600   2.154  -2.037
  174    HG1  THR  21           HG1      THR  21   7.997   0.716  -3.474
  175   HG21  THR  21          HG21      THR  21   9.334   4.196  -2.698
  176   HG22  THR  21          HG22      THR  21   9.009   3.611  -4.330
  177   HG23  THR  21          HG23      THR  21  10.640   3.514  -3.667
  178    H    LEU  22           H        LEU  22  10.172   1.424   0.131
  179    HA   LEU  22           HA       LEU  22  11.357   3.915   0.850
  180    HB2  LEU  22           HB2      LEU  22  10.612   1.370   2.265
  181    HB3  LEU  22           HB3      LEU  22  11.464   2.632   3.151
  182    HG   LEU  22           HG       LEU  22   8.877   3.042   1.617
  183   HD11  LEU  22          HD11      LEU  22   8.355   1.719   3.534
  184   HD12  LEU  22          HD12      LEU  22   7.992   3.382   3.998
  185   HD13  LEU  22          HD13      LEU  22   9.482   2.616   4.552
  186   HD21  LEU  22          HD21      LEU  22  10.628   4.828   3.321
  187   HD22  LEU  22          HD22      LEU  22   8.926   5.192   3.041
  188   HD23  LEU  22          HD23      LEU  22  10.046   5.116   1.681
  189    H    ARG  23           H        ARG  23  12.742   0.648   0.722
  190    HA   ARG  23           HA       ARG  23  15.279   1.353   1.920
  191    HB2  ARG  23           HB2      ARG  23  13.973  -0.946   0.616
  192    HB3  ARG  23           HB3      ARG  23  15.719  -0.894   0.381
  193    HG2  ARG  23           HG2      ARG  23  15.584  -2.037   2.401
  194    HG3  ARG  23           HG3      ARG  23  15.751  -0.376   2.968
  195    HD2  ARG  23           HD2      ARG  23  13.562  -0.261   3.701
  196    HD3  ARG  23           HD3      ARG  23  12.976  -1.364   2.440
  197    HE   ARG  23           HE       ARG  23  13.754  -3.239   3.758
  198   HH11  ARG  23          HH11      ARG  23  12.363  -1.805   5.942
  199   HH12  ARG  23          HH12      ARG  23  13.578  -1.704   7.174
  200   HH21  ARG  23          HH21      ARG  23  16.206  -2.392   5.002
  201   HH22  ARG  23          HH22      ARG  23  15.762  -2.037   6.638
  202    HA   PRO  24           HA       PRO  24  17.009   1.548  -2.519
  203    HB2  PRO  24           HB2      PRO  24  15.308   1.311  -4.648
  204    HB3  PRO  24           HB3      PRO  24  16.087  -0.083  -3.872
  205    HG2  PRO  24           HG2      PRO  24  13.311   0.934  -3.586
  206    HG3  PRO  24           HG3      PRO  24  13.909  -0.731  -3.606
  207    HD2  PRO  24           HD2      PRO  24  13.206   0.625  -1.331
  208    HD3  PRO  24           HD3      PRO  24  14.348  -0.734  -1.371
  209    H    GLU  25           H        GLU  25  17.290   3.780  -2.112
  210    HA   GLU  25           HA       GLU  25  15.313   5.609  -3.434
  211    HB2  GLU  25           HB2      GLU  25  15.672   5.273  -0.698
  212    HB3  GLU  25           HB3      GLU  25  16.679   6.676  -1.058
  213    HG2  GLU  25           HG2      GLU  25  13.926   6.560  -2.234
  214    HG3  GLU  25           HG3      GLU  25  14.094   6.967  -0.527
  215    H    ARG  26           H        ARG  26  16.490   6.459  -5.134
  216    HA   ARG  26           HA       ARG  26  19.147   7.671  -4.527
  217    HB2  ARG  26           HB2      ARG  26  18.532   5.322  -6.215
  218    HB3  ARG  26           HB3      ARG  26  19.579   6.518  -6.977
  219    HG2  ARG  26           HG2      ARG  26  20.139   5.641  -4.156
  220    HG3  ARG  26           HG3      ARG  26  20.643   4.621  -5.502
  221    HD2  ARG  26           HD2      ARG  26  22.532   5.963  -5.329
  222    HD3  ARG  26           HD3      ARG  26  21.571   6.984  -6.417
  223    HE   ARG  26           HE       ARG  26  21.110   7.390  -3.524
  224   HH11  ARG  26          HH11      ARG  26  20.354   9.480  -5.459
  225   HH12  ARG  26          HH12      ARG  26  21.672  10.601  -5.360
  226   HH21  ARG  26          HH21      ARG  26  23.820   8.346  -3.816
  227   HH22  ARG  26          HH22      ARG  26  23.642   9.956  -4.428
  Start of MODEL   28
    1    HA   ARG   1           HA       ARG   1 -16.569   1.508  -6.941
    2    HB2  ARG   1           HB2      ARG   1 -17.700   3.778  -7.366
    3    HB3  ARG   1           HB3      ARG   1 -18.573   3.506  -5.858
    4    HG2  ARG   1           HG2      ARG   1 -16.536   3.439  -4.589
    5    HG3  ARG   1           HG3      ARG   1 -15.554   3.386  -6.053
    6    HD2  ARG   1           HD2      ARG   1 -15.748   5.648  -6.425
    7    HD3  ARG   1           HD3      ARG   1 -17.407   5.709  -5.800
    8    HE   ARG   1           HE       ARG   1 -15.957   5.102  -3.546
    9   HH11  ARG   1          HH11      ARG   1 -17.153   7.784  -3.758
   10   HH12  ARG   1          HH12      ARG   1 -15.777   8.835  -3.724
   11   HH21  ARG   1          HH21      ARG   1 -13.506   6.315  -4.484
   12   HH22  ARG   1          HH22      ARG   1 -13.704   7.999  -4.136
   13    H    SER   2           H        SER   2 -16.020   0.543  -4.990
   14    HA   SER   2           HA       SER   2 -18.267  -0.288  -3.175
   15    HB2  SER   2           HB2      SER   2 -15.868  -1.684  -4.311
   16    HB3  SER   2           HB3      SER   2 -16.455  -2.179  -2.726
   17    HG   SER   2           HG       SER   2 -18.175  -3.009  -3.632
   18    H    ALA   3           H        ALA   3 -17.533  -0.624  -0.886
   19    HA   ALA   3           HA       ALA   3 -15.631   1.514  -0.073
   20    HB1  ALA   3           HB1      ALA   3 -17.807   1.532   0.961
   21    HB2  ALA   3           HB2      ALA   3 -16.673   0.965   2.187
   22    HB3  ALA   3           HB3      ALA   3 -17.705  -0.187   1.341
   23    H    LEU   4           H        LEU   4 -16.165  -1.999   0.359
   24    HA   LEU   4           HA       LEU   4 -13.668  -2.302   1.900
   25    HB2  LEU   4           HB2      LEU   4 -15.971  -3.526   2.118
   26    HB3  LEU   4           HB3      LEU   4 -15.378  -4.518   0.785
   27    HG   LEU   4           HG       LEU   4 -13.200  -4.475   2.465
   28   HD11  LEU   4          HD11      LEU   4 -15.716  -4.588   4.158
   29   HD12  LEU   4          HD12      LEU   4 -14.472  -3.340   4.233
   30   HD13  LEU   4          HD13      LEU   4 -14.095  -4.992   4.722
   31   HD21  LEU   4          HD21      LEU   4 -15.492  -6.464   2.549
   32   HD22  LEU   4          HD22      LEU   4 -13.811  -6.784   2.974
   33   HD23  LEU   4          HD23      LEU   4 -14.245  -6.427   1.302
   34    H    VAL   5           H        VAL   5 -13.934  -1.628  -1.218
   35    HA   VAL   5           HA       VAL   5 -12.167  -3.821  -2.222
   36    HB   VAL   5           HB       VAL   5 -13.923  -1.707  -3.502
   37   HG11  VAL   5          HG11      VAL   5 -13.148  -2.948  -5.670
   38   HG12  VAL   5          HG12      VAL   5 -11.741  -3.398  -4.708
   39   HG13  VAL   5          HG13      VAL   5 -12.106  -1.697  -4.993
   40   HG21  VAL   5          HG21      VAL   5 -14.954  -3.830  -2.679
   41   HG22  VAL   5          HG22      VAL   5 -13.865  -4.735  -3.728
   42   HG23  VAL   5          HG23      VAL   5 -15.072  -3.658  -4.431
   43    H    ASN   6           H        ASN   6 -12.455  -0.240  -2.399
   44    HA   ASN   6           HA       ASN   6  -9.709   0.132  -3.269
   45    HB2  ASN   6           HB2      ASN   6 -11.651   1.656  -3.714
   46    HB3  ASN   6           HB3      ASN   6 -11.663   2.081  -2.001
   47   HD21  ASN   6          HD21      ASN   6 -10.205   2.815  -5.044
   48   HD22  ASN   6          HD22      ASN   6  -9.001   3.861  -4.461
   49    H    SER   7           H        SER   7 -11.360   0.327  -0.094
   50    HA   SER   7           HA       SER   7  -9.320   1.492   1.464
   51    HB2  SER   7           HB2      SER   7 -11.660   0.815   2.141
   52    HB3  SER   7           HB3      SER   7 -11.093  -0.850   2.234
   53    HG   SER   7           HG       SER   7 -10.760  -0.138   4.242
   54    H    TYR   8           H        TYR   8  -9.715  -1.940   0.538
   55    HA   TYR   8           HA       TYR   8  -7.250  -2.772   1.892
   56    HB2  TYR   8           HB2      TYR   8  -9.013  -4.362   1.758
   57    HB3  TYR   8           HB3      TYR   8  -9.306  -4.018   0.055
   58    HD1  TYR   8           HD1      TYR   8  -6.726  -5.396   2.391
   59    HD2  TYR   8           HD2      TYR   8  -8.262  -5.302  -1.620
   60    HE1  TYR   8           HE2      TYR   8  -5.166  -7.213   1.749
   61    HE2  TYR   8           HE1      TYR   8  -6.702  -7.119  -2.260
   62    HH   TYR   8           HH       TYR   8  -5.349  -9.127  -0.375
   63    H    LEU   9           H        LEU   9  -8.266  -2.094  -1.461
   64    HA   LEU   9           HA       LEU   9  -5.814  -2.921  -2.730
   65    HB2  LEU   9           HB2      LEU   9  -8.303  -1.439  -3.382
   66    HB3  LEU   9           HB3      LEU   9  -6.926  -1.111  -4.431
   67    HG   LEU   9           HG       LEU   9  -7.863  -3.910  -3.747
   68   HD11  LEU   9          HD11      LEU   9  -9.592  -2.575  -4.994
   69   HD12  LEU   9          HD12      LEU   9  -8.974  -3.955  -5.902
   70   HD13  LEU   9          HD13      LEU   9  -8.407  -2.328  -6.277
   71   HD21  LEU   9          HD21      LEU   9  -6.271  -4.649  -5.264
   72   HD22  LEU   9          HD22      LEU   9  -5.451  -3.212  -4.652
   73   HD23  LEU   9          HD23      LEU   9  -6.308  -3.150  -6.192
   74    H    TRP  10           H        TRP  10  -6.907   0.211  -1.407
   75    HA   TRP  10           HA       TRP  10  -4.883   1.888  -2.490
   76    HB2  TRP  10           HB2      TRP  10  -7.010   2.447  -1.173
   77    HB3  TRP  10           HB3      TRP  10  -6.088   2.085   0.284
   78    HD1  TRP  10           HD1      TRP  10  -4.593   3.852  -2.775
   79    HE1  TRP  10           HE1      TRP  10  -3.877   6.228  -2.084
   80    HE3  TRP  10           HE3      TRP  10  -6.467   3.993   1.974
   81    HZ2  TRP  10           HZ2      TRP  10  -4.073   7.961   0.182
   82    HZ3  TRP  10           HZ3      TRP  10  -6.187   6.017   3.375
   83    HH2  TRP  10           HH2      TRP  10  -4.994   7.999   2.486
   84    H    GLN  11           H        GLN  11  -4.908   0.282   0.732
   85    HA   GLN  11           HA       GLN  11  -2.194   0.991   1.391
   86    HB2  GLN  11           HB2      GLN  11  -4.280  -0.952   2.349
   87    HB3  GLN  11           HB3      GLN  11  -2.638  -1.088   2.978
   88    HG2  GLN  11           HG2      GLN  11  -3.069   0.592   4.407
   89    HG3  GLN  11           HG3      GLN  11  -3.317   1.672   3.035
   90   HE21  GLN  11          HE21      GLN  11  -5.491   2.239   2.483
   91   HE22  GLN  11          HE22      GLN  11  -6.839   1.705   3.366
   92    H    ARG  12           H        ARG  12  -3.635  -1.893  -0.150
   93    HA   ARG  12           HA       ARG  12  -1.249  -3.494  -0.202
   94    HB2  ARG  12           HB2      ARG  12  -3.885  -3.385  -1.627
   95    HB3  ARG  12           HB3      ARG  12  -2.638  -4.464  -2.250
   96    HG2  ARG  12           HG2      ARG  12  -3.381  -4.453   0.675
   97    HG3  ARG  12           HG3      ARG  12  -4.265  -5.432  -0.494
   98    HD2  ARG  12           HD2      ARG  12  -1.248  -5.560  -0.153
   99    HD3  ARG  12           HD3      ARG  12  -2.379  -6.683   0.625
  100    HE   ARG  12           HE       ARG  12  -3.239  -7.023  -1.835
  101   HH11  ARG  12          HH11      ARG  12  -1.168  -5.450  -3.204
  102   HH12  ARG  12          HH12      ARG  12   0.063  -6.620  -3.540
  103   HH21  ARG  12          HH21      ARG  12  -1.136  -8.933  -1.241
  104   HH22  ARG  12          HH22      ARG  12   0.083  -8.599  -2.424
  105    H    TRP  13           H        TRP  13  -1.957  -0.612  -1.886
  106    HA   TRP  13           HA       TRP  13  -0.202  -1.296  -4.198
  107    HB2  TRP  13           HB2      TRP  13  -2.521   0.348  -3.681
  108    HB3  TRP  13           HB3      TRP  13  -1.214   1.364  -4.286
  109    HD1  TRP  13           HD1      TRP  13  -3.999  -0.089  -5.678
  110    HE1  TRP  13           HE1      TRP  13  -3.648  -0.994  -8.071
  111    HE3  TRP  13           HE3      TRP  13   1.092  -0.309  -5.781
  112    HZ2  TRP  13           HZ2      TRP  13  -1.479  -1.712  -9.799
  113    HZ3  TRP  13           HZ3      TRP  13   2.279  -1.102  -7.809
  114    HH2  TRP  13           HH2      TRP  13   1.001  -1.803  -9.816
  115    H    GLU  14           H        GLU  14  -0.627   1.187  -1.675
  116    HA   GLU  14           HA       GLU  14   2.023   2.359  -2.224
  117    HB2  GLU  14           HB2      GLU  14   0.084   3.016   0.004
  118    HB3  GLU  14           HB3      GLU  14   1.249   4.087  -0.772
  119    HG2  GLU  14           HG2      GLU  14  -0.056   3.801  -2.926
  120    HG3  GLU  14           HG3      GLU  14  -1.284   2.943  -1.995
  121    H    ASN  15           H        ASN  15   0.408   0.688   0.523
  122    HA   ASN  15           HA       ASN  15   2.667   0.733   2.287
  123    HB2  ASN  15           HB2      ASN  15   0.073   0.048   2.498
  124    HB3  ASN  15           HB3      ASN  15   0.760  -1.566   2.312
  125   HD21  ASN  15          HD21      ASN  15   2.949  -1.761   3.774
  126   HD22  ASN  15          HD22      ASN  15   2.753  -1.220   5.370
  127    H    TRP  16           H        TRP  16   1.630  -1.628  -0.190
  128    HA   TRP  16           HA       TRP  16   3.742  -3.540   0.388
  129    HB2  TRP  16           HB2      TRP  16   1.872  -4.433  -0.715
  130    HB3  TRP  16           HB3      TRP  16   1.717  -3.039  -1.782
  131    HD1  TRP  16           HD1      TRP  16   3.876  -6.175  -1.264
  132    HE1  TRP  16           HE1      TRP  16   5.029  -6.755  -3.494
  133    HE3  TRP  16           HE3      TRP  16   2.457  -2.146  -4.063
  134    HZ2  TRP  16           HZ2      TRP  16   5.314  -5.654  -6.119
  135    HZ3  TRP  16           HZ3      TRP  16   3.186  -1.936  -6.421
  136    HH2  TRP  16           HH2      TRP  16   4.611  -3.683  -7.453
  137    H    PHE  17           H        PHE  17   3.289  -1.042  -2.151
  138    HA   PHE  17           HA       PHE  17   5.724  -1.429  -3.551
  139    HB2  PHE  17           HB2      PHE  17   3.809  -0.026  -4.272
  140    HB3  PHE  17           HB3      PHE  17   4.180   1.129  -2.992
  141    HD1  PHE  17           HD1      PHE  17   5.462  -0.411  -6.124
  142    HD2  PHE  17           HD2      PHE  17   5.956   2.721  -3.224
  143    HE1  PHE  17           HE2      PHE  17   7.108   0.703  -7.606
  144    HE2  PHE  17           HE1      PHE  17   7.604   3.834  -4.706
  145    HZ   PHE  17           HZ       PHE  17   8.180   2.824  -6.897
  146    H    TRP  18           H        TRP  18   5.041   0.888  -0.885
  147    HA   TRP  18           HA       TRP  18   7.750   1.820  -0.655
  148    HB2  TRP  18           HB2      TRP  18   5.296   1.809   1.101
  149    HB3  TRP  18           HB3      TRP  18   6.814   2.486   1.683
  150    HD1  TRP  18           HD1      TRP  18   3.842   3.775   0.412
  151    HE1  TRP  18           HE1      TRP  18   4.148   5.877  -1.047
  152    HE3  TRP  18           HE3      TRP  18   8.835   3.423  -0.603
  153    HZ2  TRP  18           HZ2      TRP  18   6.237   7.231  -2.456
  154    HZ3  TRP  18           HZ3      TRP  18   9.956   5.132  -2.003
  155    HH2  TRP  18           HH2      TRP  18   8.665   7.034  -2.930
  156    H    ASN  19           H        ASN  19   6.023  -0.910   0.839
  157    HA   ASN  19           HA       ASN  19   7.901  -1.547   2.889
  158    HB2  ASN  19           HB2      ASN  19   5.627  -2.486   2.650
  159    HB3  ASN  19           HB3      ASN  19   6.134  -3.347   1.196
  160   HD21  ASN  19          HD21      ASN  19   7.137  -5.378   1.489
  161   HD22  ASN  19          HD22      ASN  19   7.585  -6.004   3.002
  162    H    VAL  20           H        VAL  20   7.635  -3.050  -0.377
  163    HA   VAL  20           HA       VAL  20  10.121  -4.490  -0.150
  164    HB   VAL  20           HB       VAL  20   9.783  -4.824  -2.608
  165   HG11  VAL  20          HG11      VAL  20   7.854  -6.166  -2.364
  166   HG12  VAL  20          HG12      VAL  20   7.130  -5.068  -1.190
  167   HG13  VAL  20          HG13      VAL  20   8.511  -6.064  -0.730
  168   HG21  VAL  20          HG21      VAL  20   7.231  -3.735  -3.009
  169   HG22  VAL  20          HG22      VAL  20   8.736  -3.170  -3.735
  170   HG23  VAL  20          HG23      VAL  20   8.149  -2.440  -2.243
  171    H    THR  21           H        THR  21   9.421  -1.176  -1.073
  172    HA   THR  21           HA       THR  21  12.034  -0.804  -2.395
  173    HB   THR  21           HB       THR  21   9.822   1.130  -1.633
  174    HG1  THR  21           HG1      THR  21  10.375  -0.394  -3.948
  175   HG21  THR  21          HG21      THR  21  11.612   2.540  -2.057
  176   HG22  THR  21          HG22      THR  21  10.986   2.328  -3.692
  177   HG23  THR  21          HG23      THR  21  12.385   1.399  -3.157
  178    H    LEU  22           H        LEU  22  10.537  -0.132   0.735
  179    HA   LEU  22           HA       LEU  22  12.743   1.567   1.661
  180    HB2  LEU  22           HB2      LEU  22  10.249   0.354   2.846
  181    HB3  LEU  22           HB3      LEU  22  11.426   1.167   3.876
  182    HG   LEU  22           HG       LEU  22  10.403   2.527   1.393
  183   HD11  LEU  22          HD11      LEU  22   8.452   3.250   2.405
  184   HD12  LEU  22          HD12      LEU  22   9.094   3.040   4.035
  185   HD13  LEU  22          HD13      LEU  22   8.569   1.636   3.106
  186   HD21  LEU  22          HD21      LEU  22  10.950   4.536   2.695
  187   HD22  LEU  22          HD22      LEU  22  12.343   3.455   2.646
  188   HD23  LEU  22          HD23      LEU  22  11.343   3.540   4.097
  189    H    ARG  23           H        ARG  23  11.449  -1.441   3.079
  190    HA   ARG  23           HA       ARG  23  14.021  -2.809   3.046
  191    HB2  ARG  23           HB2      ARG  23  14.074  -2.717   5.669
  192    HB3  ARG  23           HB3      ARG  23  14.692  -1.341   4.760
  193    HG2  ARG  23           HG2      ARG  23  12.953   0.024   5.376
  194    HG3  ARG  23           HG3      ARG  23  11.784  -1.297   5.389
  195    HD2  ARG  23           HD2      ARG  23  13.530  -1.961   7.464
  196    HD3  ARG  23           HD3      ARG  23  13.341  -0.202   7.607
  197    HE   ARG  23           HE       ARG  23  10.847  -0.603   7.513
  198   HH11  ARG  23          HH11      ARG  23  11.111  -3.537   6.745
  199   HH12  ARG  23          HH12      ARG  23  10.765  -4.314   8.256
  200   HH21  ARG  23          HH21      ARG  23  11.225  -1.433  10.147
  201   HH22  ARG  23          HH22      ARG  23  10.829  -3.120  10.189
  202    HA   PRO  24           HA       PRO  24  10.298  -5.461   3.660
  203    HB2  PRO  24           HB2      PRO  24  10.930  -7.256   1.694
  204    HB3  PRO  24           HB3      PRO  24  10.047  -5.748   1.378
  205    HG2  PRO  24           HG2      PRO  24  12.910  -6.397   0.919
  206    HG3  PRO  24           HG3      PRO  24  11.806  -5.407  -0.047
  207    HD2  PRO  24           HD2      PRO  24  13.703  -4.392   1.658
  208    HD3  PRO  24           HD3      PRO  24  12.229  -3.529   1.169
  209    H    GLU  25           H        GLU  25  10.388  -8.037   3.872
  210    HA   GLU  25           HA       GLU  25  12.302  -8.703   5.920
  211    HB2  GLU  25           HB2      GLU  25  10.299 -10.209   4.229
  212    HB3  GLU  25           HB3      GLU  25  11.309 -11.051   5.404
  213    HG2  GLU  25           HG2      GLU  25  10.040 -10.332   7.122
  214    HG3  GLU  25           HG3      GLU  25  10.141  -8.660   6.570
  215    H    ARG  26           H        ARG  26  12.115  -9.424   2.443
  216    HA   ARG  26           HA       ARG  26  13.740 -10.151   0.913
  217    HB2  ARG  26           HB2      ARG  26  15.551  -9.508   3.267
  218    HB3  ARG  26           HB3      ARG  26  16.114  -9.833   1.631
  219    HG2  ARG  26           HG2      ARG  26  15.184  -7.861   0.774
  220    HG3  ARG  26           HG3      ARG  26  14.040  -7.706   2.107
  221    HD2  ARG  26           HD2      ARG  26  15.512  -6.477   3.316
  222    HD3  ARG  26           HD3      ARG  26  16.796  -7.677   3.073
  223    HE   ARG  26           HE       ARG  26  16.097  -5.586   1.042
  224   HH11  ARG  26          HH11      ARG  26  17.740  -8.013   0.222
  225   HH12  ARG  26          HH12      ARG  26  19.352  -7.397   0.366
  226   HH21  ARG  26          HH21      ARG  26  18.410  -4.647   2.275
  227   HH22  ARG  26          HH22      ARG  26  19.733  -5.483   1.534
  Start of MODEL   29
    1    HA   ARG   1           HA       ARG   1 -18.781  -0.484  -7.961
    2    HB2  ARG   1           HB2      ARG   1 -21.245  -0.894  -7.735
    3    HB3  ARG   1           HB3      ARG   1 -20.488  -1.944  -8.931
    4    HG2  ARG   1           HG2      ARG   1 -20.667  -3.838  -7.583
    5    HG3  ARG   1           HG3      ARG   1 -20.713  -2.896  -6.091
    6    HD2  ARG   1           HD2      ARG   1 -22.982  -1.971  -7.087
    7    HD3  ARG   1           HD3      ARG   1 -22.936  -3.475  -8.029
    8    HE   ARG   1           HE       ARG   1 -22.342  -4.390  -5.527
    9   HH11  ARG   1          HH11      ARG   1 -23.655  -1.943  -4.393
   10   HH12  ARG   1          HH12      ARG   1 -25.295  -2.467  -4.199
   11   HH21  ARG   1          HH21      ARG   1 -24.939  -5.218  -6.297
   12   HH22  ARG   1          HH22      ARG   1 -26.025  -4.330  -5.282
   13    H    SER   2           H        SER   2 -17.320  -1.318  -5.569
   14    HA   SER   2           HA       SER   2 -19.092  -0.118  -3.464
   15    HB2  SER   2           HB2      SER   2 -18.562  -2.670  -3.427
   16    HB3  SER   2           HB3      SER   2 -16.947  -2.173  -2.931
   17    HG   SER   2           HG       SER   2 -18.130  -2.434  -1.082
   18    H    ALA   3           H        ALA   3 -17.780   0.903  -1.683
   19    HA   ALA   3           HA       ALA   3 -15.426   2.330  -2.824
   20    HB1  ALA   3           HB1      ALA   3 -15.888   3.707  -0.664
   21    HB2  ALA   3           HB2      ALA   3 -17.372   2.762  -0.556
   22    HB3  ALA   3           HB3      ALA   3 -17.080   3.787  -1.961
   23    H    LEU   4           H        LEU   4 -16.373   0.529   0.127
   24    HA   LEU   4           HA       LEU   4 -13.898   0.634   1.502
   25    HB2  LEU   4           HB2      LEU   4 -14.784  -1.370   2.672
   26    HB3  LEU   4           HB3      LEU   4 -16.025  -0.137   2.463
   27    HG   LEU   4           HG       LEU   4 -16.172  -1.699   0.134
   28   HD11  LEU   4          HD11      LEU   4 -15.943  -3.445   2.604
   29   HD12  LEU   4          HD12      LEU   4 -14.791  -3.411   1.268
   30   HD13  LEU   4          HD13      LEU   4 -16.437  -3.988   1.001
   31   HD21  LEU   4          HD21      LEU   4 -18.170  -0.866   1.029
   32   HD22  LEU   4          HD22      LEU   4 -17.783  -1.419   2.658
   33   HD23  LEU   4          HD23      LEU   4 -18.280  -2.580   1.428
   34    H    VAL   5           H        VAL   5 -14.815  -1.301  -1.271
   35    HA   VAL   5           HA       VAL   5 -12.805  -3.354  -1.063
   36    HB   VAL   5           HB       VAL   5 -14.308  -2.101  -3.388
   37   HG11  VAL   5          HG11      VAL   5 -13.681  -4.513  -4.344
   38   HG12  VAL   5          HG12      VAL   5 -12.288  -4.304  -3.282
   39   HG13  VAL   5          HG13      VAL   5 -12.604  -3.134  -4.563
   40   HG21  VAL   5          HG21      VAL   5 -15.820  -3.926  -3.151
   41   HG22  VAL   5          HG22      VAL   5 -15.531  -3.361  -1.505
   42   HG23  VAL   5          HG23      VAL   5 -14.713  -4.806  -2.097
   43    H    ASN   6           H        ASN   6 -12.880  -0.278  -2.909
   44    HA   ASN   6           HA       ASN   6 -10.180  -0.449  -3.899
   45    HB2  ASN   6           HB2      ASN   6 -11.959   0.970  -4.854
   46    HB3  ASN   6           HB3      ASN   6 -12.014   1.917  -3.366
   47   HD21  ASN   6          HD21      ASN   6 -10.247   3.412  -2.943
   48   HD22  ASN   6          HD22      ASN   6  -9.105   3.803  -4.137
   49    H    SER   7           H        SER   7 -11.600   0.974  -0.946
   50    HA   SER   7           HA       SER   7  -9.388   2.440   0.029
   51    HB2  SER   7           HB2      SER   7 -11.464   0.753   1.466
   52    HB3  SER   7           HB3      SER   7 -10.434   1.942   2.258
   53    HG   SER   7           HG       SER   7 -12.650   2.567   1.431
   54    H    TYR   8           H        TYR   8 -10.221  -0.976   0.775
   55    HA   TYR   8           HA       TYR   8  -7.803  -1.601   2.178
   56    HB2  TYR   8           HB2      TYR   8  -9.642  -3.069   2.429
   57    HB3  TYR   8           HB3      TYR   8  -9.941  -3.135   0.693
   58    HD1  TYR   8           HD1      TYR   8  -7.307  -3.997   3.224
   59    HD2  TYR   8           HD2      TYR   8  -9.147  -4.960  -0.538
   60    HE1  TYR   8           HE2      TYR   8  -5.889  -6.023   3.048
   61    HE2  TYR   8           HE1      TYR   8  -7.727  -6.985  -0.713
   62    HH   TYR   8           HH       TYR   8  -5.177  -7.542   0.488
   63    H    LEU   9           H        LEU   9  -8.717  -1.989  -1.259
   64    HA   LEU   9           HA       LEU   9  -6.373  -3.261  -2.226
   65    HB2  LEU   9           HB2      LEU   9  -8.584  -1.566  -3.275
   66    HB3  LEU   9           HB3      LEU   9  -7.166  -1.709  -4.309
   67    HG   LEU   9           HG       LEU   9  -8.620  -4.079  -3.102
   68   HD11  LEU   9          HD11      LEU   9  -8.730  -3.103  -5.968
   69   HD12  LEU   9          HD12      LEU   9  -9.969  -2.720  -4.773
   70   HD13  LEU   9          HD13      LEU   9  -9.679  -4.396  -5.236
   71   HD21  LEU   9          HD21      LEU   9  -7.319  -5.170  -5.088
   72   HD22  LEU   9          HD22      LEU   9  -6.429  -4.772  -3.618
   73   HD23  LEU   9          HD23      LEU   9  -6.326  -3.714  -5.025
   74    H    TRP  10           H        TRP  10  -7.072   0.210  -1.775
   75    HA   TRP  10           HA       TRP  10  -4.590   1.177  -2.889
   76    HB2  TRP  10           HB2      TRP  10  -6.448   2.657  -2.735
   77    HB3  TRP  10           HB3      TRP  10  -6.737   2.248  -1.046
   78    HD1  TRP  10           HD1      TRP  10  -3.934   3.885  -3.160
   79    HE1  TRP  10           HE1      TRP  10  -2.858   5.753  -1.747
   80    HE3  TRP  10           HE3      TRP  10  -6.552   3.317   1.180
   81    HZ2  TRP  10           HZ2      TRP  10  -3.083   6.862   0.881
   82    HZ3  TRP  10           HZ3      TRP  10  -6.104   4.789   3.123
   83    HH2  TRP  10           HH2      TRP  10  -4.373   6.560   2.980
   84    H    GLN  11           H        GLN  11  -5.629   0.332   0.423
   85    HA   GLN  11           HA       GLN  11  -3.287   1.249   1.800
   86    HB2  GLN  11           HB2      GLN  11  -5.520  -0.702   2.284
   87    HB3  GLN  11           HB3      GLN  11  -4.173  -0.650   3.420
   88    HG2  GLN  11           HG2      GLN  11  -4.758   1.403   4.228
   89    HG3  GLN  11           HG3      GLN  11  -5.275   1.989   2.647
   90   HE21  GLN  11          HE21      GLN  11  -7.440   2.614   2.958
   91   HE22  GLN  11          HE22      GLN  11  -8.629   1.626   3.658
   92    H    ARG  12           H        ARG  12  -4.045  -1.864   0.227
   93    HA   ARG  12           HA       ARG  12  -1.648  -3.210   1.184
   94    HB2  ARG  12           HB2      ARG  12  -4.009  -4.020   0.218
   95    HB3  ARG  12           HB3      ARG  12  -3.102  -4.038  -1.296
   96    HG2  ARG  12           HG2      ARG  12  -2.806  -6.215  -0.402
   97    HG3  ARG  12           HG3      ARG  12  -1.310  -5.367  -0.011
   98    HD2  ARG  12           HD2      ARG  12  -3.259  -4.922   2.089
   99    HD3  ARG  12           HD3      ARG  12  -3.039  -6.662   1.814
  100    HE   ARG  12           HE       ARG  12  -0.767  -4.771   2.317
  101   HH11  ARG  12          HH11      ARG  12  -0.783  -7.744   1.126
  102   HH12  ARG  12          HH12      ARG  12  -0.124  -8.573   2.498
  103   HH21  ARG  12          HH21      ARG  12  -0.544  -5.875   4.653
  104   HH22  ARG  12          HH22      ARG  12   0.012  -7.510   4.504
  105    H    TRP  13           H        TRP  13  -2.535  -1.534  -1.854
  106    HA   TRP  13           HA       TRP  13  -0.199  -2.194  -3.352
  107    HB2  TRP  13           HB2      TRP  13  -1.369  -0.995  -4.878
  108    HB3  TRP  13           HB3      TRP  13  -2.553  -0.671  -3.621
  109    HD1  TRP  13           HD1      TRP  13  -2.973   1.775  -3.149
  110    HE1  TRP  13           HE1      TRP  13  -1.709   3.983  -3.528
  111    HE3  TRP  13           HE3      TRP  13   1.397  -0.031  -5.077
  112    HZ2  TRP  13           HZ2      TRP  13   0.823   4.872  -4.520
  113    HZ3  TRP  13           HZ3      TRP  13   3.217   1.519  -5.730
  114    HH2  TRP  13           HH2      TRP  13   2.935   3.965  -5.455
  115    H    GLU  14           H        GLU  14  -0.835   0.598  -1.193
  116    HA   GLU  14           HA       GLU  14   1.722   1.861  -1.561
  117    HB2  GLU  14           HB2      GLU  14  -0.618   2.002   0.247
  118    HB3  GLU  14           HB3      GLU  14   0.891   2.593   0.943
  119    HG2  GLU  14           HG2      GLU  14   1.100   3.795  -1.424
  120    HG3  GLU  14           HG3      GLU  14  -0.657   3.638  -1.393
  121    H    ASN  15           H        ASN  15   0.548  -0.488   0.873
  122    HA   ASN  15           HA       ASN  15   2.858  -0.598   2.520
  123    HB2  ASN  15           HB2      ASN  15   0.420  -1.762   2.488
  124    HB3  ASN  15           HB3      ASN  15   1.386  -3.117   1.901
  125   HD21  ASN  15          HD21      ASN  15   3.689  -3.107   3.314
  126   HD22  ASN  15          HD22      ASN  15   3.413  -3.113   4.989
  127    H    TRP  16           H        TRP  16   2.152  -2.230  -0.568
  128    HA   TRP  16           HA       TRP  16   4.508  -3.929  -0.542
  129    HB2  TRP  16           HB2      TRP  16   2.764  -4.638  -1.954
  130    HB3  TRP  16           HB3      TRP  16   2.447  -3.005  -2.539
  131    HD1  TRP  16           HD1      TRP  16   5.036  -5.834  -2.873
  132    HE1  TRP  16           HE1      TRP  16   6.266  -5.554  -5.121
  133    HE3  TRP  16           HE3      TRP  16   3.022  -1.407  -4.433
  134    HZ2  TRP  16           HZ2      TRP  16   6.383  -3.696  -7.292
  135    HZ3  TRP  16           HZ3      TRP  16   3.712  -0.405  -6.592
  136    HH2  TRP  16           HH2      TRP  16   5.387  -1.543  -8.023
  137    H    PHE  17           H        PHE  17   3.711  -0.820  -2.135
  138    HA   PHE  17           HA       PHE  17   6.147  -0.366  -3.498
  139    HB2  PHE  17           HB2      PHE  17   3.947   0.902  -3.593
  140    HB3  PHE  17           HB3      PHE  17   4.417   1.690  -2.088
  141    HD1  PHE  17           HD1      PHE  17   5.607   1.050  -5.578
  142    HD2  PHE  17           HD2      PHE  17   5.797   3.595  -2.121
  143    HE1  PHE  17           HE2      PHE  17   6.965   2.685  -6.856
  144    HE2  PHE  17           HE1      PHE  17   7.155   5.229  -3.399
  145    HZ   PHE  17           HZ       PHE  17   7.739   4.775  -5.767
  146    H    TRP  18           H        TRP  18   5.217   0.798  -0.226
  147    HA   TRP  18           HA       TRP  18   7.732   1.955   0.458
  148    HB2  TRP  18           HB2      TRP  18   5.575   0.662   2.159
  149    HB3  TRP  18           HB3      TRP  18   6.846   1.706   2.788
  150    HD1  TRP  18           HD1      TRP  18   3.500   2.151   2.460
  151    HE1  TRP  18           HE1      TRP  18   2.764   4.444   1.536
  152    HE3  TRP  18           HE3      TRP  18   7.877   3.689   0.316
  153    HZ2  TRP  18           HZ2      TRP  18   3.884   6.635   0.084
  154    HZ3  TRP  18           HZ3      TRP  18   8.012   5.881  -0.828
  155    HH2  TRP  18           HH2      TRP  18   6.023   7.356  -0.947
  156    H    ASN  19           H        ASN  19   6.615  -1.405   0.613
  157    HA   ASN  19           HA       ASN  19   8.713  -2.433   2.296
  158    HB2  ASN  19           HB2      ASN  19   6.460  -3.357   0.751
  159    HB3  ASN  19           HB3      ASN  19   7.840  -4.414   0.460
  160   HD21  ASN  19          HD21      ASN  19   6.116  -2.843   3.219
  161   HD22  ASN  19          HD22      ASN  19   6.364  -4.135   4.293
  162    H    VAL  20           H        VAL  20   8.546  -1.833  -1.208
  163    HA   VAL  20           HA       VAL  20  11.271  -3.038  -1.511
  164    HB   VAL  20           HB       VAL  20  10.690  -3.023  -3.937
  165   HG11  VAL  20          HG11      VAL  20  10.120  -4.959  -2.468
  166   HG12  VAL  20          HG12      VAL  20   9.002  -4.778  -3.821
  167   HG13  VAL  20          HG13      VAL  20   8.524  -4.253  -2.208
  168   HG21  VAL  20          HG21      VAL  20   9.135  -1.013  -3.728
  169   HG22  VAL  20          HG22      VAL  20   7.936  -2.116  -3.054
  170   HG23  VAL  20          HG23      VAL  20   8.516  -2.346  -4.702
  171    H    THR  21           H        THR  21   9.529   0.019  -1.723
  172    HA   THR  21           HA       THR  21  11.663   1.394  -3.185
  173    HB   THR  21           HB       THR  21   9.240   2.412  -1.669
  174    HG1  THR  21           HG1      THR  21   9.648   1.689  -4.381
  175   HG21  THR  21          HG21      THR  21   9.511   4.345  -3.305
  176   HG22  THR  21          HG22      THR  21  11.110   3.698  -3.667
  177   HG23  THR  21          HG23      THR  21  10.729   4.246  -2.034
  178    H    LEU  22           H        LEU  22  10.648   1.128   0.210
  179    HA   LEU  22           HA       LEU  22  12.512   3.166   1.156
  180    HB2  LEU  22           HB2      LEU  22  10.900   0.999   2.530
  181    HB3  LEU  22           HB3      LEU  22  11.792   2.253   3.387
  182    HG   LEU  22           HG       LEU  22   9.626   2.805   1.338
  183   HD11  LEU  22          HD11      LEU  22   8.164   3.287   3.195
  184   HD12  LEU  22          HD12      LEU  22   9.473   3.055   4.353
  185   HD13  LEU  22          HD13      LEU  22   8.833   1.677   3.459
  186   HD21  LEU  22          HD21      LEU  22  11.101   4.678   1.464
  187   HD22  LEU  22          HD22      LEU  22  11.264   4.524   3.214
  188   HD23  LEU  22          HD23      LEU  22   9.744   5.085   2.516
  189    H    ARG  23           H        ARG  23  12.820  -0.196   0.385
  190    HA   ARG  23           HA       ARG  23  14.614  -1.708   0.610
  191    HB2  ARG  23           HB2      ARG  23  15.602   0.582  -0.270
  192    HB3  ARG  23           HB3      ARG  23  16.348   0.640   1.327
  193    HG2  ARG  23           HG2      ARG  23  17.370  -1.561   0.952
  194    HG3  ARG  23           HG3      ARG  23  16.592  -1.667  -0.627
  195    HD2  ARG  23           HD2      ARG  23  18.498   0.572   0.137
  196    HD3  ARG  23           HD3      ARG  23  18.999  -0.891  -0.736
  197    HE   ARG  23           HE       ARG  23  17.287   1.257  -1.815
  198   HH11  ARG  23          HH11      ARG  23  19.503   0.063  -3.393
  199   HH12  ARG  23          HH12      ARG  23  18.669  -1.004  -4.473
  200   HH21  ARG  23          HH21      ARG  23  15.730  -1.006  -2.613
  201   HH22  ARG  23          HH22      ARG  23  16.521  -1.610  -4.029
  202    HA   PRO  24           HA       PRO  24  14.340  -1.244   5.268
  203    HB2  PRO  24           HB2      PRO  24  12.694  -3.382   5.731
  204    HB3  PRO  24           HB3      PRO  24  12.086  -1.747   5.403
  205    HG2  PRO  24           HG2      PRO  24  12.273  -4.096   3.593
  206    HG3  PRO  24           HG3      PRO  24  11.026  -2.845   3.696
  207    HD2  PRO  24           HD2      PRO  24  12.992  -2.912   1.784
  208    HD3  PRO  24           HD3      PRO  24  12.147  -1.437   2.301
  209    H    GLU  25           H        GLU  25  16.613  -2.089   4.318
  210    HA   GLU  25           HA       GLU  25  17.178  -4.633   5.694
  211    HB2  GLU  25           HB2      GLU  25  16.308  -5.033   3.279
  212    HB3  GLU  25           HB3      GLU  25  17.862  -4.380   2.761
  213    HG2  GLU  25           HG2      GLU  25  18.370  -6.643   2.890
  214    HG3  GLU  25           HG3      GLU  25  18.820  -6.115   4.512
  215    H    ARG  26           H        ARG  26  18.666  -2.537   3.178
  216    HA   ARG  26           HA       ARG  26  20.835  -1.803   5.076
  217    HB2  ARG  26           HB2      ARG  26  21.001  -3.619   2.721
  218    HB3  ARG  26           HB3      ARG  26  22.314  -2.456   2.901
  219    HG2  ARG  26           HG2      ARG  26  22.526  -3.230   5.310
  220    HG3  ARG  26           HG3      ARG  26  21.411  -4.537   4.907
  221    HD2  ARG  26           HD2      ARG  26  23.882  -4.066   3.233
  222    HD3  ARG  26           HD3      ARG  26  23.954  -5.041   4.713
  223    HE   ARG  26           HE       ARG  26  22.128  -6.459   3.717
  224   HH11  ARG  26          HH11      ARG  26  24.716  -6.586   2.059
  225   HH12  ARG  26          HH12      ARG  26  24.077  -6.478   0.454
  226   HH21  ARG  26          HH21      ARG  26  20.956  -5.347   1.494
  227   HH22  ARG  26          HH22      ARG  26  21.938  -5.774   0.131
  Start of MODEL   30
    1    HA   ARG   1           HA       ARG   1 -20.878   3.668  -0.725
    2    HB2  ARG   1           HB2      ARG   1 -23.201   4.146   0.895
    3    HB3  ARG   1           HB3      ARG   1 -21.775   4.245   1.930
    4    HG2  ARG   1           HG2      ARG   1 -20.740   5.857   0.406
    5    HG3  ARG   1           HG3      ARG   1 -22.105   5.718  -0.702
    6    HD2  ARG   1           HD2      ARG   1 -23.625   6.631   1.000
    7    HD3  ARG   1           HD3      ARG   1 -22.291   6.713   2.167
    8    HE   ARG   1           HE       ARG   1 -21.466   8.066  -0.202
    9   HH11  ARG   1          HH11      ARG   1 -21.193   9.342   2.437
   10   HH12  ARG   1          HH12      ARG   1 -22.361  10.619   2.383
   11   HH21  ARG   1          HH21      ARG   1 -24.090   9.275  -0.318
   12   HH22  ARG   1          HH22      ARG   1 -24.008  10.581   0.816
   13    H    SER   2           H        SER   2 -18.900   2.958  -0.009
   14    HA   SER   2           HA       SER   2 -18.753   1.303   2.472
   15    HB2  SER   2           HB2      SER   2 -18.692   0.293  -0.145
   16    HB3  SER   2           HB3      SER   2 -17.005   0.326   0.355
   17    HG   SER   2           HG       SER   2 -19.109  -1.207   1.258
   18    H    ALA   3           H        ALA   3 -16.988   1.865   3.697
   19    HA   ALA   3           HA       ALA   3 -14.953   3.691   2.461
   20    HB1  ALA   3           HB1      ALA   3 -14.862   4.760   4.577
   21    HB2  ALA   3           HB2      ALA   3 -15.586   3.377   5.398
   22    HB3  ALA   3           HB3      ALA   3 -16.573   4.399   4.353
   23    H    LEU   4           H        LEU   4 -15.194   0.500   3.142
   24    HA   LEU   4           HA       LEU   4 -12.399   0.325   4.225
   25    HB2  LEU   4           HB2      LEU   4 -13.123  -1.732   5.318
   26    HB3  LEU   4           HB3      LEU   4 -14.247  -0.440   5.732
   27    HG   LEU   4           HG       LEU   4 -15.231  -1.585   3.339
   28   HD11  LEU   4          HD11      LEU   4 -13.721  -3.521   3.901
   29   HD12  LEU   4          HD12      LEU   4 -15.434  -3.941   3.854
   30   HD13  LEU   4          HD13      LEU   4 -14.623  -3.719   5.404
   31   HD21  LEU   4          HD21      LEU   4 -16.395  -0.608   5.425
   32   HD22  LEU   4          HD22      LEU   4 -16.218  -2.217   6.125
   33   HD23  LEU   4          HD23      LEU   4 -17.166  -1.994   4.655
   34    H    VAL   5           H        VAL   5 -14.053   0.003   1.384
   35    HA   VAL   5           HA       VAL   5 -12.852  -2.559   0.509
   36    HB   VAL   5           HB       VAL   5 -14.539  -0.461  -0.908
   37   HG11  VAL   5          HG11      VAL   5 -13.269  -1.822  -2.502
   38   HG12  VAL   5          HG12      VAL   5 -14.967  -2.298  -2.536
   39   HG13  VAL   5          HG13      VAL   5 -13.788  -3.298  -1.687
   40   HG21  VAL   5          HG21      VAL   5 -15.808  -1.441   0.892
   41   HG22  VAL   5          HG22      VAL   5 -15.222  -3.058   0.502
   42   HG23  VAL   5          HG23      VAL   5 -16.332  -2.234  -0.593
   43    H    ASN   6           H        ASN   6 -12.759   0.861  -0.613
   44    HA   ASN   6           HA       ASN   6 -10.553   0.486  -2.422
   45    HB2  ASN   6           HB2      ASN   6 -12.211   2.344  -2.465
   46    HB3  ASN   6           HB3      ASN   6 -11.517   2.974  -0.971
   47   HD21  ASN   6          HD21      ASN   6 -10.997   2.650  -4.444
   48   HD22  ASN   6          HD22      ASN   6  -9.600   3.612  -4.510
   49    H    SER   7           H        SER   7 -10.685   1.523   1.008
   50    HA   SER   7           HA       SER   7  -8.042   2.381   1.406
   51    HB2  SER   7           HB2      SER   7  -9.971   2.312   3.044
   52    HB3  SER   7           HB3      SER   7  -9.648   0.594   3.261
   53    HG   SER   7           HG       SER   7  -8.569   1.854   4.828
   54    H    TYR   8           H        TYR   8  -9.251  -0.994   1.634
   55    HA   TYR   8           HA       TYR   8  -6.619  -2.147   2.039
   56    HB2  TYR   8           HB2      TYR   8  -8.531  -3.334   2.833
   57    HB3  TYR   8           HB3      TYR   8  -9.367  -3.176   1.289
   58    HD1  TYR   8           HD1      TYR   8  -6.144  -4.543   2.657
   59    HD2  TYR   8           HD2      TYR   8  -9.368  -5.012  -0.142
   60    HE1  TYR   8           HE2      TYR   8  -5.173  -6.694   1.901
   61    HE2  TYR   8           HE1      TYR   8  -8.396  -7.163  -0.900
   62    HH   TYR   8           HH       TYR   8  -5.736  -8.102  -0.809
   63    H    LEU   9           H        LEU   9  -8.801  -1.920  -0.802
   64    HA   LEU   9           HA       LEU   9  -7.176  -3.292  -2.686
   65    HB2  LEU   9           HB2      LEU   9  -9.426  -1.383  -2.643
   66    HB3  LEU   9           HB3      LEU   9  -8.471  -1.317  -4.121
   67    HG   LEU   9           HG       LEU   9 -10.286  -2.949  -4.363
   68   HD11  LEU   9          HD11      LEU   9  -9.001  -4.707  -5.256
   69   HD12  LEU   9          HD12      LEU   9  -7.772  -4.571  -3.999
   70   HD13  LEU   9          HD13      LEU   9  -7.880  -3.346  -5.263
   71   HD21  LEU   9          HD21      LEU   9  -9.024  -4.208  -1.911
   72   HD22  LEU   9          HD22      LEU   9 -10.215  -5.021  -2.926
   73   HD23  LEU   9          HD23      LEU   9 -10.656  -3.556  -2.050
   74    H    TRP  10           H        TRP  10  -7.191   0.151  -1.748
   75    HA   TRP  10           HA       TRP  10  -5.094   0.919  -3.612
   76    HB2  TRP  10           HB2      TRP  10  -6.908   2.379  -2.658
   77    HB3  TRP  10           HB3      TRP  10  -6.121   2.256  -1.088
   78    HD1  TRP  10           HD1      TRP  10  -5.593   4.830  -0.999
   79    HE1  TRP  10           HE1      TRP  10  -3.839   6.293  -2.186
   80    HE3  TRP  10           HE3      TRP  10  -4.117   1.633  -4.714
   81    HZ2  TRP  10           HZ2      TRP  10  -2.050   6.138  -4.404
   82    HZ3  TRP  10           HZ3      TRP  10  -2.390   2.324  -6.344
   83    HH2  TRP  10           HH2      TRP  10  -1.354   4.570  -6.195
   84    H    GLN  11           H        GLN  11  -5.233  -0.080  -0.206
   85    HA   GLN  11           HA       GLN  11  -2.537   0.583   0.520
   86    HB2  GLN  11           HB2      GLN  11  -4.806  -1.009   1.536
   87    HB3  GLN  11           HB3      GLN  11  -3.228  -1.588   2.065
   88    HG2  GLN  11           HG2      GLN  11  -3.982   1.333   2.231
   89    HG3  GLN  11           HG3      GLN  11  -4.351   0.202   3.533
   90   HE21  GLN  11          HE21      GLN  11  -1.855   2.165   2.167
   91   HE22  GLN  11          HE22      GLN  11  -0.580   1.594   3.130
   92    H    ARG  12           H        ARG  12  -3.971  -2.370  -0.907
   93    HA   ARG  12           HA       ARG  12  -1.759  -4.123  -0.770
   94    HB2  ARG  12           HB2      ARG  12  -4.247  -3.824  -2.211
   95    HB3  ARG  12           HB3      ARG  12  -3.003  -4.427  -3.305
   96    HG2  ARG  12           HG2      ARG  12  -3.299  -5.643  -0.571
   97    HG3  ARG  12           HG3      ARG  12  -4.382  -6.136  -1.873
   98    HD2  ARG  12           HD2      ARG  12  -1.570  -6.053  -2.725
   99    HD3  ARG  12           HD3      ARG  12  -1.867  -7.213  -1.416
  100    HE   ARG  12           HE       ARG  12  -3.941  -7.835  -2.975
  101   HH11  ARG  12          HH11      ARG  12  -1.151  -9.165  -3.264
  102   HH12  ARG  12          HH12      ARG  12  -0.971  -9.133  -4.986
  103   HH21  ARG  12          HH21      ARG  12  -3.552  -6.856  -5.477
  104   HH22  ARG  12          HH22      ARG  12  -2.337  -7.825  -6.245
  105    H    TRP  13           H        TRP  13  -2.248  -1.300  -2.810
  106    HA   TRP  13           HA       TRP  13  -0.022  -1.935  -4.630
  107    HB2  TRP  13           HB2      TRP  13  -2.359  -0.465  -4.722
  108    HB3  TRP  13           HB3      TRP  13  -1.141   0.792  -4.533
  109    HD1  TRP  13           HD1      TRP  13  -2.742   0.522  -7.196
  110    HE1  TRP  13           HE1      TRP  13  -1.520   0.007  -9.407
  111    HE3  TRP  13           HE3      TRP  13   1.559  -1.546  -5.374
  112    HZ2  TRP  13           HZ2      TRP  13   0.952  -1.128 -10.286
  113    HZ3  TRP  13           HZ3      TRP  13   3.325  -2.334  -6.920
  114    HH2  TRP  13           HH2      TRP  13   3.030  -2.126  -9.371
  115    H    GLU  14           H        GLU  14  -0.717   0.442  -2.044
  116    HA   GLU  14           HA       GLU  14   1.963   1.625  -2.219
  117    HB2  GLU  14           HB2      GLU  14  -0.287   1.978  -0.218
  118    HB3  GLU  14           HB3      GLU  14   1.070   3.077  -0.463
  119    HG2  GLU  14           HG2      GLU  14   0.310   3.264  -2.897
  120    HG3  GLU  14           HG3      GLU  14  -1.171   2.447  -2.399
  121    H    ASN  15           H        ASN  15   0.253  -0.551   0.055
  122    HA   ASN  15           HA       ASN  15   2.079  -0.641   2.186
  123    HB2  ASN  15           HB2      ASN  15  -0.178  -1.870   1.714
  124    HB3  ASN  15           HB3      ASN  15   0.837  -3.131   1.015
  125   HD21  ASN  15          HD21      ASN  15   2.716  -3.869   2.552
  126   HD22  ASN  15          HD22      ASN  15   2.342  -3.970   4.203
  127    H    TRP  16           H        TRP  16   2.221  -2.440  -0.907
  128    HA   TRP  16           HA       TRP  16   4.735  -3.779  -0.288
  129    HB2  TRP  16           HB2      TRP  16   3.334  -4.834  -1.884
  130    HB3  TRP  16           HB3      TRP  16   3.001  -3.320  -2.724
  131    HD1  TRP  16           HD1      TRP  16   5.686  -6.019  -2.348
  132    HE1  TRP  16           HE1      TRP  16   7.367  -5.793  -4.285
  133    HE3  TRP  16           HE3      TRP  16   4.027  -1.668  -4.455
  134    HZ2  TRP  16           HZ2      TRP  16   7.938  -4.007  -6.440
  135    HZ3  TRP  16           HZ3      TRP  16   5.163  -0.729  -6.447
  136    HH2  TRP  16           HH2      TRP  16   7.116  -1.891  -7.440
  137    H    PHE  17           H        PHE  17   3.798  -0.921  -2.226
  138    HA   PHE  17           HA       PHE  17   6.326  -0.200  -3.269
  139    HB2  PHE  17           HB2      PHE  17   3.835   0.744  -3.462
  140    HB3  PHE  17           HB3      PHE  17   4.419   1.878  -2.246
  141    HD1  PHE  17           HD1      PHE  17   6.718   3.032  -2.744
  142    HD2  PHE  17           HD2      PHE  17   4.263   1.150  -5.725
  143    HE1  PHE  17           HE1      PHE  17   7.870   4.332  -4.513
  144    HE2  PHE  17           HE2      PHE  17   5.417   2.450  -7.495
  145    HZ   PHE  17           HZ       PHE  17   7.220   4.041  -6.888
  146    H    TRP  18           H        TRP  18   4.833   0.695  -0.138
  147    HA   TRP  18           HA       TRP  18   7.084   2.285   0.762
  148    HB2  TRP  18           HB2      TRP  18   4.728   0.962   2.141
  149    HB3  TRP  18           HB3      TRP  18   5.844   2.050   2.964
  150    HD1  TRP  18           HD1      TRP  18   2.597   2.292   1.742
  151    HE1  TRP  18           HE1      TRP  18   2.021   4.596   0.738
  152    HE3  TRP  18           HE3      TRP  18   7.302   4.154   1.042
  153    HZ2  TRP  18           HZ2      TRP  18   3.374   6.916  -0.234
  154    HZ3  TRP  18           HZ3      TRP  18   7.628   6.411   0.075
  155    HH2  TRP  18           HH2      TRP  18   5.672   7.795  -0.563
  156    H    ASN  19           H        ASN  19   5.953  -1.016   1.662
  157    HA   ASN  19           HA       ASN  19   8.122  -1.632   3.417
  158    HB2  ASN  19           HB2      ASN  19   5.799  -2.769   2.824
  159    HB3  ASN  19           HB3      ASN  19   6.797  -3.724   1.729
  160   HD21  ASN  19          HD21      ASN  19   9.004  -4.471   2.964
  161   HD22  ASN  19          HD22      ASN  19   8.735  -5.132   4.504
  162    H    VAL  20           H        VAL  20   8.021  -1.588  -0.098
  163    HA   VAL  20           HA       VAL  20  10.540  -3.181  -0.247
  164    HB   VAL  20           HB       VAL  20   8.541  -2.211  -2.316
  165   HG11  VAL  20          HG11      VAL  20  10.717  -2.381  -3.372
  166   HG12  VAL  20          HG12      VAL  20   9.770  -3.795  -3.834
  167   HG13  VAL  20          HG13      VAL  20  11.018  -3.937  -2.597
  168   HG21  VAL  20          HG21      VAL  20   7.395  -4.037  -1.655
  169   HG22  VAL  20          HG22      VAL  20   8.691  -4.514  -0.559
  170   HG23  VAL  20          HG23      VAL  20   8.732  -5.022  -2.247
  171    H    THR  21           H        THR  21   9.276   0.089  -0.887
  172    HA   THR  21           HA       THR  21  11.817   0.944  -2.122
  173    HB   THR  21           HB       THR  21   9.259   2.398  -1.389
  174    HG1  THR  21           HG1      THR  21  10.279   1.347  -3.821
  175   HG21  THR  21          HG21      THR  21  10.769   4.152  -1.552
  176   HG22  THR  21          HG22      THR  21  10.285   3.980  -3.239
  177   HG23  THR  21          HG23      THR  21  11.810   3.288  -2.684
  178    H    LEU  22           H        LEU  22  10.129   1.347   0.974
  179    HA   LEU  22           HA       LEU  22  11.911   3.382   2.014
  180    HB2  LEU  22           HB2      LEU  22  10.047   1.386   3.333
  181    HB3  LEU  22           HB3      LEU  22  10.825   2.717   4.186
  182    HG   LEU  22           HG       LEU  22   9.024   3.076   1.770
  183   HD11  LEU  22          HD11      LEU  22   7.394   3.957   3.472
  184   HD12  LEU  22          HD12      LEU  22   8.456   3.338   4.737
  185   HD13  LEU  22          HD13      LEU  22   7.690   2.223   3.605
  186   HD21  LEU  22          HD21      LEU  22  10.378   4.957   3.715
  187   HD22  LEU  22          HD22      LEU  22   8.991   5.457   2.746
  188   HD23  LEU  22          HD23      LEU  22  10.484   4.949   1.955
  189    H    ARG  23           H        ARG  23  12.015  -0.135   1.949
  190    HA   ARG  23           HA       ARG  23  13.866  -0.673   4.020
  191    HB2  ARG  23           HB2      ARG  23  12.864  -1.939   1.560
  192    HB3  ARG  23           HB3      ARG  23  14.485  -2.470   2.007
  193    HG2  ARG  23           HG2      ARG  23  13.578  -2.823   4.367
  194    HG3  ARG  23           HG3      ARG  23  11.967  -2.601   3.680
  195    HD2  ARG  23           HD2      ARG  23  12.149  -4.543   2.324
  196    HD3  ARG  23           HD3      ARG  23  13.910  -4.621   2.529
  197    HE   ARG  23           HE       ARG  23  11.908  -5.286   4.640
  198   HH11  ARG  23          HH11      ARG  23  13.851  -7.311   3.563
  199   HH12  ARG  23          HH12      ARG  23  15.084  -7.313   4.780
  200   HH21  ARG  23          HH21      ARG  23  14.055  -4.304   6.189
  201   HH22  ARG  23          HH22      ARG  23  15.200  -5.602   6.275
  202    HA   PRO  24           HA       PRO  24  17.516   0.001   1.033
  203    HB2  PRO  24           HB2      PRO  24  17.047   0.830  -1.531
  204    HB3  PRO  24           HB3      PRO  24  17.066  -0.880  -1.060
  205    HG2  PRO  24           HG2      PRO  24  14.760   0.912  -1.585
  206    HG3  PRO  24           HG3      PRO  24  14.950  -0.813  -1.922
  207    HD2  PRO  24           HD2      PRO  24  13.524   0.223   0.193
  208    HD3  PRO  24           HD3      PRO  24  14.195  -1.419   0.131
  209    H    GLU  25           H        GLU  25  16.460   1.913   2.670
  210    HA   GLU  25           HA       GLU  25  17.565   4.405   1.663
  211    HB2  GLU  25           HB2      GLU  25  15.038   3.874   0.782
  212    HB3  GLU  25           HB3      GLU  25  14.675   4.711   2.291
  213    HG2  GLU  25           HG2      GLU  25  14.859   6.544   0.903
  214    HG3  GLU  25           HG3      GLU  25  16.552   6.384   1.370
  215    H    ARG  26           H        ARG  26  15.194   3.052   3.991
  216    HA   ARG  26           HA       ARG  26  16.723   4.349   6.212
  217    HB2  ARG  26           HB2      ARG  26  14.599   5.572   5.313
  218    HB3  ARG  26           HB3      ARG  26  13.708   4.280   6.117
  219    HG2  ARG  26           HG2      ARG  26  14.309   4.987   8.227
  220    HG3  ARG  26           HG3      ARG  26  15.852   5.646   7.683
  221    HD2  ARG  26           HD2      ARG  26  13.439   6.992   6.584
  222    HD3  ARG  26           HD3      ARG  26  13.733   7.222   8.319
  223    HE   ARG  26           HE       ARG  26  15.969   7.628   6.377
  224   HH11  ARG  26          HH11      ARG  26  16.377   8.169   9.279
  225   HH12  ARG  26          HH12      ARG  26  16.121   9.879   9.383
  226   HH21  ARG  26          HH21      ARG  26  14.532  10.085   6.295
  227   HH22  ARG  26          HH22      ARG  26  15.071  10.969   7.684
  Start of MODEL   31
    1    HA   ARG   1           HA       ARG   1 -17.343  -0.049  -8.787
    2    HB2  ARG   1           HB2      ARG   1 -15.743   1.796  -9.781
    3    HB3  ARG   1           HB3      ARG   1 -14.829   1.532  -8.295
    4    HG2  ARG   1           HG2      ARG   1 -13.833  -0.115  -9.530
    5    HG3  ARG   1           HG3      ARG   1 -15.252  -1.040  -9.040
    6    HD2  ARG   1           HD2      ARG   1 -15.105  -1.303 -11.424
    7    HD3  ARG   1           HD3      ARG   1 -16.387  -0.103 -11.166
    8    HE   ARG   1           HE       ARG   1 -14.594   1.658 -11.530
    9   HH11  ARG   1          HH11      ARG   1 -12.195  -0.056 -11.570
   10   HH12  ARG   1          HH12      ARG   1 -11.925  -0.312 -13.261
   11   HH21  ARG   1          HH21      ARG   1 -15.128   0.678 -14.186
   12   HH22  ARG   1          HH22      ARG   1 -13.594   0.106 -14.750
   13    H    SER   2           H        SER   2 -18.444  -0.143  -6.482
   14    HA   SER   2           HA       SER   2 -18.296  -0.910  -4.259
   15    HB2  SER   2           HB2      SER   2 -16.070  -1.911  -5.750
   16    HB3  SER   2           HB3      SER   2 -15.497  -1.509  -4.135
   17    HG   SER   2           HG       SER   2 -17.012  -3.569  -4.931
   18    H    ALA   3           H        ALA   3 -16.625  -0.623  -2.221
   19    HA   ALA   3           HA       ALA   3 -15.456   2.119  -2.227
   20    HB1  ALA   3           HB1      ALA   3 -17.577   1.167  -0.276
   21    HB2  ALA   3           HB2      ALA   3 -17.900   2.219  -1.654
   22    HB3  ALA   3           HB3      ALA   3 -16.859   2.776  -0.344
   23    H    LEU   4           H        LEU   4 -16.174  -0.786  -0.245
   24    HA   LEU   4           HA       LEU   4 -13.951  -0.276   1.591
   25    HB2  LEU   4           HB2      LEU   4 -16.257  -2.029   1.317
   26    HB3  LEU   4           HB3      LEU   4 -14.833  -2.937   1.824
   27    HG   LEU   4           HG       LEU   4 -14.487  -1.004   3.533
   28   HD11  LEU   4          HD11      LEU   4 -17.399  -0.659   2.761
   29   HD12  LEU   4          HD12      LEU   4 -16.123   0.554   2.656
   30   HD13  LEU   4          HD13      LEU   4 -16.686   0.001   4.233
   31   HD21  LEU   4          HD21      LEU   4 -15.127  -3.314   4.138
   32   HD22  LEU   4          HD22      LEU   4 -16.816  -2.934   3.807
   33   HD23  LEU   4          HD23      LEU   4 -15.980  -2.143   5.143
   34    H    VAL   5           H        VAL   5 -14.494  -2.265  -1.273
   35    HA   VAL   5           HA       VAL   5 -12.184  -3.964  -1.042
   36    HB   VAL   5           HB       VAL   5 -13.735  -2.955  -3.456
   37   HG11  VAL   5          HG11      VAL   5 -12.868  -4.942  -4.601
   38   HG12  VAL   5          HG12      VAL   5 -11.966  -5.403  -3.158
   39   HG13  VAL   5          HG13      VAL   5 -11.528  -3.942  -4.042
   40   HG21  VAL   5          HG21      VAL   5 -15.354  -4.101  -2.274
   41   HG22  VAL   5          HG22      VAL   5 -14.175  -5.098  -1.421
   42   HG23  VAL   5          HG23      VAL   5 -14.600  -5.467  -3.093
   43    H    ASN   6           H        ASN   6 -12.696  -0.962  -2.952
   44    HA   ASN   6           HA       ASN   6 -10.005  -0.737  -3.918
   45    HB2  ASN   6           HB2      ASN   6 -12.426   0.522  -4.291
   46    HB3  ASN   6           HB3      ASN   6 -11.517   1.757  -3.421
   47   HD21  ASN   6          HD21      ASN   6 -12.293   1.823  -6.295
   48   HD22  ASN   6          HD22      ASN   6 -10.842   1.911  -7.172
   49    H    SER   7           H        SER   7 -11.590   0.570  -0.978
   50    HA   SER   7           HA       SER   7  -9.466   2.237  -0.061
   51    HB2  SER   7           HB2      SER   7 -11.885   1.920   0.786
   52    HB3  SER   7           HB3      SER   7 -11.264   0.541   1.689
   53    HG   SER   7           HG       SER   7 -11.197   2.437   2.942
   54    H    TYR   8           H        TYR   8 -10.133  -1.219   0.632
   55    HA   TYR   8           HA       TYR   8  -7.781  -1.664   2.243
   56    HB2  TYR   8           HB2      TYR   8  -9.584  -3.196   2.435
   57    HB3  TYR   8           HB3      TYR   8  -9.741  -3.363   0.687
   58    HD1  TYR   8           HD1      TYR   8  -7.282  -3.959   3.457
   59    HD2  TYR   8           HD2      TYR   8  -8.755  -5.193  -0.385
   60    HE1  TYR   8           HE2      TYR   8  -5.762  -5.917   3.502
   61    HE2  TYR   8           HE1      TYR   8  -7.235  -7.151  -0.339
   62    HH   TYR   8           HH       TYR   8  -5.974  -8.438   2.131
   63    H    LEU   9           H        LEU   9  -8.498  -2.112  -1.224
   64    HA   LEU   9           HA       LEU   9  -6.008  -3.294  -2.002
   65    HB2  LEU   9           HB2      LEU   9  -8.336  -1.913  -3.237
   66    HB3  LEU   9           HB3      LEU   9  -6.869  -1.949  -4.211
   67    HG   LEU   9           HG       LEU   9  -8.095  -4.401  -2.917
   68   HD11  LEU   9          HD11      LEU   9  -8.993  -4.960  -5.092
   69   HD12  LEU   9          HD12      LEU   9  -8.222  -3.554  -5.824
   70   HD13  LEU   9          HD13      LEU   9  -9.548  -3.337  -4.682
   71   HD21  LEU   9          HD21      LEU   9  -5.822  -3.906  -4.846
   72   HD22  LEU   9          HD22      LEU   9  -6.608  -5.480  -4.734
   73   HD23  LEU   9          HD23      LEU   9  -5.791  -4.801  -3.327
   74    H    TRP  10           H        TRP  10  -7.064   0.102  -1.782
   75    HA   TRP  10           HA       TRP  10  -4.762   1.347  -2.924
   76    HB2  TRP  10           HB2      TRP  10  -6.749   2.605  -2.619
   77    HB3  TRP  10           HB3      TRP  10  -6.907   2.111  -0.937
   78    HD1  TRP  10           HD1      TRP  10  -4.510   4.207  -3.136
   79    HE1  TRP  10           HE1      TRP  10  -3.585   6.132  -1.691
   80    HE3  TRP  10           HE3      TRP  10  -6.635   3.036   1.354
   81    HZ2  TRP  10           HZ2      TRP  10  -3.726   7.050   1.015
   82    HZ3  TRP  10           HZ3      TRP  10  -6.223   4.448   3.347
   83    HH2  TRP  10           HH2      TRP  10  -4.772   6.453   3.184
   84    H    GLN  11           H        GLN  11  -5.507   0.506   0.485
   85    HA   GLN  11           HA       GLN  11  -3.086   1.573   1.610
   86    HB2  GLN  11           HB2      GLN  11  -5.458   0.267   2.441
   87    HB3  GLN  11           HB3      GLN  11  -4.127  -0.724   3.037
   88    HG2  GLN  11           HG2      GLN  11  -3.700   2.170   3.384
   89    HG3  GLN  11           HG3      GLN  11  -5.077   1.538   4.286
   90   HE21  GLN  11          HE21      GLN  11  -1.579   0.894   3.706
   91   HE22  GLN  11          HE22      GLN  11  -1.306   0.199   5.230
   92    H    ARG  12           H        ARG  12  -3.890  -1.600   0.220
   93    HA   ARG  12           HA       ARG  12  -1.481  -2.962   1.059
   94    HB2  ARG  12           HB2      ARG  12  -3.890  -3.459  -0.414
   95    HB3  ARG  12           HB3      ARG  12  -2.531  -4.008  -1.393
   96    HG2  ARG  12           HG2      ARG  12  -2.764  -4.714   1.537
   97    HG3  ARG  12           HG3      ARG  12  -3.513  -5.701   0.281
   98    HD2  ARG  12           HD2      ARG  12  -0.703  -5.013  -0.302
   99    HD3  ARG  12           HD3      ARG  12  -0.911  -6.006   1.154
  100    HE   ARG  12           HE       ARG  12  -2.517  -7.371  -0.473
  101   HH11  ARG  12          HH11      ARG  12   0.209  -8.448  -0.338
  102   HH12  ARG  12          HH12      ARG  12   0.750  -8.385  -1.983
  103   HH21  ARG  12          HH21      ARG  12  -1.731  -6.167  -2.988
  104   HH22  ARG  12          HH22      ARG  12  -0.357  -7.095  -3.492
  105    H    TRP  13           H        TRP  13  -2.364  -1.111  -1.863
  106    HA   TRP  13           HA       TRP  13  -0.068  -1.716  -3.444
  107    HB2  TRP  13           HB2      TRP  13  -1.381  -0.495  -4.824
  108    HB3  TRP  13           HB3      TRP  13  -2.369   0.010  -3.461
  109    HD1  TRP  13           HD1      TRP  13  -2.444   2.505  -3.096
  110    HE1  TRP  13           HE1      TRP  13  -0.937   4.517  -3.675
  111    HE3  TRP  13           HE3      TRP  13   1.489   0.075  -5.256
  112    HZ2  TRP  13           HZ2      TRP  13   1.600   5.027  -4.894
  113    HZ3  TRP  13           HZ3      TRP  13   3.436   1.343  -6.118
  114    HH2  TRP  13           HH2      TRP  13   3.496   3.814  -5.938
  115    H    GLU  14           H        GLU  14  -0.622   0.976  -1.132
  116    HA   GLU  14           HA       GLU  14   2.028   2.099  -1.433
  117    HB2  GLU  14           HB2      GLU  14  -0.261   2.308   0.513
  118    HB3  GLU  14           HB3      GLU  14   1.273   3.105   0.872
  119    HG2  GLU  14           HG2      GLU  14   1.165   4.186  -1.395
  120    HG3  GLU  14           HG3      GLU  14  -0.452   3.511  -1.583
  121    H    ASN  15           H        ASN  15   0.588  -0.265   0.822
  122    HA   ASN  15           HA       ASN  15   2.796  -0.540   2.614
  123    HB2  ASN  15           HB2      ASN  15   0.753  -1.547   3.242
  124    HB3  ASN  15           HB3      ASN  15   0.527  -2.288   1.659
  125   HD21  ASN  15          HD21      ASN  15   3.371  -2.373   3.896
  126   HD22  ASN  15          HD22      ASN  15   3.423  -4.067   3.990
  127    H    TRP  16           H        TRP  16   1.969  -2.361  -0.362
  128    HA   TRP  16           HA       TRP  16   4.376  -3.956  -0.400
  129    HB2  TRP  16           HB2      TRP  16   2.564  -4.772  -1.669
  130    HB3  TRP  16           HB3      TRP  16   2.196  -3.181  -2.338
  131    HD1  TRP  16           HD1      TRP  16   4.725  -6.050  -2.668
  132    HE1  TRP  16           HE1      TRP  16   5.872  -5.876  -4.969
  133    HE3  TRP  16           HE3      TRP  16   2.767  -1.620  -4.295
  134    HZ2  TRP  16           HZ2      TRP  16   5.952  -4.094  -7.201
  135    HZ3  TRP  16           HZ3      TRP  16   3.399  -0.709  -6.510
  136    HH2  TRP  16           HH2      TRP  16   4.986  -1.939  -7.965
  137    H    PHE  17           H        PHE  17   3.438  -0.878  -1.958
  138    HA   PHE  17           HA       PHE  17   5.710  -0.437  -3.579
  139    HB2  PHE  17           HB2      PHE  17   3.736   0.953  -3.687
  140    HB3  PHE  17           HB3      PHE  17   3.901   1.415  -1.995
  141    HD1  PHE  17           HD1      PHE  17   5.645   1.609  -5.298
  142    HD2  PHE  17           HD2      PHE  17   5.151   3.316  -1.387
  143    HE1  PHE  17           HE2      PHE  17   7.067   3.531  -5.955
  144    HE2  PHE  17           HE1      PHE  17   6.573   5.237  -2.045
  145    HZ   PHE  17           HZ       PHE  17   7.531   5.344  -4.328
  146    H    TRP  18           H        TRP  18   5.179   0.843  -0.257
  147    HA   TRP  18           HA       TRP  18   7.862   1.781   0.111
  148    HB2  TRP  18           HB2      TRP  18   5.586   0.993   1.941
  149    HB3  TRP  18           HB3      TRP  18   7.110   1.610   2.579
  150    HD1  TRP  18           HD1      TRP  18   3.897   2.886   1.913
  151    HE1  TRP  18           HE1      TRP  18   3.910   5.369   1.220
  152    HE3  TRP  18           HE3      TRP  18   8.830   3.443   0.710
  153    HZ2  TRP  18           HZ2      TRP  18   5.767   7.332   0.282
  154    HZ3  TRP  18           HZ3      TRP  18   9.692   5.628  -0.080
  155    HH2  TRP  18           HH2      TRP  18   8.168   7.571  -0.296
  156    H    ASN  19           H        ASN  19   6.339  -1.374   0.734
  157    HA   ASN  19           HA       ASN  19   8.314  -2.628   2.315
  158    HB2  ASN  19           HB2      ASN  19   6.058  -3.495   1.616
  159    HB3  ASN  19           HB3      ASN  19   6.723  -3.816   0.016
  160   HD21  ASN  19          HD21      ASN  19   6.552  -4.994   3.305
  161   HD22  ASN  19          HD22      ASN  19   7.502  -6.380   3.063
  162    H    VAL  20           H        VAL  20   8.271  -2.095  -1.217
  163    HA   VAL  20           HA       VAL  20  10.965  -3.380  -1.423
  164    HB   VAL  20           HB       VAL  20  10.442  -3.382  -3.865
  165   HG11  VAL  20          HG11      VAL  20   8.743  -5.104  -3.763
  166   HG12  VAL  20          HG12      VAL  20   8.170  -4.510  -2.205
  167   HG13  VAL  20          HG13      VAL  20   9.762  -5.258  -2.333
  168   HG21  VAL  20          HG21      VAL  20   8.311  -2.648  -4.689
  169   HG22  VAL  20          HG22      VAL  20   8.948  -1.322  -3.719
  170   HG23  VAL  20          HG23      VAL  20   7.700  -2.377  -3.060
  171    H    THR  21           H        THR  21   9.339  -0.276  -1.664
  172    HA   THR  21           HA       THR  21  11.474   1.065  -3.135
  173    HB   THR  21           HB       THR  21   9.115   2.044  -1.498
  174    HG1  THR  21           HG1      THR  21   8.326   1.066  -3.251
  175   HG21  THR  21          HG21      THR  21  10.440   3.951  -1.580
  176   HG22  THR  21          HG22      THR  21   9.558   4.099  -3.101
  177   HG23  THR  21          HG23      THR  21  11.208   3.477  -3.095
  178    H    LEU  22           H        LEU  22  10.751   0.483   0.262
  179    HA   LEU  22           HA       LEU  22  12.555   2.508   1.312
  180    HB2  LEU  22           HB2      LEU  22  11.154   0.068   2.410
  181    HB3  LEU  22           HB3      LEU  22  12.211   1.056   3.417
  182    HG   LEU  22           HG       LEU  22   9.809   2.100   1.883
  183   HD11  LEU  22          HD11      LEU  22  10.182   1.626   4.857
  184   HD12  LEU  22          HD12      LEU  22   9.199   0.626   3.788
  185   HD13  LEU  22          HD13      LEU  22   8.749   2.305   4.085
  186   HD21  LEU  22          HD21      LEU  22  11.308   3.911   2.118
  187   HD22  LEU  22          HD22      LEU  22  11.869   3.358   3.696
  188   HD23  LEU  22          HD23      LEU  22  10.262   4.064   3.529
  189    H    ARG  23           H        ARG  23  13.086  -0.558  -0.120
  190    HA   ARG  23           HA       ARG  23  15.004  -1.896  -0.363
  191    HB2  ARG  23           HB2      ARG  23  16.074   0.817   0.422
  192    HB3  ARG  23           HB3      ARG  23  17.166  -0.528   0.103
  193    HG2  ARG  23           HG2      ARG  23  15.748  -0.798  -2.093
  194    HG3  ARG  23           HG3      ARG  23  15.302   0.880  -1.785
  195    HD2  ARG  23           HD2      ARG  23  18.085   0.809  -1.382
  196    HD3  ARG  23           HD3      ARG  23  17.803  -0.171  -2.836
  197    HE   ARG  23           HE       ARG  23  16.395   1.791  -3.669
  198   HH11  ARG  23          HH11      ARG  23  19.266   2.495  -3.905
  199   HH12  ARG  23          HH12      ARG  23  19.356   4.020  -3.088
  200   HH21  ARG  23          HH21      ARG  23  16.308   3.621  -1.461
  201   HH22  ARG  23          HH22      ARG  23  17.675   4.660  -1.698
  202    HA   PRO  24           HA       PRO  24  15.103  -2.762   4.173
  203    HB2  PRO  24           HB2      PRO  24  14.158  -5.325   3.997
  204    HB3  PRO  24           HB3      PRO  24  13.093  -3.910   4.113
  205    HG2  PRO  24           HG2      PRO  24  13.808  -5.550   1.748
  206    HG3  PRO  24           HG3      PRO  24  12.285  -4.740   2.147
  207    HD2  PRO  24           HD2      PRO  24  14.147  -3.797   0.340
  208    HD3  PRO  24           HD3      PRO  24  12.920  -2.801   1.150
  209    H    GLU  25           H        GLU  25  17.458  -2.632   3.027
  210    HA   GLU  25           HA       GLU  25  18.716  -5.310   3.442
  211    HB2  GLU  25           HB2      GLU  25  20.050  -4.941   1.388
  212    HB3  GLU  25           HB3      GLU  25  18.325  -4.945   1.024
  213    HG2  GLU  25           HG2      GLU  25  18.407  -2.401   1.234
  214    HG3  GLU  25           HG3      GLU  25  20.163  -2.550   1.252
  215    H    ARG  26           H        ARG  26  20.733  -5.186   4.463
  216    HA   ARG  26           HA       ARG  26  22.023  -2.516   4.792
  217    HB2  ARG  26           HB2      ARG  26  20.344  -2.978   6.628
  218    HB3  ARG  26           HB3      ARG  26  21.319  -4.374   7.087
  219    HG2  ARG  26           HG2      ARG  26  23.100  -2.170   6.841
  220    HG3  ARG  26           HG3      ARG  26  21.716  -1.610   7.779
  221    HD2  ARG  26           HD2      ARG  26  23.195  -2.544   9.403
  222    HD3  ARG  26           HD3      ARG  26  21.997  -3.824   9.125
  223    HE   ARG  26           HE       ARG  26  23.616  -4.990   7.735
  224   HH11  ARG  26          HH11      ARG  26  25.227  -4.169  10.216
  225   HH12  ARG  26          HH12      ARG  26  26.682  -3.584   9.482
  226   HH21  ARG  26          HH21      ARG  26  25.284  -3.325   6.308
  227   HH22  ARG  26          HH22      ARG  26  26.715  -3.105   7.260
  Start of MODEL   32
    1    HA   ARG   1           HA       ARG   1 -20.230   2.760  -3.805
    2    HB2  ARG   1           HB2      ARG   1 -21.892   4.363  -2.120
    3    HB3  ARG   1           HB3      ARG   1 -20.273   4.369  -1.424
    4    HG2  ARG   1           HG2      ARG   1 -19.299   5.207  -3.426
    5    HG3  ARG   1           HG3      ARG   1 -20.745   4.851  -4.371
    6    HD2  ARG   1           HD2      ARG   1 -20.767   6.829  -2.068
    7    HD3  ARG   1           HD3      ARG   1 -20.447   7.312  -3.746
    8    HE   ARG   1           HE       ARG   1 -22.701   5.943  -4.152
    9   HH11  ARG   1          HH11      ARG   1 -22.905   6.160  -1.025
   10   HH12  ARG   1          HH12      ARG   1 -24.071   7.434  -0.899
   11   HH21  ARG   1          HH21      ARG   1 -23.763   8.394  -4.226
   12   HH22  ARG   1          HH22      ARG   1 -24.559   8.705  -2.721
   13    H    SER   2           H        SER   2 -18.160   2.188  -3.103
   14    HA   SER   2           HA       SER   2 -18.002   0.376  -0.758
   15    HB2  SER   2           HB2      SER   2 -16.025   1.163  -2.924
   16    HB3  SER   2           HB3      SER   2 -15.760  -0.103  -1.729
   17    HG   SER   2           HG       SER   2 -16.708  -0.622  -3.936
   18    H    ALA   3           H        ALA   3 -17.055   0.992   1.160
   19    HA   ALA   3           HA       ALA   3 -15.729   3.682   1.259
   20    HB1  ALA   3           HB1      ALA   3 -16.505   3.668   3.613
   21    HB2  ALA   3           HB2      ALA   3 -17.171   2.052   3.377
   22    HB3  ALA   3           HB3      ALA   3 -17.850   3.421   2.498
   23    H    LEU   4           H        LEU   4 -15.553   0.351   2.559
   24    HA   LEU   4           HA       LEU   4 -12.757   0.886   3.469
   25    HB2  LEU   4           HB2      LEU   4 -14.977  -0.990   4.210
   26    HB3  LEU   4           HB3      LEU   4 -13.316  -1.455   4.571
   27    HG   LEU   4           HG       LEU   4 -13.304   1.111   5.470
   28   HD11  LEU   4          HD11      LEU   4 -15.398   1.498   6.700
   29   HD12  LEU   4          HD12      LEU   4 -16.079   0.016   6.029
   30   HD13  LEU   4          HD13      LEU   4 -15.719   1.379   4.970
   31   HD21  LEU   4          HD21      LEU   4 -13.676   0.089   7.740
   32   HD22  LEU   4          HD22      LEU   4 -12.518  -0.799   6.750
   33   HD23  LEU   4          HD23      LEU   4 -14.164  -1.402   6.936
   34    H    VAL   5           H        VAL   5 -14.626  -0.951   1.156
   35    HA   VAL   5           HA       VAL   5 -12.832  -3.097   0.603
   36    HB   VAL   5           HB       VAL   5 -14.755  -1.555  -1.176
   37   HG11  VAL   5          HG11      VAL   5 -14.791  -3.851  -2.376
   38   HG12  VAL   5          HG12      VAL   5 -13.259  -4.148  -1.554
   39   HG13  VAL   5          HG13      VAL   5 -13.411  -2.793  -2.673
   40   HG21  VAL   5          HG21      VAL   5 -15.844  -2.529   0.787
   41   HG22  VAL   5          HG22      VAL   5 -15.061  -4.080   0.484
   42   HG23  VAL   5          HG23      VAL   5 -16.273  -3.469  -0.642
   43    H    ASN   6           H        ASN   6 -13.129   0.069  -1.081
   44    HA   ASN   6           HA       ASN   6 -10.809  -0.317  -2.755
   45    HB2  ASN   6           HB2      ASN   6 -12.878   1.610  -2.278
   46    HB3  ASN   6           HB3      ASN   6 -11.331   2.455  -2.255
   47   HD21  ASN   6          HD21      ASN   6 -10.085   2.521  -4.243
   48   HD22  ASN   6          HD22      ASN   6 -10.726   1.991  -5.722
   49    H    SER   7           H        SER   7 -11.256   1.065   0.493
   50    HA   SER   7           HA       SER   7  -8.757   2.383   0.812
   51    HB2  SER   7           HB2      SER   7 -10.716   0.985   2.624
   52    HB3  SER   7           HB3      SER   7  -9.220   1.633   3.286
   53    HG   SER   7           HG       SER   7 -11.461   2.924   2.626
   54    H    TYR   8           H        TYR   8  -9.653  -1.028   1.427
   55    HA   TYR   8           HA       TYR   8  -7.001  -1.856   2.261
   56    HB2  TYR   8           HB2      TYR   8  -8.920  -3.142   2.918
   57    HB3  TYR   8           HB3      TYR   8  -9.502  -3.248   1.257
   58    HD1  TYR   8           HD1      TYR   8  -6.612  -4.210   3.432
   59    HD2  TYR   8           HD2      TYR   8  -8.913  -5.082  -0.088
   60    HE1  TYR   8           HE1      TYR   8  -5.325  -6.304   3.110
   61    HE2  TYR   8           HE2      TYR   8  -7.628  -7.178  -0.409
   62    HH   TYR   8           HH       TYR   8  -6.155  -8.751   1.588
   63    H    LEU   9           H        LEU   9  -8.783  -1.879  -0.823
   64    HA   LEU   9           HA       LEU   9  -6.881  -3.300  -2.415
   65    HB2  LEU   9           HB2      LEU   9  -9.145  -1.386  -2.805
   66    HB3  LEU   9           HB3      LEU   9  -8.088  -1.669  -4.184
   67    HG   LEU   9           HG       LEU   9  -9.437  -3.861  -2.581
   68   HD11  LEU   9          HD11      LEU   9 -11.000  -4.065  -4.399
   69   HD12  LEU   9          HD12      LEU   9 -10.118  -2.885  -5.367
   70   HD13  LEU   9          HD13      LEU   9 -10.986  -2.366  -3.923
   71   HD21  LEU   9          HD21      LEU   9  -7.505  -4.787  -3.584
   72   HD22  LEU   9          HD22      LEU   9  -7.673  -3.794  -5.032
   73   HD23  LEU   9          HD23      LEU   9  -8.782  -5.135  -4.749
   74    H    TRP  10           H        TRP  10  -7.334   0.229  -1.948
   75    HA   TRP  10           HA       TRP  10  -5.070   1.049  -3.517
   76    HB2  TRP  10           HB2      TRP  10  -6.907   2.540  -2.924
   77    HB3  TRP  10           HB3      TRP  10  -6.584   2.314  -1.206
   78    HD1  TRP  10           HD1      TRP  10  -5.872   4.706  -0.550
   79    HE1  TRP  10           HE1      TRP  10  -3.927   6.260  -1.223
   80    HE3  TRP  10           HE3      TRP  10  -3.991   2.108  -4.530
   81    HZ2  TRP  10           HZ2      TRP  10  -1.851   6.384  -3.184
   82    HZ3  TRP  10           HZ3      TRP  10  -2.032   2.969  -5.778
   83    HH2  TRP  10           HH2      TRP  10  -0.961   5.101  -5.111
   84    H    GLN  11           H        GLN  11  -5.449   0.208  -0.077
   85    HA   GLN  11           HA       GLN  11  -2.893   1.046   0.870
   86    HB2  GLN  11           HB2      GLN  11  -5.103  -0.739   1.661
   87    HB3  GLN  11           HB3      GLN  11  -3.539  -1.220   2.317
   88    HG2  GLN  11           HG2      GLN  11  -3.330   1.355   2.880
   89    HG3  GLN  11           HG3      GLN  11  -5.091   1.303   2.779
   90   HE21  GLN  11          HE21      GLN  11  -2.485  -0.770   4.213
   91   HE22  GLN  11          HE22      GLN  11  -3.305  -1.024   5.677
   92    H    ARG  12           H        ARG  12  -3.939  -2.078  -0.534
   93    HA   ARG  12           HA       ARG  12  -1.570  -3.583  -0.255
   94    HB2  ARG  12           HB2      ARG  12  -3.964  -4.073  -1.235
   95    HB3  ARG  12           HB3      ARG  12  -3.222  -3.628  -2.772
   96    HG2  ARG  12           HG2      ARG  12  -1.421  -5.314  -2.334
   97    HG3  ARG  12           HG3      ARG  12  -2.299  -5.819  -0.889
   98    HD2  ARG  12           HD2      ARG  12  -3.184  -7.335  -2.415
   99    HD3  ARG  12           HD3      ARG  12  -4.318  -5.992  -2.669
  100    HE   ARG  12           HE       ARG  12  -2.883  -5.273  -4.583
  101   HH11  ARG  12          HH11      ARG  12  -0.527  -7.047  -3.692
  102   HH12  ARG  12          HH12      ARG  12  -0.590  -8.291  -4.893
  103   HH21  ARG  12          HH21      ARG  12  -3.800  -7.473  -5.949
  104   HH22  ARG  12          HH22      ARG  12  -2.451  -8.535  -6.176
  105    H    TRP  13           H        TRP  13  -2.393  -1.126  -2.692
  106    HA   TRP  13           HA       TRP  13  -0.223  -1.527  -4.503
  107    HB2  TRP  13           HB2      TRP  13  -2.411   0.187  -4.138
  108    HB3  TRP  13           HB3      TRP  13  -1.015   1.258  -4.092
  109    HD1  TRP  13           HD1      TRP  13  -3.194   1.024  -6.474
  110    HE1  TRP  13           HE1      TRP  13  -2.331   0.608  -8.872
  111    HE3  TRP  13           HE3      TRP  13   1.421  -0.888  -5.428
  112    HZ2  TRP  13           HZ2      TRP  13   0.011  -0.399 -10.168
  113    HZ3  TRP  13           HZ3      TRP  13   2.947  -1.564  -7.260
  114    HH2  TRP  13           HH2      TRP  13   2.249  -1.321  -9.624
  115    H    GLU  14           H        GLU  14  -0.522   0.982  -1.967
  116    HA   GLU  14           HA       GLU  14   2.278   1.715  -2.082
  117    HB2  GLU  14           HB2      GLU  14   0.075   2.239  -0.061
  118    HB3  GLU  14           HB3      GLU  14   1.612   3.103  -0.128
  119    HG2  GLU  14           HG2      GLU  14   0.849   3.397  -2.699
  120    HG3  GLU  14           HG3      GLU  14  -0.742   3.288  -1.943
  121    H    ASN  15           H        ASN  15   0.390  -0.522  -0.074
  122    HA   ASN  15           HA       ASN  15   2.094  -0.942   2.119
  123    HB2  ASN  15           HB2      ASN  15  -0.003  -2.051   2.043
  124    HB3  ASN  15           HB3      ASN  15   0.322  -2.737   0.453
  125   HD21  ASN  15          HD21      ASN  15   2.424  -2.760   3.394
  126   HD22  ASN  15          HD22      ASN  15   2.508  -4.453   3.488
  127    H    TRP  16           H        TRP  16   2.260  -2.545  -1.088
  128    HA   TRP  16           HA       TRP  16   4.721  -3.978  -0.489
  129    HB2  TRP  16           HB2      TRP  16   3.405  -4.950  -2.168
  130    HB3  TRP  16           HB3      TRP  16   2.981  -3.393  -2.876
  131    HD1  TRP  16           HD1      TRP  16   5.805  -5.974  -2.771
  132    HE1  TRP  16           HE1      TRP  16   7.403  -5.533  -4.742
  133    HE3  TRP  16           HE3      TRP  16   3.847  -1.594  -4.533
  134    HZ2  TRP  16           HZ2      TRP  16   7.801  -3.584  -6.793
  135    HZ3  TRP  16           HZ3      TRP  16   4.861  -0.469  -6.494
  136    HH2  TRP  16           HH2      TRP  16   6.835  -1.458  -7.623
  137    H    PHE  17           H        PHE  17   3.914  -0.973  -2.244
  138    HA   PHE  17           HA       PHE  17   6.488  -0.306  -3.227
  139    HB2  PHE  17           HB2      PHE  17   4.648   0.927  -4.019
  140    HB3  PHE  17           HB3      PHE  17   4.011   1.196  -2.399
  141    HD1  PHE  17           HD1      PHE  17   7.048   1.972  -4.472
  142    HD2  PHE  17           HD2      PHE  17   4.361   3.260  -1.377
  143    HE1  PHE  17           HE2      PHE  17   8.219   4.154  -4.362
  144    HE2  PHE  17           HE1      PHE  17   5.535   5.441  -1.268
  145    HZ   PHE  17           HZ       PHE  17   7.464   5.889  -2.760
  146    H    TRP  18           H        TRP  18   4.975   0.539  -0.083
  147    HA   TRP  18           HA       TRP  18   7.149   2.107   0.922
  148    HB2  TRP  18           HB2      TRP  18   4.907   0.506   2.168
  149    HB3  TRP  18           HB3      TRP  18   6.032   1.441   3.153
  150    HD1  TRP  18           HD1      TRP  18   2.765   1.854   2.027
  151    HE1  TRP  18           HE1      TRP  18   2.148   4.292   1.467
  152    HE3  TRP  18           HE3      TRP  18   7.436   3.886   1.642
  153    HZ2  TRP  18           HZ2      TRP  18   3.458   6.774   0.931
  154    HZ3  TRP  18           HZ3      TRP  18   7.721   6.287   1.109
  155    HH2  TRP  18           HH2      TRP  18   5.739   7.733   0.754
  156    H    ASN  19           H        ASN  19   6.319  -1.304   1.765
  157    HA   ASN  19           HA       ASN  19   8.700  -1.821   3.253
  158    HB2  ASN  19           HB2      ASN  19   6.371  -3.192   2.303
  159    HB3  ASN  19           HB3      ASN  19   7.778  -4.198   1.957
  160   HD21  ASN  19          HD21      ASN  19   5.866  -2.758   4.562
  161   HD22  ASN  19          HD22      ASN  19   6.637  -3.587   5.826
  162    H    VAL  20           H        VAL  20   8.157  -1.876  -0.245
  163    HA   VAL  20           HA       VAL  20  10.718  -3.280  -0.743
  164    HB   VAL  20           HB       VAL  20   8.514  -2.154  -2.499
  165   HG11  VAL  20          HG11      VAL  20  10.578  -2.078  -3.772
  166   HG12  VAL  20          HG12      VAL  20   9.637  -3.463  -4.323
  167   HG13  VAL  20          HG13      VAL  20  11.011  -3.705  -3.245
  168   HG21  VAL  20          HG21      VAL  20   7.522  -4.143  -2.136
  169   HG22  VAL  20          HG22      VAL  20   8.802  -4.559  -1.000
  170   HG23  VAL  20          HG23      VAL  20   8.962  -4.987  -2.703
  171    H    THR  21           H        THR  21   9.481   0.030  -0.736
  172    HA   THR  21           HA       THR  21  11.938   0.997  -2.117
  173    HB   THR  21           HB       THR  21   9.341   2.338  -1.312
  174    HG1  THR  21           HG1      THR  21  10.378   1.463  -3.808
  175   HG21  THR  21          HG21      THR  21  10.379   3.982  -3.163
  176   HG22  THR  21          HG22      THR  21  11.884   3.373  -2.471
  177   HG23  THR  21          HG23      THR  21  10.703   4.183  -1.441
  178    H    LEU  22           H        LEU  22  10.195   1.339   0.972
  179    HA   LEU  22           HA       LEU  22  11.876   3.353   2.123
  180    HB2  LEU  22           HB2      LEU  22  10.153   1.149   3.272
  181    HB3  LEU  22           HB3      LEU  22  10.956   2.343   4.289
  182    HG   LEU  22           HG       LEU  22   9.106   3.075   2.004
  183   HD11  LEU  22          HD11      LEU  22   7.404   3.504   3.712
  184   HD12  LEU  22          HD12      LEU  22   8.512   2.974   4.978
  185   HD13  LEU  22          HD13      LEU  22   7.912   1.816   3.791
  186   HD21  LEU  22          HD21      LEU  22  10.339   4.618   4.307
  187   HD22  LEU  22          HD22      LEU  22   9.071   5.263   3.264
  188   HD23  LEU  22          HD23      LEU  22  10.647   4.854   2.586
  189    H    ARG  23           H        ARG  23  12.212  -0.170   1.981
  190    HA   ARG  23           HA       ARG  23  14.296  -0.481   3.903
  191    HB2  ARG  23           HB2      ARG  23  13.120  -1.975   1.631
  192    HB3  ARG  23           HB3      ARG  23  14.774  -2.433   2.040
  193    HG2  ARG  23           HG2      ARG  23  12.635  -2.166   4.156
  194    HG3  ARG  23           HG3      ARG  23  12.881  -3.672   3.274
  195    HD2  ARG  23           HD2      ARG  23  15.309  -2.378   4.450
  196    HD3  ARG  23           HD3      ARG  23  14.187  -3.185   5.563
  197    HE   ARG  23           HE       ARG  23  14.379  -5.203   4.022
  198   HH11  ARG  23          HH11      ARG  23  16.859  -5.079   5.584
  199   HH12  ARG  23          HH12      ARG  23  18.096  -5.077   4.373
  200   HH21  ARG  23          HH21      ARG  23  15.936  -4.188   1.797
  201   HH22  ARG  23          HH22      ARG  23  17.572  -4.565   2.219
  202    HA   PRO  24           HA       PRO  24  17.512   0.148   0.462
  203    HB2  PRO  24           HB2      PRO  24  16.707   0.641  -2.105
  204    HB3  PRO  24           HB3      PRO  24  16.919  -0.999  -1.462
  205    HG2  PRO  24           HG2      PRO  24  14.431   0.545  -1.925
  206    HG3  PRO  24           HG3      PRO  24  14.727  -1.193  -2.068
  207    HD2  PRO  24           HD2      PRO  24  13.452   0.028   0.058
  208    HD3  PRO  24           HD3      PRO  24  14.210  -1.577   0.105
  209    H    GLU  25           H        GLU  25  17.078   2.166   1.931
  210    HA   GLU  25           HA       GLU  25  16.166   4.564   0.428
  211    HB2  GLU  25           HB2      GLU  25  15.786   3.693   2.980
  212    HB3  GLU  25           HB3      GLU  25  17.184   4.742   3.215
  213    HG2  GLU  25           HG2      GLU  25  15.520   6.323   3.419
  214    HG3  GLU  25           HG3      GLU  25  15.729   6.377   1.669
  215    H    ARG  26           H        ARG  26  17.855   5.129  -0.964
  216    HA   ARG  26           HA       ARG  26  19.952   5.962  -1.639
  217    HB2  ARG  26           HB2      ARG  26  19.053   7.387   0.450
  218    HB3  ARG  26           HB3      ARG  26  20.514   6.740   1.194
  219    HG2  ARG  26           HG2      ARG  26  21.173   8.798   0.188
  220    HG3  ARG  26           HG3      ARG  26  21.760   7.536  -0.895
  221    HD2  ARG  26           HD2      ARG  26  20.495   8.341  -2.593
  222    HD3  ARG  26           HD3      ARG  26  19.033   8.279  -1.588
  223    HE   ARG  26           HE       ARG  26  20.987  10.554  -1.515
  224   HH11  ARG  26          HH11      ARG  26  19.064  10.288   0.784
  225   HH12  ARG  26          HH12      ARG  26  17.753  11.299   0.276
  226   HH21  ARG  26          HH21      ARG  26  18.768  11.386  -3.049
  227   HH22  ARG  26          HH22      ARG  26  17.585  11.924  -1.904
  Start of MODEL   33
    1    HA   ARG   1           HA       ARG   1 -16.559   1.916  -6.131
    2    HB2  ARG   1           HB2      ARG   1 -14.140   2.941  -5.218
    3    HB3  ARG   1           HB3      ARG   1 -14.831   2.206  -3.771
    4    HG2  ARG   1           HG2      ARG   1 -13.806   0.345  -4.672
    5    HG3  ARG   1           HG3      ARG   1 -15.365   0.226  -5.485
    6    HD2  ARG   1           HD2      ARG   1 -13.429   1.967  -6.881
    7    HD3  ARG   1           HD3      ARG   1 -12.952   0.260  -6.800
    8    HE   ARG   1           HE       ARG   1 -15.432   1.296  -8.070
    9   HH11  ARG   1          HH11      ARG   1 -13.294  -0.461  -9.372
   10   HH12  ARG   1          HH12      ARG   1 -14.100  -1.994  -9.409
   11   HH21  ARG   1          HH21      ARG   1 -16.546  -1.057  -7.123
   12   HH22  ARG   1          HH22      ARG   1 -15.947  -2.333  -8.129
   13    H    SER   2           H        SER   2 -16.656   0.714  -3.612
   14    HA   SER   2           HA       SER   2 -19.193   1.789  -2.560
   15    HB2  SER   2           HB2      SER   2 -18.578  -0.652  -3.046
   16    HB3  SER   2           HB3      SER   2 -17.589  -0.584  -1.589
   17    HG   SER   2           HG       SER   2 -19.436  -0.093  -0.407
   18    H    ALA   3           H        ALA   3 -16.151   2.774  -1.959
   19    HA   ALA   3           HA       ALA   3 -15.266   4.094  -0.217
   20    HB1  ALA   3           HB1      ALA   3 -16.753   4.930   1.338
   21    HB2  ALA   3           HB2      ALA   3 -17.523   3.366   1.603
   22    HB3  ALA   3           HB3      ALA   3 -17.901   4.301   0.157
   23    H    LEU   4           H        LEU   4 -16.666   0.942   0.776
   24    HA   LEU   4           HA       LEU   4 -14.381   0.616   2.681
   25    HB2  LEU   4           HB2      LEU   4 -17.229  -0.062   2.626
   26    HB3  LEU   4           HB3      LEU   4 -16.226  -1.439   3.077
   27    HG   LEU   4           HG       LEU   4 -16.868  -0.163   5.074
   28   HD11  LEU   4          HD11      LEU   4 -14.726  -0.050   6.063
   29   HD12  LEU   4          HD12      LEU   4 -13.961   0.460   4.559
   30   HD13  LEU   4          HD13      LEU   4 -14.518  -1.203   4.746
   31   HD21  LEU   4          HD21      LEU   4 -16.395   2.139   5.356
   32   HD22  LEU   4          HD22      LEU   4 -17.005   2.031   3.704
   33   HD23  LEU   4          HD23      LEU   4 -15.271   2.163   3.996
   34    H    VAL   5           H        VAL   5 -14.700  -0.014  -0.441
   35    HA   VAL   5           HA       VAL   5 -13.754  -2.857  -0.268
   36    HB   VAL   5           HB       VAL   5 -15.022  -1.257  -2.518
   37   HG11  VAL   5          HG11      VAL   5 -15.063  -3.439  -3.720
   38   HG12  VAL   5          HG12      VAL   5 -14.115  -4.152  -2.416
   39   HG13  VAL   5          HG13      VAL   5 -13.418  -2.880  -3.418
   40   HG21  VAL   5          HG21      VAL   5 -16.918  -2.778  -2.188
   41   HG22  VAL   5          HG22      VAL   5 -16.547  -1.958  -0.672
   42   HG23  VAL   5          HG23      VAL   5 -16.039  -3.628  -0.917
   43    H    ASN   6           H        ASN   6 -13.113   0.289  -1.878
   44    HA   ASN   6           HA       ASN   6 -10.578  -0.683  -3.009
   45    HB2  ASN   6           HB2      ASN   6 -12.117   0.948  -4.120
   46    HB3  ASN   6           HB3      ASN   6 -11.753   2.110  -2.843
   47   HD21  ASN   6          HD21      ASN   6 -10.561   3.637  -4.117
   48   HD22  ASN   6          HD22      ASN   6  -9.098   3.253  -4.886
   49    H    SER   7           H        SER   7 -11.570   0.936  -0.047
   50    HA   SER   7           HA       SER   7  -9.274   2.407   0.657
   51    HB2  SER   7           HB2      SER   7 -11.488   2.115   1.895
   52    HB3  SER   7           HB3      SER   7 -10.848   0.595   2.514
   53    HG   SER   7           HG       SER   7  -9.141   1.767   3.445
   54    H    TYR   8           H        TYR   8  -9.896  -1.064   1.350
   55    HA   TYR   8           HA       TYR   8  -7.227  -1.582   2.361
   56    HB2  TYR   8           HB2      TYR   8  -9.453  -2.834   2.738
   57    HB3  TYR   8           HB3      TYR   8  -9.174  -3.567   1.158
   58    HD1  TYR   8           HD1      TYR   8  -7.266  -5.080   0.783
   59    HD2  TYR   8           HD2      TYR   8  -8.057  -3.382   4.649
   60    HE1  TYR   8           HE1      TYR   8  -5.734  -6.730   1.822
   61    HE2  TYR   8           HE2      TYR   8  -6.524  -5.030   5.687
   62    HH   TYR   8           HH       TYR   8  -4.276  -6.594   4.271
   63    H    LEU   9           H        LEU   9  -8.832  -2.047  -0.795
   64    HA   LEU   9           HA       LEU   9  -6.740  -3.418  -2.159
   65    HB2  LEU   9           HB2      LEU   9  -8.964  -1.539  -2.980
   66    HB3  LEU   9           HB3      LEU   9  -7.919  -2.303  -4.172
   67    HG   LEU   9           HG       LEU   9  -9.654  -3.727  -2.131
   68   HD11  LEU   9          HD11      LEU   9 -11.000  -2.919  -3.944
   69   HD12  LEU   9          HD12      LEU   9 -10.706  -4.628  -4.266
   70   HD13  LEU   9          HD13      LEU   9  -9.792  -3.397  -5.137
   71   HD21  LEU   9          HD21      LEU   9  -8.876  -5.740  -3.614
   72   HD22  LEU   9          HD22      LEU   9  -7.790  -5.142  -2.361
   73   HD23  LEU   9          HD23      LEU   9  -7.530  -4.684  -4.044
   74    H    TRP  10           H        TRP  10  -7.279   0.062  -1.612
   75    HA   TRP  10           HA       TRP  10  -5.123   0.956  -3.339
   76    HB2  TRP  10           HB2      TRP  10  -7.028   2.370  -2.730
   77    HB3  TRP  10           HB3      TRP  10  -6.621   2.231  -1.020
   78    HD1  TRP  10           HD1      TRP  10  -4.369   3.044  -4.067
   79    HE1  TRP  10           HE1      TRP  10  -3.099   5.228  -3.562
   80    HE3  TRP  10           HE3      TRP  10  -6.392   4.217   0.476
   81    HZ2  TRP  10           HZ2      TRP  10  -2.960   7.212  -1.510
   82    HZ3  TRP  10           HZ3      TRP  10  -5.673   6.258   1.681
   83    HH2  TRP  10           HH2      TRP  10  -3.961   7.757   0.694
   84    H    GLN  11           H        GLN  11  -5.410   0.297   0.163
   85    HA   GLN  11           HA       GLN  11  -2.833   1.240   0.955
   86    HB2  GLN  11           HB2      GLN  11  -4.907  -0.661   1.976
   87    HB3  GLN  11           HB3      GLN  11  -3.321  -0.688   2.746
   88    HG2  GLN  11           HG2      GLN  11  -4.580   1.980   2.268
   89    HG3  GLN  11           HG3      GLN  11  -5.240   0.984   3.566
   90   HE21  GLN  11          HE21      GLN  11  -4.292   1.620   5.515
   91   HE22  GLN  11          HE22      GLN  11  -2.650   1.995   5.720
   92    H    ARG  12           H        ARG  12  -3.888  -1.960  -0.239
   93    HA   ARG  12           HA       ARG  12  -1.528  -3.460   0.167
   94    HB2  ARG  12           HB2      ARG  12  -3.971  -3.577  -1.350
   95    HB3  ARG  12           HB3      ARG  12  -2.641  -4.109  -2.379
   96    HG2  ARG  12           HG2      ARG  12  -1.908  -5.557  -0.369
   97    HG3  ARG  12           HG3      ARG  12  -3.519  -5.244   0.278
   98    HD2  ARG  12           HD2      ARG  12  -4.024  -7.148  -0.931
   99    HD3  ARG  12           HD3      ARG  12  -4.176  -5.979  -2.258
  100    HE   ARG  12           HE       ARG  12  -1.668  -7.521  -1.685
  101   HH11  ARG  12          HH11      ARG  12  -3.291  -8.482  -3.950
  102   HH12  ARG  12          HH12      ARG  12  -2.625  -7.629  -5.302
  103   HH21  ARG  12          HH21      ARG  12  -1.025  -5.245  -3.340
  104   HH22  ARG  12          HH22      ARG  12  -1.338  -5.788  -4.955
  105    H    TRP  13           H        TRP  13  -2.340  -1.200  -2.461
  106    HA   TRP  13           HA       TRP  13  -0.134  -1.655  -4.195
  107    HB2  TRP  13           HB2      TRP  13  -2.350  -0.011  -4.030
  108    HB3  TRP  13           HB3      TRP  13  -1.028   1.138  -3.857
  109    HD1  TRP  13           HD1      TRP  13  -2.882   1.021  -6.415
  110    HE1  TRP  13           HE1      TRP  13  -1.827   0.600  -8.733
  111    HE3  TRP  13           HE3      TRP  13   1.511  -1.156  -4.999
  112    HZ2  TRP  13           HZ2      TRP  13   0.567  -0.511  -9.833
  113    HZ3  TRP  13           HZ3      TRP  13   3.157  -1.886  -6.698
  114    HH2  TRP  13           HH2      TRP  13   2.693  -1.565  -9.110
  115    H    GLU  14           H        GLU  14  -0.471   1.038  -1.856
  116    HA   GLU  14           HA       GLU  14   2.290   1.816  -1.958
  117    HB2  GLU  14           HB2      GLU  14   0.094   2.254   0.088
  118    HB3  GLU  14           HB3      GLU  14   1.608   3.161   0.032
  119    HG2  GLU  14           HG2      GLU  14   0.854   3.467  -2.532
  120    HG3  GLU  14           HG3      GLU  14  -0.741   3.284  -1.801
  121    H    ASN  15           H        ASN  15   0.509  -0.434   0.144
  122    HA   ASN  15           HA       ASN  15   2.369  -0.827   2.227
  123    HB2  ASN  15           HB2      ASN  15   0.018  -1.854   1.711
  124    HB3  ASN  15           HB3      ASN  15   0.924  -3.101   0.856
  125   HD21  ASN  15          HD21      ASN  15   2.961  -3.879   2.335
  126   HD22  ASN  15          HD22      ASN  15   2.546  -4.225   3.944
  127    H    TRP  16           H        TRP  16   2.265  -2.382  -1.002
  128    HA   TRP  16           HA       TRP  16   4.702  -3.917  -0.631
  129    HB2  TRP  16           HB2      TRP  16   3.163  -4.697  -2.259
  130    HB3  TRP  16           HB3      TRP  16   2.934  -3.088  -2.938
  131    HD1  TRP  16           HD1      TRP  16   5.338  -6.045  -2.961
  132    HE1  TRP  16           HE1      TRP  16   6.995  -5.764  -4.915
  133    HE3  TRP  16           HE3      TRP  16   4.111  -1.327  -4.485
  134    HZ2  TRP  16           HZ2      TRP  16   7.707  -3.797  -6.865
  135    HZ3  TRP  16           HZ3      TRP  16   5.296  -0.275  -6.390
  136    HH2  TRP  16           HH2      TRP  16   7.091  -1.503  -7.581
  137    H    PHE  17           H        PHE  17   3.923  -0.812  -2.220
  138    HA   PHE  17           HA       PHE  17   6.480  -0.200  -3.290
  139    HB2  PHE  17           HB2      PHE  17   4.341   0.980  -3.755
  140    HB3  PHE  17           HB3      PHE  17   4.355   1.629  -2.116
  141    HD1  PHE  17           HD1      PHE  17   6.370   1.502  -5.266
  142    HD2  PHE  17           HD2      PHE  17   5.521   3.620  -1.625
  143    HE1  PHE  17           HE1      PHE  17   7.813   3.373  -6.017
  144    HE2  PHE  17           HE2      PHE  17   6.964   5.490  -2.378
  145    HZ   PHE  17           HZ       PHE  17   8.110   5.368  -4.573
  146    H    TRP  18           H        TRP  18   5.080   0.792  -0.133
  147    HA   TRP  18           HA       TRP  18   7.463   2.050   0.857
  148    HB2  TRP  18           HB2      TRP  18   5.068   0.768   2.214
  149    HB3  TRP  18           HB3      TRP  18   6.259   1.754   3.060
  150    HD1  TRP  18           HD1      TRP  18   3.003   2.275   2.116
  151    HE1  TRP  18           HE1      TRP  18   2.503   4.631   1.196
  152    HE3  TRP  18           HE3      TRP  18   7.745   3.816   0.994
  153    HZ2  TRP  18           HZ2      TRP  18   3.922   6.869   0.129
  154    HZ3  TRP  18           HZ3      TRP  18   8.138   6.062   0.029
  155    HH2  TRP  18           HH2      TRP  18   6.236   7.589  -0.404
  156    H    ASN  19           H        ASN  19   6.307  -1.310   0.964
  157    HA   ASN  19           HA       ASN  19   8.244  -2.281   2.867
  158    HB2  ASN  19           HB2      ASN  19   6.251  -3.332   0.947
  159    HB3  ASN  19           HB3      ASN  19   7.574  -4.436   1.322
  160   HD21  ASN  19          HD21      ASN  19   5.118  -2.359   2.954
  161   HD22  ASN  19          HD22      ASN  19   5.003  -3.336   4.336
  162    H    VAL  20           H        VAL  20   8.256  -2.162  -0.725
  163    HA   VAL  20           HA       VAL  20  10.963  -3.355  -0.791
  164    HB   VAL  20           HB       VAL  20  10.619  -3.277  -3.231
  165   HG11  VAL  20          HG11      VAL  20   8.813  -4.837  -3.344
  166   HG12  VAL  20          HG12      VAL  20   8.041  -4.154  -1.914
  167   HG13  VAL  20          HG13      VAL  20   9.548  -5.057  -1.756
  168   HG21  VAL  20          HG21      VAL  20   9.419  -1.501  -3.982
  169   HG22  VAL  20          HG22      VAL  20   8.574  -1.308  -2.448
  170   HG23  VAL  20          HG23      VAL  20   8.004  -2.490  -3.624
  171    H    THR  21           H        THR  21   9.521  -0.143  -0.998
  172    HA   THR  21           HA       THR  21  11.933   1.073  -2.165
  173    HB   THR  21           HB       THR  21   9.386   2.219  -0.981
  174    HG1  THR  21           HG1      THR  21   8.739   1.344  -2.799
  175   HG21  THR  21          HG21      THR  21  10.182   4.186  -2.534
  176   HG22  THR  21          HG22      THR  21  11.776   3.472  -2.293
  177   HG23  THR  21          HG23      THR  21  10.844   4.034  -0.906
  178    H    LEU  22           H        LEU  22  10.244   1.316   0.988
  179    HA   LEU  22           HA       LEU  22  12.363   2.845   2.237
  180    HB2  LEU  22           HB2      LEU  22  10.141   1.154   3.431
  181    HB3  LEU  22           HB3      LEU  22  11.072   2.373   4.296
  182    HG   LEU  22           HG       LEU  22   9.447   2.993   1.814
  183   HD11  LEU  22          HD11      LEU  22   7.701   3.816   3.276
  184   HD12  LEU  22          HD12      LEU  22   8.669   3.459   4.706
  185   HD13  LEU  22          HD13      LEU  22   8.037   2.142   3.718
  186   HD21  LEU  22          HD21      LEU  22  11.195   4.616   2.282
  187   HD22  LEU  22          HD22      LEU  22  10.734   4.683   3.983
  188   HD23  LEU  22          HD23      LEU  22   9.648   5.321   2.750
  189    H    ARG  23           H        ARG  23  11.278  -0.487   2.936
  190    HA   ARG  23           HA       ARG  23  12.467  -2.349   3.776
  191    HB2  ARG  23           HB2      ARG  23  13.940  -1.081   1.547
  192    HB3  ARG  23           HB3      ARG  23  14.891  -2.201   2.516
  193    HG2  ARG  23           HG2      ARG  23  12.545  -3.595   2.211
  194    HG3  ARG  23           HG3      ARG  23  12.660  -2.744   0.671
  195    HD2  ARG  23           HD2      ARG  23  14.828  -4.492   1.894
  196    HD3  ARG  23           HD3      ARG  23  13.825  -4.900   0.490
  197    HE   ARG  23           HE       ARG  23  15.707  -2.563   0.533
  198   HH11  ARG  23          HH11      ARG  23  13.591  -2.732  -1.634
  199   HH12  ARG  23          HH12      ARG  23  14.472  -3.496  -2.916
  200   HH21  ARG  23          HH21      ARG  23  17.049  -4.583  -0.843
  201   HH22  ARG  23          HH22      ARG  23  16.446  -4.547  -2.468
  202    HA   PRO  24           HA       PRO  24  14.969   0.182   6.752
  203    HB2  PRO  24           HB2      PRO  24  13.556  -0.468   9.003
  204    HB3  PRO  24           HB3      PRO  24  13.120   0.891   7.950
  205    HG2  PRO  24           HG2      PRO  24  11.889  -1.793   8.177
  206    HG3  PRO  24           HG3      PRO  24  11.143  -0.233   7.805
  207    HD2  PRO  24           HD2      PRO  24  11.759  -2.201   5.951
  208    HD3  PRO  24           HD3      PRO  24  11.461  -0.490   5.576
  209    H    GLU  25           H        GLU  25  15.875  -2.199   5.707
  210    HA   GLU  25           HA       GLU  25  17.165  -3.495   7.970
  211    HB2  GLU  25           HB2      GLU  25  14.595  -4.407   7.142
  212    HB3  GLU  25           HB3      GLU  25  15.763  -5.618   6.611
  213    HG2  GLU  25           HG2      GLU  25  15.743  -4.485   9.419
  214    HG3  GLU  25           HG3      GLU  25  14.853  -5.940   8.968
  215    H    ARG  26           H        ARG  26  16.142  -4.162   4.586
  216    HA   ARG  26           HA       ARG  26  19.018  -4.490   3.845
  217    HB2  ARG  26           HB2      ARG  26  18.324  -6.566   2.595
  218    HB3  ARG  26           HB3      ARG  26  18.155  -6.710   4.343
  219    HG2  ARG  26           HG2      ARG  26  15.885  -6.859   4.239
  220    HG3  ARG  26           HG3      ARG  26  15.769  -5.642   2.968
  221    HD2  ARG  26           HD2      ARG  26  16.862  -7.541   1.473
  222    HD3  ARG  26           HD3      ARG  26  16.171  -8.606   2.714
  223    HE   ARG  26           HE       ARG  26  14.643  -6.991   0.809
  224   HH11  ARG  26          HH11      ARG  26  13.764  -9.690   1.685
  225   HH12  ARG  26          HH12      ARG  26  12.469  -9.333   2.778
  226   HH21  ARG  26          HH21      ARG  26  13.380  -6.003   3.186
  227   HH22  ARG  26          HH22      ARG  26  12.252  -7.238   3.633
  Start of MODEL   34
    1    HA   ARG   1           HA       ARG   1 -18.768  -0.191  -4.206
    2    HB2  ARG   1           HB2      ARG   1 -19.731   2.153  -5.022
    3    HB3  ARG   1           HB3      ARG   1 -19.868   2.446  -3.288
    4    HG2  ARG   1           HG2      ARG   1 -17.561   2.311  -2.945
    5    HG3  ARG   1           HG3      ARG   1 -17.300   1.353  -4.404
    6    HD2  ARG   1           HD2      ARG   1 -17.743   3.297  -5.819
    7    HD3  ARG   1           HD3      ARG   1 -18.145   4.275  -4.394
    8    HE   ARG   1           HE       ARG   1 -15.425   3.159  -4.962
    9   HH11  ARG   1          HH11      ARG   1 -15.703   6.058  -5.249
   10   HH12  ARG   1          HH12      ARG   1 -15.277   6.663  -3.682
   11   HH21  ARG   1          HH21      ARG   1 -15.698   3.597  -2.098
   12   HH22  ARG   1          HH22      ARG   1 -15.281   5.265  -1.890
   13    H    SER   2           H        SER   2 -18.088  -0.946  -2.226
   14    HA   SER   2           HA       SER   2 -20.015  -0.893   0.047
   15    HB2  SER   2           HB2      SER   2 -18.744  -2.941  -1.012
   16    HB3  SER   2           HB3      SER   2 -17.395  -2.369  -0.032
   17    HG   SER   2           HG       SER   2 -18.601  -2.670   1.789
   18    H    ALA   3           H        ALA   3 -17.434   0.968  -1.010
   19    HA   ALA   3           HA       ALA   3 -16.037   2.541   0.044
   20    HB1  ALA   3           HB1      ALA   3 -16.995   3.570   1.962
   21    HB2  ALA   3           HB2      ALA   3 -17.766   2.070   2.477
   22    HB3  ALA   3           HB3      ALA   3 -18.372   2.932   1.063
   23    H    LEU   4           H        LEU   4 -15.882  -0.635   0.736
   24    HA   LEU   4           HA       LEU   4 -13.697  -0.261   2.746
   25    HB2  LEU   4           HB2      LEU   4 -16.032  -2.162   2.666
   26    HB3  LEU   4           HB3      LEU   4 -14.564  -2.595   3.543
   27    HG   LEU   4           HG       LEU   4 -15.812   0.099   4.005
   28   HD11  LEU   4          HD11      LEU   4 -17.152  -0.915   5.844
   29   HD12  LEU   4          HD12      LEU   4 -16.694  -2.516   5.265
   30   HD13  LEU   4          HD13      LEU   4 -17.679  -1.459   4.252
   31   HD21  LEU   4          HD21      LEU   4 -14.790  -0.207   6.214
   32   HD22  LEU   4          HD22      LEU   4 -13.586  -0.494   4.958
   33   HD23  LEU   4          HD23      LEU   4 -14.330  -1.857   5.794
   34    H    VAL   5           H        VAL   5 -14.346  -1.173  -0.368
   35    HA   VAL   5           HA       VAL   5 -12.506  -3.517  -0.403
   36    HB   VAL   5           HB       VAL   5 -14.145  -2.202  -2.603
   37   HG11  VAL   5          HG11      VAL   5 -12.886  -4.958  -2.405
   38   HG12  VAL   5          HG12      VAL   5 -12.274  -3.627  -3.389
   39   HG13  VAL   5          HG13      VAL   5 -13.839  -4.352  -3.761
   40   HG21  VAL   5          HG21      VAL   5 -15.706  -2.968  -0.957
   41   HG22  VAL   5          HG22      VAL   5 -14.782  -4.443  -0.666
   42   HG23  VAL   5          HG23      VAL   5 -15.651  -4.233  -2.185
   43    H    ASN   6           H        ASN   6 -12.936  -0.397  -2.120
   44    HA   ASN   6           HA       ASN   6 -10.397  -0.363  -3.439
   45    HB2  ASN   6           HB2      ASN   6 -12.679   1.393  -2.918
   46    HB3  ASN   6           HB3      ASN   6 -11.160   2.288  -2.952
   47   HD21  ASN   6          HD21      ASN   6 -11.280   3.235  -5.044
   48   HD22  ASN   6          HD22      ASN   6 -11.408   2.329  -6.473
   49    H    SER   7           H        SER   7 -11.415   0.974  -0.268
   50    HA   SER   7           HA       SER   7  -9.016   2.341   0.409
   51    HB2  SER   7           HB2      SER   7  -9.845   1.760   2.790
   52    HB3  SER   7           HB3      SER   7 -10.957   2.646   1.753
   53    HG   SER   7           HG       SER   7 -12.098   0.957   2.594
   54    H    TYR   8           H        TYR   8  -9.979  -1.029   1.171
   55    HA   TYR   8           HA       TYR   8  -7.509  -1.821   2.396
   56    HB2  TYR   8           HB2      TYR   8  -9.328  -3.231   2.794
   57    HB3  TYR   8           HB3      TYR   8  -9.907  -3.119   1.134
   58    HD1  TYR   8           HD1      TYR   8  -6.706  -4.194   2.797
   59    HD2  TYR   8           HD2      TYR   8  -9.808  -5.126  -0.023
   60    HE1  TYR   8           HE2      TYR   8  -5.572  -6.332   2.259
   61    HE2  TYR   8           HE1      TYR   8  -8.674  -7.265  -0.562
   62    HH   TYR   8           HH       TYR   8  -6.014  -8.037  -0.354
   63    H    LEU   9           H        LEU   9  -8.697  -2.097  -0.963
   64    HA   LEU   9           HA       LEU   9  -6.430  -3.436  -2.083
   65    HB2  LEU   9           HB2      LEU   9  -8.832  -1.956  -2.933
   66    HB3  LEU   9           HB3      LEU   9  -7.510  -1.861  -4.091
   67    HG   LEU   9           HG       LEU   9  -7.403  -4.237  -4.317
   68   HD11  LEU   9          HD11      LEU   9  -9.154  -4.264  -1.852
   69   HD12  LEU   9          HD12      LEU   9  -7.568  -5.007  -2.067
   70   HD13  LEU   9          HD13      LEU   9  -8.976  -5.678  -2.891
   71   HD21  LEU   9          HD21      LEU   9  -9.736  -4.829  -4.935
   72   HD22  LEU   9          HD22      LEU   9  -9.290  -3.221  -5.509
   73   HD23  LEU   9          HD23      LEU   9 -10.307  -3.396  -4.079
   74    H    TRP  10           H        TRP  10  -7.206   0.055  -1.854
   75    HA   TRP  10           HA       TRP  10  -4.880   1.043  -3.194
   76    HB2  TRP  10           HB2      TRP  10  -6.644   2.563  -2.878
   77    HB3  TRP  10           HB3      TRP  10  -6.891   2.076  -1.203
   78    HD1  TRP  10           HD1      TRP  10  -4.392   4.046  -3.377
   79    HE1  TRP  10           HE1      TRP  10  -3.185   5.758  -1.872
   80    HE3  TRP  10           HE3      TRP  10  -6.313   2.738   1.168
   81    HZ2  TRP  10           HZ2      TRP  10  -3.057   6.479   0.893
   82    HZ3  TRP  10           HZ3      TRP  10  -5.634   3.950   3.218
   83    HH2  TRP  10           HH2      TRP  10  -4.009   5.818   3.087
   84    H    GLN  11           H        GLN  11  -5.514   0.583   0.316
   85    HA   GLN  11           HA       GLN  11  -3.017   1.449   1.322
   86    HB2  GLN  11           HB2      GLN  11  -5.132   0.813   2.565
   87    HB3  GLN  11           HB3      GLN  11  -4.693  -0.877   2.319
   88    HG2  GLN  11           HG2      GLN  11  -3.843  -0.344   4.472
   89    HG3  GLN  11           HG3      GLN  11  -2.438  -0.277   3.409
   90   HE21  GLN  11          HE21      GLN  11  -1.220   1.619   3.575
   91   HE22  GLN  11          HE22      GLN  11  -1.800   3.098   4.173
   92    H    ARG  12           H        ARG  12  -3.936  -1.699  -0.064
   93    HA   ARG  12           HA       ARG  12  -1.490  -3.086   0.608
   94    HB2  ARG  12           HB2      ARG  12  -3.984  -3.680  -0.445
   95    HB3  ARG  12           HB3      ARG  12  -2.915  -3.926  -1.826
   96    HG2  ARG  12           HG2      ARG  12  -3.020  -6.020  -0.656
   97    HG3  ARG  12           HG3      ARG  12  -1.441  -5.321  -0.301
   98    HD2  ARG  12           HD2      ARG  12  -3.179  -4.282   1.673
   99    HD3  ARG  12           HD3      ARG  12  -3.558  -6.012   1.551
  100    HE   ARG  12           HE       ARG  12  -0.738  -5.031   1.841
  101   HH11  ARG  12          HH11      ARG  12  -1.708  -7.966   1.355
  102   HH12  ARG  12          HH12      ARG  12  -1.507  -8.612   2.949
  103   HH21  ARG  12          HH21      ARG  12  -1.183  -5.493   4.453
  104   HH22  ARG  12          HH22      ARG  12  -1.210  -7.205   4.711
  105    H    TRP  13           H        TRP  13  -2.524  -1.173  -2.222
  106    HA   TRP  13           HA       TRP  13  -0.336  -1.801  -3.950
  107    HB2  TRP  13           HB2      TRP  13  -1.611  -0.472  -5.268
  108    HB3  TRP  13           HB3      TRP  13  -2.631  -0.132  -3.879
  109    HD1  TRP  13           HD1      TRP  13  -2.811   2.314  -3.253
  110    HE1  TRP  13           HE1      TRP  13  -1.430   4.446  -3.684
  111    HE3  TRP  13           HE3      TRP  13   1.182   0.299  -5.721
  112    HZ2  TRP  13           HZ2      TRP  13   1.040   5.198  -4.912
  113    HZ3  TRP  13           HZ3      TRP  13   3.030   1.746  -6.511
  114    HH2  TRP  13           HH2      TRP  13   2.966   4.191  -6.109
  115    H    GLU  14           H        GLU  14  -0.720   0.819  -1.539
  116    HA   GLU  14           HA       GLU  14   1.962   1.876  -1.946
  117    HB2  GLU  14           HB2      GLU  14  -0.411   2.326  -0.250
  118    HB3  GLU  14           HB3      GLU  14   1.118   2.703   0.545
  119    HG2  GLU  14           HG2      GLU  14   1.754   4.070  -1.464
  120    HG3  GLU  14           HG3      GLU  14   0.132   3.800  -2.100
  121    H    ASN  15           H        ASN  15   0.472  -0.465   0.282
  122    HA   ASN  15           HA       ASN  15   2.506  -0.803   2.198
  123    HB2  ASN  15           HB2      ASN  15   0.130  -1.976   1.615
  124    HB3  ASN  15           HB3      ASN  15   1.226  -3.247   1.078
  125   HD21  ASN  15          HD21      ASN  15   3.329  -2.899   3.014
  126   HD22  ASN  15          HD22      ASN  15   2.706  -3.288   4.545
  127    H    TRP  16           H        TRP  16   2.218  -2.393  -1.008
  128    HA   TRP  16           HA       TRP  16   4.697  -3.871  -0.798
  129    HB2  TRP  16           HB2      TRP  16   3.190  -4.697  -2.386
  130    HB3  TRP  16           HB3      TRP  16   2.734  -3.086  -2.938
  131    HD1  TRP  16           HD1      TRP  16   5.687  -5.559  -3.142
  132    HE1  TRP  16           HE1      TRP  16   7.007  -5.068  -5.301
  133    HE3  TRP  16           HE3      TRP  16   3.194  -1.412  -4.776
  134    HZ2  TRP  16           HZ2      TRP  16   7.007  -3.167  -7.437
  135    HZ3  TRP  16           HZ3      TRP  16   3.875  -0.281  -6.872
  136    HH2  TRP  16           HH2      TRP  16   5.777  -1.152  -8.204
  137    H    PHE  17           H        PHE  17   3.814  -0.802  -2.421
  138    HA   PHE  17           HA       PHE  17   6.323  -0.122  -3.537
  139    HB2  PHE  17           HB2      PHE  17   3.982   0.963  -3.714
  140    HB3  PHE  17           HB3      PHE  17   4.404   1.824  -2.234
  141    HD1  PHE  17           HD1      PHE  17   5.214   1.366  -5.807
  142    HD2  PHE  17           HD2      PHE  17   6.118   3.548  -2.218
  143    HE1  PHE  17           HE2      PHE  17   6.499   3.020  -7.136
  144    HE2  PHE  17           HE1      PHE  17   7.402   5.201  -3.547
  145    HZ   PHE  17           HZ       PHE  17   7.593   4.938  -6.006
  146    H    TRP  18           H        TRP  18   5.045   0.502  -0.261
  147    HA   TRP  18           HA       TRP  18   7.447   1.886   0.657
  148    HB2  TRP  18           HB2      TRP  18   5.018   0.697   2.031
  149    HB3  TRP  18           HB3      TRP  18   6.237   1.658   2.864
  150    HD1  TRP  18           HD1      TRP  18   3.011   2.292   2.026
  151    HE1  TRP  18           HE1      TRP  18   2.554   4.635   1.055
  152    HE3  TRP  18           HE3      TRP  18   7.751   3.615   0.638
  153    HZ2  TRP  18           HZ2      TRP  18   4.003   6.782  -0.149
  154    HZ3  TRP  18           HZ3      TRP  18   8.179   5.815  -0.417
  155    HH2  TRP  18           HH2      TRP  18   6.313   7.399  -0.811
  156    H    ASN  19           H        ASN  19   6.285  -1.442   0.643
  157    HA   ASN  19           HA       ASN  19   7.987  -2.530   2.677
  158    HB2  ASN  19           HB2      ASN  19   5.934  -3.509   1.497
  159    HB3  ASN  19           HB3      ASN  19   7.015  -3.911   0.164
  160   HD21  ASN  19          HD21      ASN  19   6.037  -4.820   3.402
  161   HD22  ASN  19          HD22      ASN  19   7.063  -6.166   3.539
  162    H    VAL  20           H        VAL  20   8.458  -2.224  -0.869
  163    HA   VAL  20           HA       VAL  20  11.116  -3.451  -0.764
  164    HB   VAL  20           HB       VAL  20  11.121  -2.805  -3.187
  165   HG11  VAL  20          HG11      VAL  20   9.487  -4.397  -3.814
  166   HG12  VAL  20          HG12      VAL  20   8.450  -3.998  -2.444
  167   HG13  VAL  20          HG13      VAL  20   9.958  -4.874  -2.183
  168   HG21  VAL  20          HG21      VAL  20   9.736  -1.217  -3.993
  169   HG22  VAL  20          HG22      VAL  20   9.265  -0.869  -2.329
  170   HG23  VAL  20          HG23      VAL  20   8.328  -2.012  -3.291
  171    H    THR  21           H        THR  21   9.923  -0.209  -0.315
  172    HA   THR  21           HA       THR  21  12.563   0.991  -0.970
  173    HB   THR  21           HB       THR  21  11.238   3.113  -0.400
  174    HG1  THR  21           HG1      THR  21   8.924   1.611  -0.737
  175   HG21  THR  21          HG21      THR  21   9.688   2.674  -2.507
  176   HG22  THR  21          HG22      THR  21  10.667   1.213  -2.641
  177   HG23  THR  21          HG23      THR  21  11.439   2.799  -2.683
  178    H    LEU  22           H        LEU  22  10.274   1.064   1.777
  179    HA   LEU  22           HA       LEU  22  12.291   2.068   3.630
  180    HB2  LEU  22           HB2      LEU  22   9.510   0.912   3.992
  181    HB3  LEU  22           HB3      LEU  22  10.428   1.710   5.267
  182    HG   LEU  22           HG       LEU  22  10.122   3.189   2.694
  183   HD11  LEU  22          HD11      LEU  22   7.901   3.492   4.652
  184   HD12  LEU  22          HD12      LEU  22   7.859   2.057   3.628
  185   HD13  LEU  22          HD13      LEU  22   7.886   3.661   2.896
  186   HD21  LEU  22          HD21      LEU  22  11.395   4.096   4.619
  187   HD22  LEU  22          HD22      LEU  22   9.950   3.976   5.622
  188   HD23  LEU  22          HD23      LEU  22   9.985   5.092   4.257
  189    H    ARG  23           H        ARG  23  11.050  -1.106   2.749
  190    HA   ARG  23           HA       ARG  23  11.734  -3.274   3.373
  191    HB2  ARG  23           HB2      ARG  23  13.952  -1.695   3.050
  192    HB3  ARG  23           HB3      ARG  23  14.189  -2.273   4.698
  193    HG2  ARG  23           HG2      ARG  23  15.226  -3.929   3.369
  194    HG3  ARG  23           HG3      ARG  23  13.647  -4.618   3.745
  195    HD2  ARG  23           HD2      ARG  23  13.716  -4.959   1.434
  196    HD3  ARG  23           HD3      ARG  23  12.952  -3.358   1.488
  197    HE   ARG  23           HE       ARG  23  15.561  -2.642   1.475
  198   HH11  ARG  23          HH11      ARG  23  14.015  -2.521  -1.083
  199   HH12  ARG  23          HH12      ARG  23  14.966  -3.517  -2.136
  200   HH21  ARG  23          HH21      ARG  23  16.733  -5.019   0.455
  201   HH22  ARG  23          HH22      ARG  23  16.514  -4.936  -1.260
  202    HA   PRO  24           HA       PRO  24  10.257  -2.553   7.670
  203    HB2  PRO  24           HB2      PRO  24   8.408  -4.575   7.618
  204    HB3  PRO  24           HB3      PRO  24   8.074  -2.936   7.023
  205    HG2  PRO  24           HG2      PRO  24   8.767  -5.398   5.499
  206    HG3  PRO  24           HG3      PRO  24   7.605  -4.120   5.111
  207    HD2  PRO  24           HD2      PRO  24  10.064  -4.289   3.966
  208    HD3  PRO  24           HD3      PRO  24   9.210  -2.751   4.213
  209    H    GLU  25           H        GLU  25  10.183  -4.190   9.519
  210    HA   GLU  25           HA       GLU  25  12.366  -6.197   9.161
  211    HB2  GLU  25           HB2      GLU  25  11.125  -4.800  11.554
  212    HB3  GLU  25           HB3      GLU  25  12.383  -6.028  11.692
  213    HG2  GLU  25           HG2      GLU  25  13.860  -4.640  10.245
  214    HG3  GLU  25           HG3      GLU  25  12.614  -3.393  10.202
  215    H    ARG  26           H        ARG  26   9.192  -5.906  10.838
  216    HA   ARG  26           HA       ARG  26   9.000  -8.824  11.172
  217    HB2  ARG  26           HB2      ARG  26   7.279  -6.418  11.811
  218    HB3  ARG  26           HB3      ARG  26   6.705  -8.062  12.088
  219    HG2  ARG  26           HG2      ARG  26   7.790  -8.037  14.063
  220    HG3  ARG  26           HG3      ARG  26   9.307  -7.990  13.166
  221    HD2  ARG  26           HD2      ARG  26   9.378  -6.078  14.606
  222    HD3  ARG  26           HD3      ARG  26   8.922  -5.429  13.019
  223    HE   ARG  26           HE       ARG  26   6.558  -5.442  13.783
  224   HH11  ARG  26          HH11      ARG  26   7.895  -3.564  15.642
  225   HH12  ARG  26          HH12      ARG  26   7.416  -4.156  17.197
  226   HH21  ARG  26          HH21      ARG  26   6.428  -7.265  15.994
  227   HH22  ARG  26          HH22      ARG  26   6.581  -6.262  17.398
  Start of MODEL   35
    1    HA   ARG   1           HA       ARG   1 -18.643   4.560  -1.498
    2    HB2  ARG   1           HB2      ARG   1 -20.853   5.501  -0.619
    3    HB3  ARG   1           HB3      ARG   1 -20.817   4.215   0.589
    4    HG2  ARG   1           HG2      ARG   1 -18.583   5.025   1.339
    5    HG3  ARG   1           HG3      ARG   1 -18.703   6.354   0.186
    6    HD2  ARG   1           HD2      ARG   1 -21.135   6.335   1.677
    7    HD3  ARG   1           HD3      ARG   1 -19.799   6.216   2.839
    8    HE   ARG   1           HE       ARG   1 -20.067   8.372   0.782
    9   HH11  ARG   1          HH11      ARG   1 -17.241   7.912   1.521
   10   HH12  ARG   1          HH12      ARG   1 -17.024   8.950   2.890
   11   HH21  ARG   1          HH21      ARG   1 -20.431   9.330   3.469
   12   HH22  ARG   1          HH22      ARG   1 -18.838   9.756   3.998
   13    H    SER   2           H        SER   2 -17.397   2.528  -1.695
   14    HA   SER   2           HA       SER   2 -17.784   0.384   0.266
   15    HB2  SER   2           HB2      SER   2 -16.026   1.034  -2.043
   16    HB3  SER   2           HB3      SER   2 -15.361  -0.076  -0.849
   17    HG   SER   2           HG       SER   2 -16.532  -1.225  -2.397
   18    H    ALA   3           H        ALA   3 -16.586   0.052   2.144
   19    HA   ALA   3           HA       ALA   3 -14.747   2.274   2.964
   20    HB1  ALA   3           HB1      ALA   3 -15.439   1.679   5.233
   21    HB2  ALA   3           HB2      ALA   3 -16.313   0.273   4.625
   22    HB3  ALA   3           HB3      ALA   3 -16.871   1.899   4.228
   23    H    LEU   4           H        LEU   4 -15.110  -1.284   2.922
   24    HA   LEU   4           HA       LEU   4 -12.235  -1.529   3.734
   25    HB2  LEU   4           HB2      LEU   4 -14.742  -3.080   4.166
   26    HB3  LEU   4           HB3      LEU   4 -13.254  -4.013   4.009
   27    HG   LEU   4           HG       LEU   4 -12.334  -2.174   5.698
   28   HD11  LEU   4          HD11      LEU   4 -15.329  -2.225   6.166
   29   HD12  LEU   4          HD12      LEU   4 -14.333  -0.815   5.803
   30   HD13  LEU   4          HD13      LEU   4 -14.163  -1.639   7.352
   31   HD21  LEU   4          HD21      LEU   4 -12.350  -4.560   6.174
   32   HD22  LEU   4          HD22      LEU   4 -14.093  -4.534   6.435
   33   HD23  LEU   4          HD23      LEU   4 -13.020  -3.709   7.566
   34    H    VAL   5           H        VAL   5 -13.682  -1.209   0.913
   35    HA   VAL   5           HA       VAL   5 -12.450  -3.611  -0.390
   36    HB   VAL   5           HB       VAL   5 -14.569  -1.616  -1.264
   37   HG11  VAL   5          HG11      VAL   5 -14.828  -3.099  -3.250
   38   HG12  VAL   5          HG12      VAL   5 -13.406  -4.003  -2.730
   39   HG13  VAL   5          HG13      VAL   5 -13.249  -2.312  -3.205
   40   HG21  VAL   5          HG21      VAL   5 -16.001  -3.688  -1.243
   41   HG22  VAL   5          HG22      VAL   5 -15.407  -3.224   0.352
   42   HG23  VAL   5          HG23      VAL   5 -14.647  -4.557  -0.519
   43    H    ASN   6           H        ASN   6 -12.903  -0.087  -0.952
   44    HA   ASN   6           HA       ASN   6 -10.733   0.079  -2.882
   45    HB2  ASN   6           HB2      ASN   6 -12.902   1.586  -2.227
   46    HB3  ASN   6           HB3      ASN   6 -11.639   2.488  -1.389
   47   HD21  ASN   6          HD21      ASN   6  -9.862   3.386  -2.726
   48   HD22  ASN   6          HD22      ASN   6 -10.064   3.586  -4.400
   49    H    SER   7           H        SER   7 -11.063   0.888   0.597
   50    HA   SER   7           HA       SER   7  -8.490   2.039   1.014
   51    HB2  SER   7           HB2      SER   7 -10.341   0.380   2.754
   52    HB3  SER   7           HB3      SER   7  -8.899   1.171   3.382
   53    HG   SER   7           HG       SER   7 -10.885   2.409   3.548
   54    H    TYR   8           H        TYR   8  -9.569  -1.364   1.154
   55    HA   TYR   8           HA       TYR   8  -7.013  -2.504   1.852
   56    HB2  TYR   8           HB2      TYR   8  -8.898  -3.845   2.255
   57    HB3  TYR   8           HB3      TYR   8  -9.648  -3.422   0.718
   58    HD1  TYR   8           HD1      TYR   8  -6.729  -5.261   2.171
   59    HD2  TYR   8           HD2      TYR   8  -9.429  -4.841  -1.143
   60    HE1  TYR   8           HE2      TYR   8  -5.785  -7.309   1.140
   61    HE2  TYR   8           HE1      TYR   8  -8.485  -6.889  -2.173
   62    HH   TYR   8           HH       TYR   8  -7.025  -9.125  -0.812
   63    H    LEU   9           H        LEU   9  -8.640  -1.828  -1.247
   64    HA   LEU   9           HA       LEU   9  -6.684  -3.104  -2.947
   65    HB2  LEU   9           HB2      LEU   9  -9.133  -1.573  -3.119
   66    HB3  LEU   9           HB3      LEU   9  -7.978  -0.963  -4.297
   67    HG   LEU   9           HG       LEU   9  -9.304  -2.753  -5.300
   68   HD11  LEU   9          HD11      LEU   9  -6.779  -2.524  -5.730
   69   HD12  LEU   9          HD12      LEU   9  -7.527  -4.057  -6.178
   70   HD13  LEU   9          HD13      LEU   9  -6.592  -3.934  -4.688
   71   HD21  LEU   9          HD21      LEU   9  -9.676  -4.816  -4.323
   72   HD22  LEU   9          HD22      LEU   9  -9.529  -3.828  -2.870
   73   HD23  LEU   9          HD23      LEU   9  -8.157  -4.784  -3.428
   74    H    TRP  10           H        TRP  10  -7.109   0.253  -1.805
   75    HA   TRP  10           HA       TRP  10  -4.835   1.296  -3.297
   76    HB2  TRP  10           HB2      TRP  10  -6.587   2.805  -2.766
   77    HB3  TRP  10           HB3      TRP  10  -6.668   2.256  -1.093
   78    HD1  TRP  10           HD1      TRP  10  -3.810   3.696  -3.295
   79    HE1  TRP  10           HE1      TRP  10  -2.595   5.515  -1.928
   80    HE3  TRP  10           HE3      TRP  10  -6.567   3.561   1.004
   81    HZ2  TRP  10           HZ2      TRP  10  -2.773   6.750   0.643
   82    HZ3  TRP  10           HZ3      TRP  10  -6.022   5.069   2.894
   83    HH2  TRP  10           HH2      TRP  10  -4.130   6.661   2.719
   84    H    GLN  11           H        GLN  11  -5.377   0.352   0.122
   85    HA   GLN  11           HA       GLN  11  -2.874   1.122   1.194
   86    HB2  GLN  11           HB2      GLN  11  -4.722   0.388   2.573
   87    HB3  GLN  11           HB3      GLN  11  -4.735  -1.198   1.801
   88    HG2  GLN  11           HG2      GLN  11  -3.153  -1.970   3.207
   89    HG3  GLN  11           HG3      GLN  11  -2.096  -0.604   2.849
   90   HE21  GLN  11          HE21      GLN  11  -2.837   1.545   4.010
   91   HE22  GLN  11          HE22      GLN  11  -3.384   1.370   5.608
   92    H    ARG  12           H        ARG  12  -3.751  -2.166   0.007
   93    HA   ARG  12           HA       ARG  12  -1.242  -3.406   0.216
   94    HB2  ARG  12           HB2      ARG  12  -3.765  -3.830  -1.048
   95    HB3  ARG  12           HB3      ARG  12  -2.513  -4.190  -2.237
   96    HG2  ARG  12           HG2      ARG  12  -1.540  -5.860  -0.896
   97    HG3  ARG  12           HG3      ARG  12  -2.298  -5.249   0.575
   98    HD2  ARG  12           HD2      ARG  12  -3.708  -7.045   0.157
   99    HD3  ARG  12           HD3      ARG  12  -4.530  -5.822  -0.832
  100    HE   ARG  12           HE       ARG  12  -2.731  -7.951  -1.865
  101   HH11  ARG  12          HH11      ARG  12  -5.592  -7.406  -2.770
  102   HH12  ARG  12          HH12      ARG  12  -5.321  -6.636  -4.298
  103   HH21  ARG  12          HH21      ARG  12  -1.965  -5.979  -3.666
  104   HH22  ARG  12          HH22      ARG  12  -3.260  -5.816  -4.803
  105    H    TRP  13           H        TRP  13  -2.421  -1.286  -2.389
  106    HA   TRP  13           HA       TRP  13  -0.347  -1.619  -4.291
  107    HB2  TRP  13           HB2      TRP  13  -2.596   0.005  -3.836
  108    HB3  TRP  13           HB3      TRP  13  -1.256   1.137  -3.989
  109    HD1  TRP  13           HD1      TRP  13  -3.581   0.743  -6.157
  110    HE1  TRP  13           HE1      TRP  13  -2.926   0.150  -8.582
  111    HE3  TRP  13           HE3      TRP  13   1.099  -1.132  -5.369
  112    HZ2  TRP  13           HZ2      TRP  13  -0.705  -0.969  -9.996
  113    HZ3  TRP  13           HZ3      TRP  13   2.462  -1.952  -7.268
  114    HH2  TRP  13           HH2      TRP  13   1.569  -1.871  -9.578
  115    H    GLU  14           H        GLU  14  -0.608   1.023  -1.888
  116    HA   GLU  14           HA       GLU  14   2.158   1.849  -2.242
  117    HB2  GLU  14           HB2      GLU  14  -0.034   2.506  -0.252
  118    HB3  GLU  14           HB3      GLU  14   1.504   3.369  -0.340
  119    HG2  GLU  14           HG2      GLU  14   0.782   3.451  -2.953
  120    HG3  GLU  14           HG3      GLU  14  -0.814   3.440  -2.199
  121    H    ASN  15           H        ASN  15   0.400  -0.092   0.176
  122    HA   ASN  15           HA       ASN  15   2.318  -0.272   2.229
  123    HB2  ASN  15           HB2      ASN  15   0.140  -1.248   2.476
  124    HB3  ASN  15           HB3      ASN  15   0.353  -2.252   1.044
  125   HD21  ASN  15          HD21      ASN  15   2.652  -1.749   3.783
  126   HD22  ASN  15          HD22      ASN  15   2.702  -3.385   4.227
  127    H    TRP  16           H        TRP  16   2.045  -2.338  -0.702
  128    HA   TRP  16           HA       TRP  16   4.449  -3.854  -0.181
  129    HB2  TRP  16           HB2      TRP  16   2.935  -4.833  -1.690
  130    HB3  TRP  16           HB3      TRP  16   2.627  -3.309  -2.520
  131    HD1  TRP  16           HD1      TRP  16   5.322  -6.033  -2.191
  132    HE1  TRP  16           HE1      TRP  16   6.825  -5.954  -4.283
  133    HE3  TRP  16           HE3      TRP  16   3.411  -1.893  -4.499
  134    HZ2  TRP  16           HZ2      TRP  16   7.170  -4.356  -6.625
  135    HZ3  TRP  16           HZ3      TRP  16   4.349  -1.117  -6.657
  136    HH2  TRP  16           HH2      TRP  16   6.225  -2.342  -7.722
  137    H    PHE  17           H        PHE  17   3.763  -1.006  -2.243
  138    HA   PHE  17           HA       PHE  17   6.319  -0.622  -3.381
  139    HB2  PHE  17           HB2      PHE  17   4.456   0.651  -4.154
  140    HB3  PHE  17           HB3      PHE  17   4.072   1.219  -2.531
  141    HD1  PHE  17           HD1      PHE  17   6.960   1.256  -4.940
  142    HD2  PHE  17           HD2      PHE  17   4.703   3.385  -1.969
  143    HE1  PHE  17           HE1      PHE  17   8.382   3.255  -5.293
  144    HE2  PHE  17           HE2      PHE  17   6.124   5.384  -2.325
  145    HZ   PHE  17           HZ       PHE  17   7.964   5.320  -3.985
  146    H    TRP  18           H        TRP  18   5.023   0.846  -0.366
  147    HA   TRP  18           HA       TRP  18   7.489   2.104   0.414
  148    HB2  TRP  18           HB2      TRP  18   4.993   1.199   1.879
  149    HB3  TRP  18           HB3      TRP  18   6.279   2.101   2.677
  150    HD1  TRP  18           HD1      TRP  18   3.110   2.767   1.250
  151    HE1  TRP  18           HE1      TRP  18   2.916   5.148   0.278
  152    HE3  TRP  18           HE3      TRP  18   8.053   4.020   1.004
  153    HZ2  TRP  18           HZ2      TRP  18   4.635   7.300  -0.495
  154    HZ3  TRP  18           HZ3      TRP  18   8.748   6.237   0.148
  155    HH2  TRP  18           HH2      TRP  18   7.046   7.879  -0.600
  156    H    ASN  19           H        ASN  19   6.061  -1.079   1.176
  157    HA   ASN  19           HA       ASN  19   8.042  -1.906   3.093
  158    HB2  ASN  19           HB2      ASN  19   5.690  -2.818   2.522
  159    HB3  ASN  19           HB3      ASN  19   6.492  -3.712   1.232
  160   HD21  ASN  19          HD21      ASN  19   7.062  -5.791   1.880
  161   HD22  ASN  19          HD22      ASN  19   7.500  -6.235   3.458
  162    H    VAL  20           H        VAL  20   7.985  -2.005  -0.453
  163    HA   VAL  20           HA       VAL  20  10.485  -3.634  -0.476
  164    HB   VAL  20           HB       VAL  20   8.354  -4.117  -1.839
  165   HG11  VAL  20          HG11      VAL  20   9.452  -2.093  -3.775
  166   HG12  VAL  20          HG12      VAL  20   8.290  -1.595  -2.547
  167   HG13  VAL  20          HG13      VAL  20   7.851  -2.830  -3.725
  168   HG21  VAL  20          HG21      VAL  20  10.606  -5.121  -2.270
  169   HG22  VAL  20          HG22      VAL  20  10.945  -3.795  -3.382
  170   HG23  VAL  20          HG23      VAL  20   9.643  -4.930  -3.735
  171    H    THR  21           H        THR  21   9.578  -0.338  -0.592
  172    HA   THR  21           HA       THR  21  11.990   0.385  -2.209
  173    HB   THR  21           HB       THR  21   9.534   1.978  -1.410
  174    HG1  THR  21           HG1      THR  21   8.814   0.681  -2.933
  175   HG21  THR  21          HG21      THR  21  11.885   2.616  -3.208
  176   HG22  THR  21          HG22      THR  21  11.378   3.487  -1.760
  177   HG23  THR  21          HG23      THR  21  10.379   3.534  -3.212
  178    H    LEU  22           H        LEU  22  10.466   0.807   0.955
  179    HA   LEU  22           HA       LEU  22  12.327   2.843   1.884
  180    HB2  LEU  22           HB2      LEU  22  10.371   0.968   3.237
  181    HB3  LEU  22           HB3      LEU  22  11.285   2.194   4.114
  182    HG   LEU  22           HG       LEU  22   9.526   2.831   1.730
  183   HD11  LEU  22          HD11      LEU  22   8.093   1.941   3.475
  184   HD12  LEU  22          HD12      LEU  22   7.922   3.696   3.461
  185   HD13  LEU  22          HD13      LEU  22   8.908   2.916   4.698
  186   HD21  LEU  22          HD21      LEU  22  10.906   4.474   3.871
  187   HD22  LEU  22          HD22      LEU  22   9.658   5.131   2.814
  188   HD23  LEU  22          HD23      LEU  22  11.171   4.541   2.129
  189    H    ARG  23           H        ARG  23  12.168  -0.690   2.111
  190    HA   ARG  23           HA       ARG  23  14.214  -1.121   4.038
  191    HB2  ARG  23           HB2      ARG  23  12.564  -2.621   2.324
  192    HB3  ARG  23           HB3      ARG  23  14.210  -3.087   1.891
  193    HG2  ARG  23           HG2      ARG  23  14.231  -2.980   4.688
  194    HG3  ARG  23           HG3      ARG  23  12.687  -3.733   4.287
  195    HD2  ARG  23           HD2      ARG  23  13.817  -5.673   3.953
  196    HD3  ARG  23           HD3      ARG  23  14.587  -4.912   2.546
  197    HE   ARG  23           HE       ARG  23  15.711  -4.875   5.319
  198   HH11  ARG  23          HH11      ARG  23  17.131  -6.473   3.288
  199   HH12  ARG  23          HH12      ARG  23  18.327  -5.374   2.687
  200   HH21  ARG  23          HH21      ARG  23  16.743  -2.550   3.956
  201   HH22  ARG  23          HH22      ARG  23  18.105  -3.143   3.066
  202    HA   PRO  24           HA       PRO  24  17.420  -1.246   0.494
  203    HB2  PRO  24           HB2      PRO  24  16.653  -0.495  -2.024
  204    HB3  PRO  24           HB3      PRO  24  16.533  -2.165  -1.435
  205    HG2  PRO  24           HG2      PRO  24  14.417  -0.099  -1.713
  206    HG3  PRO  24           HG3      PRO  24  14.335  -1.846  -1.982
  207    HD2  PRO  24           HD2      PRO  24  13.390  -0.585   0.261
  208    HD3  PRO  24           HD3      PRO  24  13.889  -2.287   0.207
  209    H    GLU  25           H        GLU  25  18.287   0.627  -1.272
  210    HA   GLU  25           HA       GLU  25  18.948   2.876  -1.495
  211    HB2  GLU  25           HB2      GLU  25  16.197   2.742  -1.526
  212    HB3  GLU  25           HB3      GLU  25  16.483   3.915  -0.241
  213    HG2  GLU  25           HG2      GLU  25  18.280   4.700  -2.199
  214    HG3  GLU  25           HG3      GLU  25  16.877   4.185  -3.137
  215    H    ARG  26           H        ARG  26  18.280   5.087   0.236
  216    HA   ARG  26           HA       ARG  26  19.726   4.244   2.720
  217    HB2  ARG  26           HB2      ARG  26  20.493   6.590   2.747
  218    HB3  ARG  26           HB3      ARG  26  20.844   5.846   1.189
  219    HG2  ARG  26           HG2      ARG  26  19.427   7.227   0.073
  220    HG3  ARG  26           HG3      ARG  26  18.190   7.122   1.325
  221    HD2  ARG  26           HD2      ARG  26  20.734   8.716   1.748
  222    HD3  ARG  26           HD3      ARG  26  19.284   9.431   1.015
  223    HE   ARG  26           HE       ARG  26  18.974   7.977   3.596
  224   HH11  ARG  26          HH11      ARG  26  20.288  10.857   3.384
  225   HH12  ARG  26          HH12      ARG  26  18.929  11.814   3.873
  226   HH21  ARG  26          HH21      ARG  26  16.646   9.214   3.532
  227   HH22  ARG  26          HH22      ARG  26  16.859  10.879   3.956
  Start of MODEL   36
    1    HA   ARG   1           HA       ARG   1 -13.605  -2.087  -5.293
    2    HB2  ARG   1           HB2      ARG   1 -14.117  -1.508  -7.849
    3    HB3  ARG   1           HB3      ARG   1 -15.547  -0.753  -7.146
    4    HG2  ARG   1           HG2      ARG   1 -14.040   0.493  -5.570
    5    HG3  ARG   1           HG3      ARG   1 -12.657  -0.166  -6.444
    6    HD2  ARG   1           HD2      ARG   1 -13.819   0.822  -8.569
    7    HD3  ARG   1           HD3      ARG   1 -14.720   1.814  -7.407
    8    HE   ARG   1           HE       ARG   1 -12.507   2.595  -6.525
    9   HH11  ARG   1          HH11      ARG   1 -12.812   3.481  -9.419
   10   HH12  ARG   1          HH12      ARG   1 -11.265   3.059 -10.070
   11   HH21  ARG   1          HH21      ARG   1 -10.426   0.970  -7.420
   12   HH22  ARG   1          HH22      ARG   1  -9.908   1.632  -8.935
   13    H    SER   2           H        SER   2 -14.509  -1.205  -3.451
   14    HA   SER   2           HA       SER   2 -17.366  -0.654  -3.178
   15    HB2  SER   2           HB2      SER   2 -16.644  -3.277  -2.892
   16    HB3  SER   2           HB3      SER   2 -16.473  -2.709  -1.233
   17    HG   SER   2           HG       SER   2 -18.731  -2.975  -2.825
   18    H    ALA   3           H        ALA   3 -17.725  -0.393  -0.560
   19    HA   ALA   3           HA       ALA   3 -16.107   1.801   0.281
   20    HB1  ALA   3           HB1      ALA   3 -17.829  -0.134   1.866
   21    HB2  ALA   3           HB2      ALA   3 -18.402   1.317   1.042
   22    HB3  ALA   3           HB3      ALA   3 -17.314   1.459   2.422
   23    H    LEU   4           H        LEU   4 -16.015  -1.642   1.303
   24    HA   LEU   4           HA       LEU   4 -13.429  -1.098   2.709
   25    HB2  LEU   4           HB2      LEU   4 -15.716  -2.999   2.994
   26    HB3  LEU   4           HB3      LEU   4 -14.124  -3.567   3.497
   27    HG   LEU   4           HG       LEU   4 -14.793  -0.840   4.411
   28   HD11  LEU   4          HD11      LEU   4 -17.005  -1.881   4.633
   29   HD12  LEU   4          HD12      LEU   4 -16.275  -1.668   6.224
   30   HD13  LEU   4          HD13      LEU   4 -16.288  -3.260   5.466
   31   HD21  LEU   4          HD21      LEU   4 -13.795  -1.710   6.484
   32   HD22  LEU   4          HD22      LEU   4 -12.775  -2.114   5.104
   33   HD23  LEU   4          HD23      LEU   4 -13.813  -3.344   5.822
   34    H    VAL   5           H        VAL   5 -14.243  -1.947  -0.324
   35    HA   VAL   5           HA       VAL   5 -12.355  -4.251  -0.545
   36    HB   VAL   5           HB       VAL   5 -14.427  -3.032  -2.399
   37   HG11  VAL   5          HG11      VAL   5 -13.957  -5.087  -3.801
   38   HG12  VAL   5          HG12      VAL   5 -12.523  -5.356  -2.811
   39   HG13  VAL   5          HG13      VAL   5 -12.656  -3.898  -3.794
   40   HG21  VAL   5          HG21      VAL   5 -15.573  -5.200  -2.029
   41   HG22  VAL   5          HG22      VAL   5 -15.334  -4.332  -0.512
   42   HG23  VAL   5          HG23      VAL   5 -14.282  -5.685  -0.929
   43    H    ASN   6           H        ASN   6 -12.952  -0.974  -1.873
   44    HA   ASN   6           HA       ASN   6 -10.460  -1.037  -3.448
   45    HB2  ASN   6           HB2      ASN   6 -12.644   0.102  -4.085
   46    HB3  ASN   6           HB3      ASN   6 -12.305   1.288  -2.823
   47   HD21  ASN   6          HD21      ASN   6 -10.851   2.977  -3.340
   48   HD22  ASN   6          HD22      ASN   6  -9.962   3.053  -4.783
   49    H    SER   7           H        SER   7 -11.619   0.401  -0.396
   50    HA   SER   7           HA       SER   7  -9.460   2.181   0.128
   51    HB2  SER   7           HB2      SER   7 -11.764   1.427   1.367
   52    HB3  SER   7           HB3      SER   7 -10.587   0.604   2.386
   53    HG   SER   7           HG       SER   7 -10.976   3.335   1.904
   54    H    TYR   8           H        TYR   8  -9.850  -1.246   1.129
   55    HA   TYR   8           HA       TYR   8  -7.243  -1.531   2.303
   56    HB2  TYR   8           HB2      TYR   8  -8.871  -3.153   2.858
   57    HB3  TYR   8           HB3      TYR   8  -9.369  -3.359   1.179
   58    HD1  TYR   8           HD1      TYR   8  -6.368  -3.798   3.393
   59    HD2  TYR   8           HD2      TYR   8  -8.551  -5.180  -0.041
   60    HE1  TYR   8           HE1      TYR   8  -4.785  -5.689   3.147
   61    HE2  TYR   8           HE2      TYR   8  -6.967  -7.073  -0.284
   62    HH   TYR   8           HH       TYR   8  -4.397  -7.420   0.464
   63    H    LEU   9           H        LEU   9  -8.487  -2.105  -0.994
   64    HA   LEU   9           HA       LEU   9  -6.176  -3.274  -2.163
   65    HB2  LEU   9           HB2      LEU   9  -8.624  -1.832  -3.001
   66    HB3  LEU   9           HB3      LEU   9  -7.310  -1.790  -4.174
   67    HG   LEU   9           HG       LEU   9  -8.409  -4.306  -2.886
   68   HD11  LEU   9          HD11      LEU   9  -8.762  -3.176  -5.679
   69   HD12  LEU   9          HD12      LEU   9 -10.019  -3.312  -4.449
   70   HD13  LEU   9          HD13      LEU   9  -9.311  -4.767  -5.152
   71   HD21  LEU   9          HD21      LEU   9  -7.051  -5.245  -4.940
   72   HD22  LEU   9          HD22      LEU   9  -6.203  -4.834  -3.450
   73   HD23  LEU   9          HD23      LEU   9  -6.180  -3.717  -4.816
   74    H    TRP  10           H        TRP  10  -7.060   0.168  -1.758
   75    HA   TRP  10           HA       TRP  10  -4.791   1.267  -3.148
   76    HB2  TRP  10           HB2      TRP  10  -6.702   2.641  -2.743
   77    HB3  TRP  10           HB3      TRP  10  -6.715   2.246  -1.024
   78    HD1  TRP  10           HD1      TRP  10  -4.376   4.001  -3.561
   79    HE1  TRP  10           HE1      TRP  10  -3.166   5.924  -2.340
   80    HE3  TRP  10           HE3      TRP  10  -6.198   3.328   1.157
   81    HZ2  TRP  10           HZ2      TRP  10  -2.998   7.030   0.293
   82    HZ3  TRP  10           HZ3      TRP  10  -5.499   4.825   3.003
   83    HH2  TRP  10           HH2      TRP  10  -3.902   6.674   2.577
   84    H    GLN  11           H        GLN  11  -5.379   0.600   0.329
   85    HA   GLN  11           HA       GLN  11  -2.884   1.566   1.319
   86    HB2  GLN  11           HB2      GLN  11  -4.884  -0.521   2.214
   87    HB3  GLN  11           HB3      GLN  11  -3.458  -0.139   3.181
   88    HG2  GLN  11           HG2      GLN  11  -4.166   2.303   3.049
   89    HG3  GLN  11           HG3      GLN  11  -5.691   1.736   2.370
   90   HE21  GLN  11          HE21      GLN  11  -6.986   0.201   3.776
   91   HE22  GLN  11          HE22      GLN  11  -6.828   0.313   5.463
   92    H    ARG  12           H        ARG  12  -3.794  -1.584  -0.063
   93    HA   ARG  12           HA       ARG  12  -1.362  -2.986   0.589
   94    HB2  ARG  12           HB2      ARG  12  -3.825  -3.364  -0.881
   95    HB3  ARG  12           HB3      ARG  12  -2.470  -3.973  -1.830
   96    HG2  ARG  12           HG2      ARG  12  -2.755  -4.649   1.098
   97    HG3  ARG  12           HG3      ARG  12  -3.570  -5.599  -0.145
   98    HD2  ARG  12           HD2      ARG  12  -1.625  -6.583  -0.828
   99    HD3  ARG  12           HD3      ARG  12  -0.712  -5.067  -0.703
  100    HE   ARG  12           HE       ARG  12  -0.432  -5.474   1.680
  101   HH11  ARG  12          HH11      ARG  12   0.485  -8.095   0.625
  102   HH12  ARG  12          HH12      ARG  12  -0.448  -9.226   1.547
  103   HH21  ARG  12          HH21      ARG  12  -2.769  -6.860   2.593
  104   HH22  ARG  12          HH22      ARG  12  -2.295  -8.523   2.667
  105    H    TRP  13           H        TRP  13  -2.370  -1.058  -2.248
  106    HA   TRP  13           HA       TRP  13  -0.115  -1.570  -3.914
  107    HB2  TRP  13           HB2      TRP  13  -1.482  -0.313  -5.208
  108    HB3  TRP  13           HB3      TRP  13  -2.435   0.126  -3.798
  109    HD1  TRP  13           HD1      TRP  13  -2.539   2.606  -3.353
  110    HE1  TRP  13           HE1      TRP  13  -1.074   4.658  -3.895
  111    HE3  TRP  13           HE3      TRP  13   1.382   0.305  -5.676
  112    HZ2  TRP  13           HZ2      TRP  13   1.431   5.244  -5.146
  113    HZ3  TRP  13           HZ3      TRP  13   3.290   1.631  -6.534
  114    HH2  TRP  13           HH2      TRP  13   3.320   4.096  -6.270
  115    H    GLU  14           H        GLU  14  -0.633   1.004  -1.466
  116    HA   GLU  14           HA       GLU  14   2.044   2.113  -1.788
  117    HB2  GLU  14           HB2      GLU  14  -0.304   2.415   0.062
  118    HB3  GLU  14           HB3      GLU  14   1.246   3.114   0.536
  119    HG2  GLU  14           HG2      GLU  14   1.197   4.009  -1.977
  120    HG3  GLU  14           HG3      GLU  14  -0.542   3.842  -1.744
  121    H    ASN  15           H        ASN  15   0.480  -0.124   0.519
  122    HA   ASN  15           HA       ASN  15   2.582  -0.471   2.379
  123    HB2  ASN  15           HB2      ASN  15   0.489  -1.461   2.852
  124    HB3  ASN  15           HB3      ASN  15   0.379  -2.208   1.260
  125   HD21  ASN  15          HD21      ASN  15   3.205  -2.342   3.498
  126   HD22  ASN  15          HD22      ASN  15   3.150  -4.026   3.692
  127    H    TRP  16           H        TRP  16   1.982  -2.239  -0.688
  128    HA   TRP  16           HA       TRP  16   4.304  -3.916  -0.568
  129    HB2  TRP  16           HB2      TRP  16   2.643  -4.531  -2.118
  130    HB3  TRP  16           HB3      TRP  16   2.439  -2.878  -2.697
  131    HD1  TRP  16           HD1      TRP  16   5.035  -5.737  -2.813
  132    HE1  TRP  16           HE1      TRP  16   6.394  -5.503  -4.991
  133    HE3  TRP  16           HE3      TRP  16   3.061  -1.386  -4.621
  134    HZ2  TRP  16           HZ2      TRP  16   6.614  -3.710  -7.206
  135    HZ3  TRP  16           HZ3      TRP  16   3.862  -0.440  -6.766
  136    HH2  TRP  16           HH2      TRP  16   5.634  -1.595  -8.061
  137    H    PHE  17           H        PHE  17   3.754  -0.756  -2.176
  138    HA   PHE  17           HA       PHE  17   6.343  -0.395  -3.289
  139    HB2  PHE  17           HB2      PHE  17   4.142   0.919  -3.575
  140    HB3  PHE  17           HB3      PHE  17   4.604   1.784  -2.109
  141    HD1  PHE  17           HD1      PHE  17   5.666   0.969  -5.580
  142    HD2  PHE  17           HD2      PHE  17   6.296   3.470  -2.143
  143    HE1  PHE  17           HE1      PHE  17   7.161   2.429  -6.915
  144    HE2  PHE  17           HE2      PHE  17   7.790   4.929  -3.479
  145    HZ   PHE  17           HZ       PHE  17   8.222   4.409  -5.866
  146    H    TRP  18           H        TRP  18   5.075   0.785  -0.136
  147    HA   TRP  18           HA       TRP  18   7.565   1.878   0.790
  148    HB2  TRP  18           HB2      TRP  18   5.054   0.876   2.158
  149    HB3  TRP  18           HB3      TRP  18   6.360   1.668   3.036
  150    HD1  TRP  18           HD1      TRP  18   3.194   2.514   1.699
  151    HE1  TRP  18           HE1      TRP  18   3.015   4.986   0.995
  152    HE3  TRP  18           HE3      TRP  18   8.153   3.767   1.587
  153    HZ2  TRP  18           HZ2      TRP  18   4.742   7.197   0.457
  154    HZ3  TRP  18           HZ3      TRP  18   8.850   6.059   0.975
  155    HH2  TRP  18           HH2      TRP  18   7.153   7.777   0.412
  156    H    ASN  19           H        ASN  19   6.488  -1.416   0.521
  157    HA   ASN  19           HA       ASN  19   8.350  -2.397   2.608
  158    HB2  ASN  19           HB2      ASN  19   6.174  -3.503   0.860
  159    HB3  ASN  19           HB3      ASN  19   7.332  -4.617   1.588
  160   HD21  ASN  19          HD21      ASN  19   5.980  -5.529   3.221
  161   HD22  ASN  19          HD22      ASN  19   5.287  -4.612   4.468
  162    H    VAL  20           H        VAL  20   8.141  -2.166  -0.926
  163    HA   VAL  20           HA       VAL  20  10.658  -3.770  -1.175
  164    HB   VAL  20           HB       VAL  20   9.996  -3.989  -3.526
  165   HG11  VAL  20          HG11      VAL  20   8.922  -5.378  -1.615
  166   HG12  VAL  20          HG12      VAL  20   8.159  -5.425  -3.204
  167   HG13  VAL  20          HG13      VAL  20   7.477  -4.415  -1.928
  168   HG21  VAL  20          HG21      VAL  20   7.363  -2.898  -3.497
  169   HG22  VAL  20          HG22      VAL  20   8.728  -2.401  -4.496
  170   HG23  VAL  20          HG23      VAL  20   8.457  -1.636  -2.930
  171    H    THR  21           H        THR  21   9.814  -0.540  -0.892
  172    HA   THR  21           HA       THR  21  11.947   0.359  -2.794
  173    HB   THR  21           HB       THR  21   9.667   1.853  -1.460
  174    HG1  THR  21           HG1      THR  21   8.641   0.833  -2.986
  175   HG21  THR  21          HG21      THR  21  11.723   2.676  -3.521
  176   HG22  THR  21          HG22      THR  21  11.441   3.401  -1.939
  177   HG23  THR  21          HG23      THR  21  10.241   3.583  -3.218
  178    H    LEU  22           H        LEU  22  11.188   0.057   0.567
  179    HA   LEU  22           HA       LEU  22  13.182   2.100   1.377
  180    HB2  LEU  22           HB2      LEU  22  11.096   0.401   2.747
  181    HB3  LEU  22           HB3      LEU  22  12.307   1.276   3.684
  182    HG   LEU  22           HG       LEU  22  11.575   3.341   2.264
  183   HD11  LEU  22          HD11      LEU  22   8.863   2.303   2.143
  184   HD12  LEU  22          HD12      LEU  22   9.949   1.399   1.093
  185   HD13  LEU  22          HD13      LEU  22   9.793   3.144   0.905
  186   HD21  LEU  22          HD21      LEU  22  11.147   3.197   4.650
  187   HD22  LEU  22          HD22      LEU  22   9.811   2.076   4.382
  188   HD23  LEU  22          HD23      LEU  22   9.674   3.754   3.857
  189    H    ARG  23           H        ARG  23  12.669  -1.402   1.423
  190    HA   ARG  23           HA       ARG  23  15.547  -1.746   2.198
  191    HB2  ARG  23           HB2      ARG  23  13.042  -3.150   3.166
  192    HB3  ARG  23           HB3      ARG  23  14.652  -3.828   3.412
  193    HG2  ARG  23           HG2      ARG  23  14.245  -0.975   4.192
  194    HG3  ARG  23           HG3      ARG  23  13.507  -2.204   5.217
  195    HD2  ARG  23           HD2      ARG  23  15.827  -3.364   5.178
  196    HD3  ARG  23           HD3      ARG  23  16.437  -1.806   4.586
  197    HE   ARG  23           HE       ARG  23  15.686  -0.768   6.659
  198   HH11  ARG  23          HH11      ARG  23  17.205  -3.190   7.652
  199   HH12  ARG  23          HH12      ARG  23  16.104  -3.840   8.818
  200   HH21  ARG  23          HH21      ARG  23  13.381  -2.023   7.648
  201   HH22  ARG  23          HH22      ARG  23  13.929  -3.177   8.816
  202    HA   PRO  24           HA       PRO  24  14.381  -4.126  -1.648
  203    HB2  PRO  24           HB2      PRO  24  16.006  -2.828  -3.421
  204    HB3  PRO  24           HB3      PRO  24  14.354  -2.296  -3.060
  205    HG2  PRO  24           HG2      PRO  24  16.937  -1.179  -2.154
  206    HG3  PRO  24           HG3      PRO  24  15.398  -0.366  -2.464
  207    HD2  PRO  24           HD2      PRO  24  16.411  -1.032   0.043
  208    HD3  PRO  24           HD3      PRO  24  14.727  -0.602  -0.319
  209    H    GLU  25           H        GLU  25  15.801  -5.443   0.055
  210    HA   GLU  25           HA       GLU  25  17.676  -6.813   0.482
  211    HB2  GLU  25           HB2      GLU  25  17.392  -6.520  -2.490
  212    HB3  GLU  25           HB3      GLU  25  18.787  -7.398  -1.864
  213    HG2  GLU  25           HG2      GLU  25  17.330  -8.914  -0.626
  214    HG3  GLU  25           HG3      GLU  25  15.907  -7.996  -1.122
  215    H    ARG  26           H        ARG  26  18.413  -4.411   1.316
  216    HA   ARG  26           HA       ARG  26  21.026  -3.778  -0.018
  217    HB2  ARG  26           HB2      ARG  26  18.922  -2.147   0.271
  218    HB3  ARG  26           HB3      ARG  26  19.643  -1.905   1.863
  219    HG2  ARG  26           HG2      ARG  26  21.539  -1.830  -0.413
  220    HG3  ARG  26           HG3      ARG  26  20.379  -0.502  -0.351
  221    HD2  ARG  26           HD2      ARG  26  21.384   0.430   1.471
  222    HD3  ARG  26           HD3      ARG  26  21.583  -1.143   2.269
  223    HE   ARG  26           HE       ARG  26  23.322  -0.579  -0.072
  224   HH11  ARG  26          HH11      ARG  26  23.529  -2.691   2.236
  225   HH12  ARG  26          HH12      ARG  26  24.922  -2.077   3.065
  226   HH21  ARG  26          HH21      ARG  26  24.846   1.008   1.462
  227   HH22  ARG  26          HH22      ARG  26  25.671   0.025   2.625