*HEADER    MEMBRANE PROTEIN                        21-JUN-10   2KZQ              
*TITLE     S34R STRUCTURE                                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ENVELOPE GLYCOPROTEIN E2 PEPTIDE;                          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: E2[296-331] SEGMENT, UNP RESIDUES 684-719;                 
*COMPND   5 SYNONYM: ENVELOPE GLYCOPROTEIN E2, NS1, GP68, GP70;                  
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HEPATITIS C VIRUS;                              
*SOURCE   4 ORGANISM_COMMON: HCV;                                                
*SOURCE   5 ORGANISM_TAXID: 356411;                                              
*SOURCE   6 OTHER_DETAILS: CHEMICAL SYNTHESIS                                    
*KEYWDS    MEMBRANE PROTEIN, E2 STRUCTURAL PROTEIN, HCV                          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    36                                                                    
*AUTHOR    R.MONTSERRET, J.DUBUISSON, F.PENIN                                    
*REVDAT   1   02-MAR-11 2KZQ    0                                                


!============================================================================
!   > RESTRAINTS FROM s34r_noe_list.txt
!   > SEQUENCE
!  SDLPALSTGLLHLHQNIVDVQYMYGLSPAITKYVVR
!
!   > 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)
!============================================================================
! <========== S1 ==========>
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   )  3.9  2.1  1.4
! <========== D2 ==========>
assign (resid 2     and name HN   )(resid 3     and name HN   )  3.9  2.1  0.4
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   )  3.9  2.1  0.4
assign (resid 2     and name HB2  )(resid 3     and name HN   )  3.9  2.1  0.4
! <========== L3 ==========>
assign (resid 3     and name HN   )(resid 4     and name HD1  )  2.8  1.0  0.3
assign (resid 3     and name HN   )(resid 4     and name HD2  )  3.9  2.1  0.4
assign (resid 3     and name HA   )(resid 4     and name HD1  )  3.9  2.1  0.4
assign (resid 3     and name HA   )(resid 4     and name HD2  )  3.9  2.1  0.4
assign (resid 3     and name HB1  )(resid 4     and name HD1  )  3.9  2.1  0.4
assign (resid 3     and name HB1  )(resid 4     and name HD2  )  5.0  3.2  0.5
assign (resid 3     and name HB2  )(resid 4     and name HD1  )  3.9  2.1  0.4
assign (resid 3     and name HB2  )(resid 4     and name HD2  )  5.0  3.2  0.5
! <========== P4 ==========>
assign (resid 4     and name HA   )(resid 5     and name HN   )  2.8  1.0  0.3
assign (resid 4     and name HB1  )(resid 5     and name HN   )  5.0  3.2  0.5
assign (resid 4     and name HB2  )(resid 5     and name HN   )  3.9  2.1  0.4
assign (resid 4     and name HG1  )(resid 5     and name HN   )  5.0  3.2  0.5
assign (resid 4     and name HG2  )(resid 5     and name HN   )  5.0  3.2  0.5
assign (resid 4     and name HD1  )(resid 5     and name HN   )  5.0  3.2  0.5
assign (resid 4     and name HD2  )(resid 5     and name HN   )  3.9  2.1  0.4
! <========== A5 ==========>
assign (resid 5     and name HN   )(resid 6     and name HN   )  2.8  1.0  0.3
assign (resid 5     and name HB#  )(resid 6     and name HN   )  2.8  1.0  1.3
! <========== L6 ==========>
assign (resid 6     and name HN   )(resid 7     and name HN   )  2.8  1.0  0.3
assign (resid 6     and name HB#  )(resid 7     and name HN   )  2.8  1.0  1.3
! <========== S7 ==========>
assign (resid 7     and name HN   )(resid 8     and name HN   )  2.8  1.0  0.3
assign (resid 7     and name HA   )(resid 8     and name HN   )  2.8  1.0  0.3
! <========== T8 ==========>
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   )  2.8  1.0  0.3
assign (resid 8     and name HB   )(resid 9     and name HN   )  5.0  3.2  0.5
assign (resid 8     and name HG2# )(resid 9     and name HN   )  5.0  3.2  1.5
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  )  2.8  1.0  0.3
assign (resid 8     and name HA   )(resid 11    and name HB2  )  3.9  2.1  0.4
assign (resid 8     and name HA   )(resid 12    and name HN   )  5.0  3.2  0.5
assign (resid 8     and name HG2# )(resid 12    and name HD2  )  5.0  3.2  1.5
assign (resid 8     and name HG2# )(resid 12    and name HE1  )  5.0  3.2  1.5
! <========== G9 ==========>
assign (resid 9     and name HA#  )(resid 10    and name HN   )  2.8  1.0  1.3
assign (resid 9     and name HA#  )(resid 12    and name HN   )  3.9  2.1  1.4
assign (resid 9     and name HA#  )(resid 12    and name HB#  )  2.8  1.0  2.3
! <========== L10 ==========>
assign (resid 10    and name HN   )(resid 11    and name HN   )  2.8  1.0  0.3
assign (resid 10    and name HA   )(resid 11    and name HN   )  3.9  2.1  0.4
assign (resid 10    and name HB1  )(resid 11    and name HN   )  3.9  2.1  0.4
assign (resid 10    and name HA   )(resid 12    and name HN   )  5.0  3.2  0.5
assign (resid 10    and name HA   )(resid 13    and name HN   )  3.9  2.1  0.4
assign (resid 10    and name HA   )(resid 13    and name HB1  )  2.8  1.0  0.3
assign (resid 10    and name HA   )(resid 13    and name HB2  )  2.8  1.0  0.3
! <========== L11 ==========>
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   )  2.8  1.0  0.3
assign (resid 11    and name HB2  )(resid 12    and name HN   )  3.9  2.1  0.4
assign (resid 11    and name HG   )(resid 12    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 11    and name HA   )(resid 15    and name HN   )  5.0  3.2  0.5
! <========== H12 ==========>
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   )  5.0  3.2  0.5
assign (resid 12    and name HB#  )(resid 13    and name HN   )  2.8  1.0  1.3
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  )  3.9  2.1  0.4
assign (resid 12    and name HA   )(resid 16    and name HN   )  5.0  3.2  0.5
! <========== L13 ==========>
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   )  3.9  2.1  0.4
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 13    and name HG   )(resid 14    and name HN   )  5.0  3.2  0.5
assign (resid 13    and name HA   )(resid 15    and name HN   )  5.0  3.2  0.5
assign (resid 13    and name HA   )(resid 16    and name HN   )  3.9  2.1  0.4
assign (resid 13    and name HA   )(resid 16    and name HB1  )  2.8  1.0  0.3
assign (resid 13    and name HA   )(resid 16    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
! <========== H14 ==========>
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   )  3.9  2.1  0.4
assign (resid 14    and name HB#  )(resid 15    and name HN   )  2.8  1.0  1.3
assign (resid 14    and name HN   )(resid 16    and name HN   )  5.0  3.2  0.5
assign (resid 14    and name HA   )(resid 16    and name HN   )  5.0  3.2  0.5
assign (resid 14    and name HA   )(resid 17    and name HN   )  3.9  2.1  0.4
assign (resid 14    and name HA   )(resid 17    and name HB   )  2.8  1.0  0.3
assign (resid 14    and name HA   )(resid 18    and name HN   )  5.0  3.2  0.5
assign (resid 14    and name HD2  )(resid 18    and name HG1# )  3.9  2.1  1.4
assign (resid 14    and name HD2  )(resid 18    and name HG2# )  5.0  3.2  1.5
assign (resid 14    and name HE1  )(resid 18    and name HG1# )  3.9  2.1  1.4
assign (resid 14    and name HE1  )(resid 18    and name HG2# )  5.0  3.2  1.5
! <========== Q15 ==========>
assign (resid 15    and name HN   )(resid 16    and name HN   )  2.8  1.0  0.3
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 15    and name HN   )(resid 17    and name HN   )  5.0  3.2  0.5
assign (resid 15    and name HA   )(resid 17    and name HN   )  5.0  3.2  0.5
assign (resid 15    and name HA   )(resid 18    and name HN   )  3.9  2.1  0.4
assign (resid 15    and name HA   )(resid 18    and name HB   )  2.8  1.0  0.3
assign (resid 15    and name HE22 )(resid 18    and name HG1# )  5.0  3.2  1.5
assign (resid 15    and name HE22 )(resid 18    and name HG2# )  5.0  3.2  1.5
! <========== N16 ==========>
assign (resid 16    and name HA   )(resid 17    and name HN   )  3.9  2.1  0.4
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 16    and name HN   )(resid 18    and name HN   )  5.0  3.2  0.5
assign (resid 16    and name HA   )(resid 18    and name HN   )  5.0  3.2  0.5
assign (resid 16    and name HA   )(resid 19    and name HN   )  3.9  2.1  0.4
assign (resid 16    and name HA   )(resid 19    and name HB1  )  3.9  2.1  0.4
assign (resid 16    and name HA   )(resid 19    and name HB2  )  3.9  2.1  0.4
assign (resid 16    and name HD21 )(resid 20    and name HG1# )  5.0  3.2  1.5
! <========== I17 ==========>
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   )  3.9  2.1  0.4
assign (resid 17    and name HB   )(resid 18    and name HN   )  2.8  1.0  0.3
assign (resid 17    and name HA   )(resid 19    and name HN   )  5.0  3.2  0.5
assign (resid 17    and name HA   )(resid 20    and name HB   )  2.8  1.0  0.3
! <========== V18 ==========>
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   )  2.8  1.0  0.3
assign (resid 18    and name HB   )(resid 19    and name HN   )  2.8  1.0  0.3
assign (resid 18    and name HN   )(resid 20    and name HN   )  5.0  3.2  0.5
assign (resid 18    and name HA   )(resid 21    and name HB2  )  3.9  2.1  0.4
assign (resid 18    and name HG2# )(resid 22    and name HD*  )  5.0  3.2  3.5
assign (resid 18    and name HG1# )(resid 22    and name HD*  )  5.0  3.2  3.5
assign (resid 18    and name HA   )(resid 22    and name HN   )  5.0  3.2  0.5
! <========== D19 ==========>
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 19    and name HA   )(resid 22    and name HN   )  5.0  3.2  0.5
assign (resid 19    and name HA   )(resid 22    and name HB#  )  2.8  1.0  1.3
assign (resid 19    and name HA   )(resid 23    and name HN   )  5.0  3.2  0.5
! <========== V20 ==========>
assign (resid 20    and name HA   )(resid 21    and name HN   )  2.8  1.0  0.3
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 20    and name HA   )(resid 22    and name HN   )  5.0  3.2  0.5
assign (resid 20    and name HG1# )(resid 22    and name HE*  )  5.0  3.2  3.5
assign (resid 20    and name HG2# )(resid 22    and name HE*  )  5.0  3.2  3.5
assign (resid 20    and name HA   )(resid 23    and name HN   )  3.9  2.1  0.4
assign (resid 20    and name HA   )(resid 23    and name HB1  )  3.9  2.1  0.4
assign (resid 20    and name HA   )(resid 23    and name HB2  )  3.9  2.1  0.4
assign (resid 20    and name HA   )(resid 24    and name HN   )  5.0  3.2  0.5
assign (resid 20    and name HA   )(resid 24    and name HD*  )  5.0  3.2  2.5
assign (resid 20    and name HG1# )(resid 24    and name HD*  )  5.0  3.2  3.5
assign (resid 20    and name HG2# )(resid 24    and name HD*  )  3.9  2.1  3.4
! <========== Q21 ==========>
assign (resid 21    and name HN   )(resid 22    and name HN   )  2.8  1.0  0.3
assign (resid 21    and name HA   )(resid 22    and name HN   )  3.9  2.1  0.4
assign (resid 21    and name HB1  )(resid 22    and name HN   )  3.9  2.1  0.4
assign (resid 21    and name HB2  )(resid 22    and name HN   )  3.9  2.1  0.4
assign (resid 21    and name HA   )(resid 23    and name HN   )  5.0  3.2  0.5
assign (resid 21    and name HA   )(resid 24    and name HN   )  3.9  2.1  0.4
assign (resid 21    and name HA   )(resid 24    and name HB1  )  3.9  2.1  0.4
assign (resid 21    and name HA   )(resid 24    and name HB2  )  3.9  2.1  0.4
! <========== Y22 ==========>
assign (resid 22    and name HN   )(resid 23    and name HN   )  2.8  1.0  0.3
assign (resid 22    and name HA   )(resid 23    and name HN   )  3.9  2.1  0.4
assign (resid 22    and name HB#  )(resid 23    and name HN   )  2.8  1.0  1.3
assign (resid 22    and name HD*  )(resid 23    and name HA   )  5.0  3.2  2.5
assign (resid 22    and name HD*  )(resid 23    and name HG2  )  5.0  3.2  2.5
assign (resid 22    and name HD*  )(resid 23    and name HG1  )  5.0  3.2  2.5
assign (resid 22    and name HA   )(resid 24    and name HN   )  5.0  3.2  0.5
assign (resid 22    and name HA   )(resid 25    and name HN   )  5.0  3.2  0.5
! <========== M23 ==========>
assign (resid 23    and name HN   )(resid 24    and name HN   )  2.8  1.0  0.3
assign (resid 23    and name HA   )(resid 24    and name HN   )  3.9  2.1  0.4
assign (resid 23    and name HB1  )(resid 24    and name HN   )  3.9  2.1  0.4
assign (resid 23    and name HB2  )(resid 24    and name HN   )  3.9  2.1  0.4
assign (resid 23    and name HA   )(resid 26    and name HN   )  5.0  3.2  0.5
! <========== Y24 ==========>
assign (resid 24    and name HN   )(resid 25    and name HN   )  2.8  1.0  0.3
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   )  3.9  2.1  0.4
assign (resid 24    and name HB2  )(resid 25    and name HN   )  3.9  2.1  0.4
! <========== G25 ==========>
assign (resid 25    and name HN   )(resid 26    and name HN   )  2.8  1.0  0.3
assign (resid 25    and name HA#  )(resid 26    and name HN   )  2.8  1.0  1.3
! <========== L26 ==========>
assign (resid 26    and name HN   )(resid 27    and name HN   )  2.8  1.0  0.3
assign (resid 26    and name HA   )(resid 27    and name HN   )  2.8  1.0  0.3
assign (resid 26    and name HB1  )(resid 27    and name HN   )  3.9  2.1  0.4
assign (resid 26    and name HB2  )(resid 27    and name HN   )  3.9  2.1  0.4
assign (resid 26    and name HA   )(resid 29    and name HB#  )  3.9  2.1  1.4
! <========== S27 ==========>
assign (resid 27    and name HN   )(resid 28    and name HD1  )  3.9  2.1  0.4
assign (resid 27    and name HN   )(resid 28    and name HD2  )  3.9  2.1  0.4
assign (resid 27    and name HA   )(resid 28    and name HD1  )  3.9  2.1  0.4
assign (resid 27    and name HA   )(resid 28    and name HD2  )  3.9  2.1  0.4
assign (resid 27    and name HA   )(resid 30    and name HN   )  5.0  3.2  0.5
assign (resid 27    and name HA   )(resid 30    and name HB   )  3.9  2.1  0.4
assign (resid 27    and name HA   )(resid 31    and name HN   )  5.0  3.2  0.5
! <========== P28 ==========>
assign (resid 28    and name HA   )(resid 29    and name HN   )  2.8  1.0  0.3
assign (resid 28    and name HB1  )(resid 29    and name HN   )  5.0  3.2  0.5
assign (resid 28    and name HB2  )(resid 29    and name HN   )  3.9  2.1  0.4
assign (resid 28    and name HG1  )(resid 29    and name HN   )  5.0  3.2  0.5
assign (resid 28    and name HG2  )(resid 29    and name HN   )  5.0  3.2  0.5
assign (resid 28    and name HD1  )(resid 29    and name HN   )  5.0  3.2  0.5
assign (resid 28    and name HD2  )(resid 29    and name HN   )  3.9  2.1  0.4
assign (resid 28    and name HA   )(resid 30    and name HN   )  5.0  3.2  0.5
assign (resid 28    and name HA   )(resid 31    and name HN   )  3.9  2.1  0.4
assign (resid 28    and name HA   )(resid 31    and name HG2# )  5.0  3.2  1.5
! <========== A29 ==========>
assign (resid 29    and name HN   )(resid 30    and name HN   )  2.8  1.0  0.3
assign (resid 29    and name HA   )(resid 30    and name HN   )  3.9  2.1  0.4
assign (resid 29    and name HB#  )(resid 30    and name HN   )  2.8  1.0  1.3
assign (resid 29    and name HA   )(resid 31    and name HN   )  5.0  3.2  0.5
assign (resid 29    and name HA   )(resid 32    and name HN   )  3.9  2.1  0.4
assign (resid 29    and name HB#  )(resid 33    and name HD*  )  5.0  3.2  3.5
! <========== I30 ==========>
assign (resid 30    and name HN   )(resid 31    and name HN   )  2.8  1.0  0.3
assign (resid 30    and name HA   )(resid 31    and name HN   )  2.8  1.0  0.3
assign (resid 30    and name HB   )(resid 31    and name HN   )  3.9  2.1  0.4
assign (resid 30    and name HA   )(resid 33    and name HB1  )  3.9  2.1  0.4
assign (resid 30    and name HA   )(resid 33    and name HB2  )  3.9  2.1  0.4
! <========== T31 ==========>
assign (resid 31    and name HN   )(resid 32    and name HN   )  2.8  1.0  0.3
assign (resid 31    and name HA   )(resid 32    and name HN   )  3.9  2.1  0.4
assign (resid 31    and name HB   )(resid 32    and name HN   )  3.9  2.1  0.4
assign (resid 31    and name HG2# )(resid 32    and name HN   )  5.0  3.2  1.5
assign (resid 31    and name HA   )(resid 34    and name HB   )  3.9  2.1  0.4
assign (resid 31    and name HA   )(resid 33    and name HD*  )  5.0  3.2  2.5
! <========== K32 ==========>
assign (resid 32    and name HN   )(resid 33    and name HN   )  2.8  1.0  0.3
assign (resid 32    and name HA   )(resid 33    and name HN   )  2.8  1.0  0.3
assign (resid 32    and name HB1  )(resid 33    and name HN   )  5.0  3.2  0.5
assign (resid 32    and name HB2  )(resid 33    and name HN   )  5.0  3.2  0.5
assign (resid 32    and name HA   )(resid 33    and name HD*  )  5.0  3.2  2.5
assign (resid 32    and name HA   )(resid 35    and name HB   )  5.0  3.2  0.5
! <========== Y33 ==========>
assign (resid 33    and name HN   )(resid 34    and name HN   )  2.8  1.0  0.3
assign (resid 33    and name HA   )(resid 34    and name HN   )  3.9  2.1  0.4
assign (resid 33    and name HB1  )(resid 34    and name HN   )  3.9  2.1  0.4
assign (resid 33    and name HB2  )(resid 34    and name HN   )  3.9  2.1  0.4
assign (resid 33    and name HD*  )(resid 34    and name HG1# )  5.0  3.2  3.5
assign (resid 33    and name HD*  )(resid 34    and name HG2# )  3.9  2.1  3.4
! <========== V34 ==========>
assign (resid 34    and name HB   )(resid 35    and name HN   )  3.9  2.1  0.4
! <========== V35 ==========>
assign (resid 35    and name HN   )(resid 36    and name HN   )  2.8  1.0  0.3
assign (resid 35    and name HA   )(resid 36    and name HN   )  2.8  1.0  0.3
assign (resid 35    and name HB   )(resid 36    and name HN   )  3.9  2.1  0.4
assign (resid 35    and name HG1# )(resid 36    and name HN   )  5.0  3.2  1.5
assign (resid 35    and name HG2# )(resid 36    and name HN   )  5.0  3.2  1.5
! <========== R36 ==========>

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   SER   1           HA       SER   1 -20.072 -14.663  -5.837
    2    HB2  SER   1           HB2      SER   1 -17.932 -13.425  -7.600
    3    HB3  SER   1           HB3      SER   1 -18.053 -15.125  -7.152
    4    HG   SER   1           HG       SER   1 -18.962 -14.699  -9.218
    5    H    ASP   2           H        ASP   2 -19.175 -14.953  -3.840
    6    HA   ASP   2           HA       ASP   2 -17.847 -14.657  -1.928
    7    HB2  ASP   2           HB2      ASP   2 -16.114 -13.235  -3.978
    8    HB3  ASP   2           HB3      ASP   2 -15.581 -13.700  -2.365
    9    H    LEU   3           H        LEU   3 -16.823 -12.835  -0.544
   10    HA   LEU   3           HA       LEU   3 -17.194 -10.836   0.654
   11    HB2  LEU   3           HB2      LEU   3 -16.627 -10.346  -2.093
   12    HB3  LEU   3           HB3      LEU   3 -17.834  -9.168  -1.593
   13    HG   LEU   3           HG       LEU   3 -15.539  -8.327  -1.204
   14   HD11  LEU   3          HD11      LEU   3 -17.337  -7.581   0.295
   15   HD12  LEU   3          HD12      LEU   3 -15.822  -7.733   1.185
   16   HD13  LEU   3          HD13      LEU   3 -17.064  -8.976   1.338
   17   HD21  LEU   3          HD21      LEU   3 -14.011  -9.417   0.258
   18   HD22  LEU   3          HD22      LEU   3 -14.648 -10.704  -0.768
   19   HD23  LEU   3          HD23      LEU   3 -15.255 -10.504   0.876
   20    HA   PRO   4           HA       PRO   4 -21.797 -11.176   0.051
   21    HB2  PRO   4           HB2      PRO   4 -22.361 -12.552   2.347
   22    HB3  PRO   4           HB3      PRO   4 -21.959 -13.347   0.813
   23    HG2  PRO   4           HG2      PRO   4 -20.307 -12.973   3.231
   24    HG3  PRO   4           HG3      PRO   4 -20.268 -14.259   2.019
   25    HD2  PRO   4           HD2      PRO   4 -18.488 -12.109   2.202
   26    HD3  PRO   4           HD3      PRO   4 -18.676 -13.192   0.809
   27    H    ALA   5           H        ALA   5 -20.748  -8.844   0.698
   28    HA   ALA   5           HA       ALA   5 -22.305  -7.923   3.040
   29    HB1  ALA   5           HB1      ALA   5 -20.222  -8.535   4.079
   30    HB2  ALA   5           HB2      ALA   5 -20.186  -6.780   3.905
   31    HB3  ALA   5           HB3      ALA   5 -19.287  -7.798   2.778
   32    H    LEU   6           H        LEU   6 -19.749  -6.856   0.752
   33    HA   LEU   6           HA       LEU   6 -19.628  -4.986  -0.673
   34    HB2  LEU   6           HB2      LEU   6 -22.224  -6.153  -0.791
   35    HB3  LEU   6           HB3      LEU   6 -22.440  -4.404  -0.853
   36    HG   LEU   6           HG       LEU   6 -20.304  -4.740  -2.537
   37   HD11  LEU   6          HD11      LEU   6 -22.156  -7.117  -2.889
   38   HD12  LEU   6          HD12      LEU   6 -20.460  -7.189  -2.410
   39   HD13  LEU   6          HD13      LEU   6 -20.898  -6.634  -4.026
   40   HD21  LEU   6          HD21      LEU   6 -22.000  -4.482  -4.360
   41   HD22  LEU   6          HD22      LEU   6 -22.279  -3.382  -3.010
   42   HD23  LEU   6          HD23      LEU   6 -23.268  -4.832  -3.185
   43    H    SER   7           H        SER   7 -19.858  -4.580   2.364
   44    HA   SER   7           HA       SER   7 -20.899  -1.762   2.323
   45    HB2  SER   7           HB2      SER   7 -20.788  -3.937   4.415
   46    HB3  SER   7           HB3      SER   7 -21.011  -2.250   4.871
   47    HG   SER   7           HG       SER   7 -23.004  -2.423   4.252
   48    H    THR   8           H        THR   8 -18.121  -2.849   1.629
   49    HA   THR   8           HA       THR   8 -16.594  -1.053   3.465
   50    HB   THR   8           HB       THR   8 -14.821  -2.915   3.456
   51    HG1  THR   8           HG1      THR   8 -15.446  -4.295   1.932
   52   HG21  THR   8          HG21      THR   8 -15.751  -3.952   5.362
   53   HG22  THR   8          HG22      THR   8 -17.397  -3.794   4.751
   54   HG23  THR   8          HG23      THR   8 -16.528  -2.369   5.318
   55    H    GLY   9           H        GLY   9 -17.221  -0.073   1.057
   56    HA2  GLY   9           HA2      GLY   9 -15.283  -0.892  -1.000
   57    HA3  GLY   9           HA3      GLY   9 -16.483   0.391  -1.158
   58    H    LEU  10           H        LEU  10 -16.023   2.295   0.475
   59    HA   LEU  10           HA       LEU  10 -13.591   3.568  -0.261
   60    HB2  LEU  10           HB2      LEU  10 -15.733   3.941   1.803
   61    HB3  LEU  10           HB3      LEU  10 -14.277   4.928   1.929
   62    HG   LEU  10           HG       LEU  10 -15.796   4.676  -0.671
   63   HD11  LEU  10          HD11      LEU  10 -16.945   6.774  -0.091
   64   HD12  LEU  10          HD12      LEU  10 -16.183   6.763   1.499
   65   HD13  LEU  10          HD13      LEU  10 -17.348   5.510   1.072
   66   HD21  LEU  10          HD21      LEU  10 -14.698   6.964  -0.964
   67   HD22  LEU  10          HD22      LEU  10 -13.593   5.591  -0.931
   68   HD23  LEU  10          HD23      LEU  10 -13.776   6.610   0.497
   69    H    LEU  11           H        LEU  11 -14.415   1.725   2.690
   70    HA   LEU  11           HA       LEU  11 -12.054   2.200   4.197
   71    HB2  LEU  11           HB2      LEU  11 -14.232   1.042   4.848
   72    HB3  LEU  11           HB3      LEU  11 -13.623  -0.392   4.020
   73    HG   LEU  11           HG       LEU  11 -11.700   0.815   5.901
   74   HD11  LEU  11          HD11      LEU  11 -14.150  -0.580   7.009
   75   HD12  LEU  11          HD12      LEU  11 -13.933   1.170   7.044
   76   HD13  LEU  11          HD13      LEU  11 -12.815   0.125   7.921
   77   HD21  LEU  11          HD21      LEU  11 -11.475  -1.580   6.547
   78   HD22  LEU  11          HD22      LEU  11 -11.330  -1.350   4.805
   79   HD23  LEU  11          HD23      LEU  11 -12.831  -1.974   5.491
   80    H    HIS  12           H        HIS  12 -12.763  -0.475   1.908
   81    HA   HIS  12           HA       HIS  12 -10.207  -1.749   2.028
   82    HB2  HIS  12           HB2      HIS  12 -12.493  -1.589   0.072
   83    HB3  HIS  12           HB3      HIS  12 -11.026  -2.459  -0.376
   84    HD1  HIS  12           HD1      HIS  12 -12.097  -4.803  -0.244
   85    HD2  HIS  12           HD2      HIS  12 -12.403  -2.651   3.315
   86    HE1  HIS  12           HE1      HIS  12 -12.880  -6.442   1.522
   87    H    LEU  13           H        LEU  13 -11.453   0.826  -0.116
   88    HA   LEU  13           HA       LEU  13  -9.227   1.077  -1.866
   89    HB2  LEU  13           HB2      LEU  13 -11.596   2.146  -1.849
   90    HB3  LEU  13           HB3      LEU  13 -10.876   3.384  -0.821
   91    HG   LEU  13           HG       LEU  13  -9.045   3.539  -2.658
   92   HD11  LEU  13          HD11      LEU  13 -11.253   2.008  -4.043
   93   HD12  LEU  13          HD12      LEU  13  -9.530   1.634  -3.994
   94   HD13  LEU  13          HD13      LEU  13 -10.108   3.006  -4.940
   95   HD21  LEU  13          HD21      LEU  13 -11.904   4.481  -3.010
   96   HD22  LEU  13          HD22      LEU  13 -10.582   5.038  -4.037
   97   HD23  LEU  13          HD23      LEU  13 -10.555   5.373  -2.304
   98    H    HIS  14           H        HIS  14  -9.859   2.629   1.294
   99    HA   HIS  14           HA       HIS  14  -7.560   4.319   1.391
  100    HB2  HIS  14           HB2      HIS  14  -9.431   4.569   2.905
  101    HB3  HIS  14           HB3      HIS  14  -9.236   2.922   3.502
  102    HD1  HIS  14           HD1      HIS  14  -7.511   6.299   3.569
  103    HD2  HIS  14           HD2      HIS  14  -7.348   2.636   5.552
  104    HE1  HIS  14           HE1      HIS  14  -5.951   6.618   5.539
  105    H    GLN  15           H        GLN  15  -8.045   1.008   2.698
  106    HA   GLN  15           HA       GLN  15  -5.416   0.627   3.741
  107    HB2  GLN  15           HB2      GLN  15  -7.688  -1.093   2.795
  108    HB3  GLN  15           HB3      GLN  15  -6.145  -1.866   3.164
  109    HG2  GLN  15           HG2      GLN  15  -7.326   0.085   5.122
  110    HG3  GLN  15           HG3      GLN  15  -7.930  -1.571   5.070
  111   HE21  GLN  15          HE21      GLN  15  -5.307   0.430   6.164
  112   HE22  GLN  15          HE22      GLN  15  -4.328  -0.821   6.760
  113    H    ASN  16           H        ASN  16  -6.741   0.073   0.479
  114    HA   ASN  16           HA       ASN  16  -4.487  -1.264  -0.667
  115    HB2  ASN  16           HB2      ASN  16  -6.921  -0.849  -1.500
  116    HB3  ASN  16           HB3      ASN  16  -6.288   0.675  -2.125
  117   HD21  ASN  16          HD21      ASN  16  -4.457   0.511  -3.725
  118   HD22  ASN  16          HD22      ASN  16  -4.309  -0.892  -4.667
  119    H    ILE  17           H        ILE  17  -5.261   2.213  -0.364
  120    HA   ILE  17           HA       ILE  17  -2.870   3.066  -1.830
  121    HB   ILE  17           HB       ILE  17  -4.958   4.459  -0.120
  122   HG12  ILE  17          HG12      ILE  17  -4.548   4.737  -3.096
  123   HG13  ILE  17          HG13      ILE  17  -5.462   3.374  -2.449
  124   HG21  ILE  17          HG21      ILE  17  -3.067   5.889   0.007
  125   HG22  ILE  17          HG22      ILE  17  -4.023   6.538  -1.326
  126   HG23  ILE  17          HG23      ILE  17  -2.598   5.553  -1.661
  127   HD11  ILE  17          HD11      ILE  17  -7.116   5.009  -2.839
  128   HD12  ILE  17          HD12      ILE  17  -6.089   6.316  -2.250
  129   HD13  ILE  17          HD13      ILE  17  -6.784   5.162  -1.114
  130    H    VAL  18           H        VAL  18  -3.887   3.008   1.602
  131    HA   VAL  18           HA       VAL  18  -1.486   4.174   2.670
  132    HB   VAL  18           HB       VAL  18  -3.695   2.422   3.773
  133   HG11  VAL  18          HG11      VAL  18  -1.456   3.808   5.283
  134   HG12  VAL  18          HG12      VAL  18  -1.708   2.066   5.166
  135   HG13  VAL  18          HG13      VAL  18  -2.874   3.070   6.029
  136   HG21  VAL  18          HG21      VAL  18  -3.099   5.354   3.595
  137   HG22  VAL  18          HG22      VAL  18  -4.010   4.765   4.986
  138   HG23  VAL  18          HG23      VAL  18  -4.626   4.508   3.354
  139    H    ASP  19           H        ASP  19  -2.131   0.983   1.463
  140    HA   ASP  19           HA       ASP  19   0.182  -0.175   2.938
  141    HB2  ASP  19           HB2      ASP  19  -2.035  -1.333   2.787
  142    HB3  ASP  19           HB3      ASP  19  -1.823  -1.438   1.040
  143    H    VAL  20           H        VAL  20  -0.381   1.412  -0.023
  144    HA   VAL  20           HA       VAL  20   1.929  -0.006  -1.308
  145    HB   VAL  20           HB       VAL  20  -0.451   1.479  -2.465
  146   HG11  VAL  20          HG11      VAL  20   2.010   0.304  -3.781
  147   HG12  VAL  20          HG12      VAL  20   1.401   1.954  -3.910
  148   HG13  VAL  20          HG13      VAL  20   0.520   0.627  -4.667
  149   HG21  VAL  20          HG21      VAL  20   0.404  -1.417  -2.772
  150   HG22  VAL  20          HG22      VAL  20  -1.106  -0.689  -3.321
  151   HG23  VAL  20          HG23      VAL  20  -0.792  -0.872  -1.596
  152    H    GLN  21           H        GLN  21   0.361   3.202  -1.084
  153    HA   GLN  21           HA       GLN  21   2.559   4.712  -2.132
  154    HB2  GLN  21           HB2      GLN  21  -0.052   5.131  -1.045
  155    HB3  GLN  21           HB3      GLN  21   1.053   6.225  -0.215
  156    HG2  GLN  21           HG2      GLN  21   0.899   5.932  -3.229
  157    HG3  GLN  21           HG3      GLN  21   0.083   7.199  -2.314
  158   HE21  GLN  21          HE21      GLN  21   1.467   8.810  -1.193
  159   HE22  GLN  21          HE22      GLN  21   3.078   9.036  -1.676
  160    H    TYR  22           H        TYR  22   1.929   3.435   1.100
  161    HA   TYR  22           HA       TYR  22   3.717   5.118   2.580
  162    HB2  TYR  22           HB2      TYR  22   3.053   3.757   4.301
  163    HB3  TYR  22           HB3      TYR  22   1.898   3.156   3.120
  164    HD1  TYR  22           HD1      TYR  22   5.060   2.469   4.890
  165    HD2  TYR  22           HD2      TYR  22   2.192   0.980   2.064
  166    HE1  TYR  22           HE1      TYR  22   6.044   0.201   5.086
  167    HE2  TYR  22           HE2      TYR  22   3.172  -1.290   2.262
  168    HH   TYR  22           HH       TYR  22   6.129  -1.916   3.506
  169    H    MET  23           H        MET  23   4.275   2.257   0.574
  170    HA   MET  23           HA       MET  23   7.148   2.182   1.355
  171    HB2  MET  23           HB2      MET  23   5.200   0.277   0.776
  172    HB3  MET  23           HB3      MET  23   6.187   0.308  -0.684
  173    HG2  MET  23           HG2      MET  23   7.696   0.331   1.866
  174    HG3  MET  23           HG3      MET  23   6.815  -1.155   1.521
  175    HE1  MET  23           HE1      MET  23  10.435   0.070   1.096
  176    HE2  MET  23           HE2      MET  23   9.266   1.350   0.780
  177    HE3  MET  23           HE3      MET  23  10.319   0.789  -0.516
  178    H    TYR  24           H        TYR  24   5.043   3.049  -1.356
  179    HA   TYR  24           HA       TYR  24   7.445   3.552  -3.074
  180    HB2  TYR  24           HB2      TYR  24   4.514   3.019  -3.548
  181    HB3  TYR  24           HB3      TYR  24   5.516   3.718  -4.818
  182    HD1  TYR  24           HD1      TYR  24   4.964   0.750  -2.688
  183    HD2  TYR  24           HD2      TYR  24   7.261   2.428  -5.906
  184    HE1  TYR  24           HE1      TYR  24   5.841  -1.503  -3.237
  185    HE2  TYR  24           HE2      TYR  24   8.138   0.174  -6.455
  186    HH   TYR  24           HH       TYR  24   8.270  -2.247  -4.598
  187    H    GLY  25           H        GLY  25   6.385   5.374  -0.859
  188    HA2  GLY  25           HA2      GLY  25   5.305   7.675  -2.357
  189    HA3  GLY  25           HA3      GLY  25   5.579   7.609  -0.615
  190    H    LEU  26           H        LEU  26   8.068   7.259  -0.112
  191    HA   LEU  26           HA       LEU  26  10.179   8.314  -0.061
  192    HB2  LEU  26           HB2      LEU  26   9.570   7.849  -2.982
  193    HB3  LEU  26           HB3      LEU  26  11.116   8.519  -2.465
  194    HG   LEU  26           HG       LEU  26  10.703   6.344  -0.755
  195   HD11  LEU  26          HD11      LEU  26   8.881   5.755  -2.505
  196   HD12  LEU  26          HD12      LEU  26  10.038   4.498  -2.067
  197   HD13  LEU  26          HD13      LEU  26  10.231   5.389  -3.578
  198   HD21  LEU  26          HD21      LEU  26  12.538   5.320  -2.163
  199   HD22  LEU  26          HD22      LEU  26  12.863   6.972  -1.644
  200   HD23  LEU  26          HD23      LEU  26  12.330   6.656  -3.295
  201    H    SER  27           H        SER  27   7.796  10.114  -0.038
  202    HA   SER  27           HA       SER  27   8.118  12.385  -1.725
  203    HB2  SER  27           HB2      SER  27   7.198  13.207   0.851
  204    HB3  SER  27           HB3      SER  27   6.236  12.879  -0.584
  205    HG   SER  27           HG       SER  27   5.602  11.103   0.331
  206    HA   PRO  28           HA       PRO  28  10.874  14.375   1.636
  207    HB2  PRO  28           HB2      PRO  28  11.744  12.829   3.720
  208    HB3  PRO  28           HB3      PRO  28  10.238  13.767   3.773
  209    HG2  PRO  28           HG2      PRO  28  10.642  10.862   3.269
  210    HG3  PRO  28           HG3      PRO  28   9.372  11.683   4.189
  211    HD2  PRO  28           HD2      PRO  28   9.018  10.729   1.663
  212    HD3  PRO  28           HD3      PRO  28   8.113  12.106   2.327
  213    H    ALA  29           H        ALA  29  11.443  11.003   0.814
  214    HA   ALA  29           HA       ALA  29  14.299  10.944   0.981
  215    HB1  ALA  29           HB1      ALA  29  12.257   9.474  -0.710
  216    HB2  ALA  29           HB2      ALA  29  12.993   8.927   0.797
  217    HB3  ALA  29           HB3      ALA  29  13.965   9.037  -0.671
  218    H    ILE  30           H        ILE  30  12.193  11.498  -1.886
  219    HA   ILE  30           HA       ILE  30  14.286  12.064  -3.740
  220    HB   ILE  30           HB       ILE  30  11.398  12.975  -3.557
  221   HG12  ILE  30          HG12      ILE  30  11.717  10.529  -3.668
  222   HG13  ILE  30          HG13      ILE  30  11.017  11.132  -5.168
  223   HG21  ILE  30          HG21      ILE  30  13.471  13.299  -5.715
  224   HG22  ILE  30          HG22      ILE  30  12.294  14.470  -5.122
  225   HG23  ILE  30          HG23      ILE  30  11.768  13.132  -6.143
  226   HD11  ILE  30          HD11      ILE  30  13.396  11.233  -6.088
  227   HD12  ILE  30          HD12      ILE  30  12.753   9.614  -5.811
  228   HD13  ILE  30          HD13      ILE  30  13.889  10.321  -4.661
  229    H    THR  31           H        THR  31  12.563  14.175  -1.477
  230    HA   THR  31           HA       THR  31  13.485  16.704  -2.424
  231    HB   THR  31           HB       THR  31  12.861  15.779   0.403
  232    HG1  THR  31           HG1      THR  31  11.243  16.689  -1.736
  233   HG21  THR  31          HG21      THR  31  12.966  18.499  -0.912
  234   HG22  THR  31          HG22      THR  31  13.843  17.951   0.517
  235   HG23  THR  31          HG23      THR  31  12.100  18.208   0.596
  236    H    LYS  32           H        LYS  32  15.086  14.232  -0.477
  237    HA   LYS  32           HA       LYS  32  17.396  16.073  -0.004
  238    HB2  LYS  32           HB2      LYS  32  16.073  13.859   1.402
  239    HB3  LYS  32           HB3      LYS  32  17.829  13.695   1.365
  240    HG2  LYS  32           HG2      LYS  32  17.203  14.974   3.340
  241    HG3  LYS  32           HG3      LYS  32  18.022  16.044   2.204
  242    HD2  LYS  32           HD2      LYS  32  16.230  17.407   2.355
  243    HD3  LYS  32           HD3      LYS  32  15.326  16.186   1.463
  244    HE2  LYS  32           HE2      LYS  32  15.661  15.921   4.451
  245    HE3  LYS  32           HE3      LYS  32  14.389  16.958   3.777
  246    HZ1  LYS  32           HZ1      LYS  32  13.417  14.845   3.908
  247    HZ2  LYS  32           HZ2      LYS  32  14.812  14.058   3.345
  248    HZ3  LYS  32           HZ3      LYS  32  13.868  14.984   2.278
  249    H    TYR  33           H        TYR  33  16.474  14.048  -2.391
  250    HA   TYR  33           HA       TYR  33  19.092  12.648  -2.698
  251    HB2  TYR  33           HB2      TYR  33  16.293  12.189  -3.398
  252    HB3  TYR  33           HB3      TYR  33  17.353  11.967  -4.789
  253    HD1  TYR  33           HD1      TYR  33  19.773  10.841  -3.854
  254    HD2  TYR  33           HD2      TYR  33  15.801  10.165  -2.365
  255    HE1  TYR  33           HE1      TYR  33  20.481   8.636  -2.966
  256    HE2  TYR  33           HE2      TYR  33  16.509   7.960  -1.478
  257    HH   TYR  33           HH       TYR  33  19.272   7.061  -0.782
  258    H    VAL  34           H        VAL  34  16.916  14.934  -4.359
  259    HA   VAL  34           HA       VAL  34  18.594  15.265  -6.702
  260    HB   VAL  34           HB       VAL  34  16.412  16.976  -5.455
  261   HG11  VAL  34          HG11      VAL  34  17.772  17.054  -8.155
  262   HG12  VAL  34          HG12      VAL  34  17.590  18.369  -6.994
  263   HG13  VAL  34          HG13      VAL  34  16.185  17.772  -7.877
  264   HG21  VAL  34          HG21      VAL  34  14.958  15.865  -7.110
  265   HG22  VAL  34          HG22      VAL  34  15.707  14.673  -6.049
  266   HG23  VAL  34          HG23      VAL  34  16.327  14.912  -7.684
  267    H    VAL  35           H        VAL  35  18.596  16.673  -3.482
  268    HA   VAL  35           HA       VAL  35  20.557  18.754  -4.364
  269    HB   VAL  35           HB       VAL  35  18.336  19.218  -3.107
  270   HG11  VAL  35          HG11      VAL  35  18.835  17.338  -1.434
  271   HG12  VAL  35          HG12      VAL  35  18.290  18.871  -0.752
  272   HG13  VAL  35          HG13      VAL  35  20.000  18.442  -0.705
  273   HG21  VAL  35          HG21      VAL  35  20.896  20.259  -1.857
  274   HG22  VAL  35          HG22      VAL  35  19.334  21.076  -1.914
  275   HG23  VAL  35          HG23      VAL  35  20.253  20.825  -3.398
  276    H    ARG  36           H        ARG  36  20.758  15.662  -3.327
  277    HA   ARG  36           HA       ARG  36  23.429  16.021  -2.186
  278    HB2  ARG  36           HB2      ARG  36  21.733  16.512  -0.337
  279    HB3  ARG  36           HB3      ARG  36  21.265  14.815  -0.441
  280    HG2  ARG  36           HG2      ARG  36  23.001  14.250   0.869
  281    HG3  ARG  36           HG3      ARG  36  24.117  14.923  -0.320
  282    HD2  ARG  36           HD2      ARG  36  22.679  16.814   1.523
  283    HD3  ARG  36           HD3      ARG  36  24.076  15.910   2.136
  284    HE   ARG  36           HE       ARG  36  25.131  16.796  -0.160
  285   HH11  ARG  36          HH11      ARG  36  23.045  18.802  -0.674
  286   HH12  ARG  36          HH12      ARG  36  23.630  20.206   0.157
  287   HH21  ARG  36          HH21      ARG  36  25.900  18.432   2.103
  288   HH22  ARG  36          HH22      ARG  36  25.252  19.995   1.734
  Start of MODEL    2
    1    HA   SER   1           HA       SER   1 -20.025   0.629  14.037
    2    HB2  SER   1           HB2      SER   1 -18.164   1.703  12.598
    3    HB3  SER   1           HB3      SER   1 -19.398   2.782  13.243
    4    HG   SER   1           HG       SER   1 -17.111   3.414  13.526
    5    H    ASP   2           H        ASP   2 -19.316  -1.430  13.676
    6    HA   ASP   2           HA       ASP   2 -16.577  -2.181  14.642
    7    HB2  ASP   2           HB2      ASP   2 -17.575  -4.417  14.998
    8    HB3  ASP   2           HB3      ASP   2 -18.474  -3.175  15.867
    9    H    LEU   3           H        LEU   3 -18.261  -1.600  11.818
   10    HA   LEU   3           HA       LEU   3 -17.959  -2.223   9.565
   11    HB2  LEU   3           HB2      LEU   3 -15.375  -2.261  11.002
   12    HB3  LEU   3           HB3      LEU   3 -15.373  -3.073   9.439
   13    HG   LEU   3           HG       LEU   3 -16.788  -0.500   9.407
   14   HD11  LEU   3          HD11      LEU   3 -14.811   0.902   9.577
   15   HD12  LEU   3          HD12      LEU   3 -13.786  -0.511   9.838
   16   HD13  LEU   3          HD13      LEU   3 -14.961  -0.036  11.064
   17   HD21  LEU   3          HD21      LEU   3 -16.260  -1.703   7.364
   18   HD22  LEU   3          HD22      LEU   3 -14.551  -1.766   7.795
   19   HD23  LEU   3          HD23      LEU   3 -15.304  -0.223   7.394
   20    HA   PRO   4           HA       PRO   4 -18.296  -6.762  10.405
   21    HB2  PRO   4           HB2      PRO   4 -21.009  -6.997  10.164
   22    HB3  PRO   4           HB3      PRO   4 -20.205  -6.599  11.693
   23    HG2  PRO   4           HG2      PRO   4 -21.786  -4.887   9.915
   24    HG3  PRO   4           HG3      PRO   4 -21.412  -4.694  11.630
   25    HD2  PRO   4           HD2      PRO   4 -20.192  -3.372   9.415
   26    HD3  PRO   4           HD3      PRO   4 -19.775  -3.221  11.134
   27    H    ALA   5           H        ALA   5 -17.427  -5.700   8.004
   28    HA   ALA   5           HA       ALA   5 -17.369  -6.128   5.688
   29    HB1  ALA   5           HB1      ALA   5 -19.396  -8.295   6.217
   30    HB2  ALA   5           HB2      ALA   5 -17.751  -8.439   6.837
   31    HB3  ALA   5           HB3      ALA   5 -18.031  -8.310   5.101
   32    H    LEU   6           H        LEU   6 -19.711  -4.491   6.997
   33    HA   LEU   6           HA       LEU   6 -21.538  -4.576   4.614
   34    HB2  LEU   6           HB2      LEU   6 -21.956  -4.178   7.570
   35    HB3  LEU   6           HB3      LEU   6 -23.118  -3.507   6.425
   36    HG   LEU   6           HG       LEU   6 -22.333  -6.312   5.904
   37   HD11  LEU   6          HD11      LEU   6 -22.429  -6.295   8.380
   38   HD12  LEU   6          HD12      LEU   6 -23.768  -7.210   7.687
   39   HD13  LEU   6          HD13      LEU   6 -24.040  -5.581   8.303
   40   HD21  LEU   6          HD21      LEU   6 -24.091  -5.072   4.651
   41   HD22  LEU   6          HD22      LEU   6 -25.010  -4.898   6.146
   42   HD23  LEU   6          HD23      LEU   6 -24.741  -6.499   5.458
   43    H    SER   7           H        SER   7 -19.008  -2.854   5.682
   44    HA   SER   7           HA       SER   7 -19.916  -0.355   4.421
   45    HB2  SER   7           HB2      SER   7 -19.516   0.979   6.465
   46    HB3  SER   7           HB3      SER   7 -20.759  -0.233   6.758
   47    HG   SER   7           HG       SER   7 -18.061  -0.179   7.587
   48    H    THR   8           H        THR   8 -17.927  -1.994   3.482
   49    HA   THR   8           HA       THR   8 -15.405  -0.580   4.285
   50    HB   THR   8           HB       THR   8 -15.752  -3.021   4.990
   51    HG1  THR   8           HG1      THR   8 -13.687  -2.808   5.057
   52   HG21  THR   8          HG21      THR   8 -15.617  -4.740   3.370
   53   HG22  THR   8          HG22      THR   8 -15.100  -3.625   2.105
   54   HG23  THR   8          HG23      THR   8 -16.764  -3.590   2.686
   55    H    GLY   9           H        GLY   9 -17.461  -0.187   1.983
   56    HA2  GLY   9           HA2      GLY   9 -16.237  -0.969  -0.481
   57    HA3  GLY   9           HA3      GLY   9 -17.363   0.377  -0.294
   58    H    LEU  10           H        LEU  10 -16.131   2.182   1.229
   59    HA   LEU  10           HA       LEU  10 -13.921   3.139  -0.457
   60    HB2  LEU  10           HB2      LEU  10 -15.906   4.415   0.692
   61    HB3  LEU  10           HB3      LEU  10 -14.875   4.377   2.122
   62    HG   LEU  10           HG       LEU  10 -13.025   5.292   0.531
   63   HD11  LEU  10          HD11      LEU  10 -15.561   5.936  -1.005
   64   HD12  LEU  10          HD12      LEU  10 -14.196   4.976  -1.575
   65   HD13  LEU  10          HD13      LEU  10 -14.002   6.706  -1.299
   66   HD21  LEU  10          HD21      LEU  10 -13.978   6.613   2.349
   67   HD22  LEU  10          HD22      LEU  10 -15.416   6.957   1.385
   68   HD23  LEU  10          HD23      LEU  10 -13.855   7.625   0.911
   69    H    LEU  11           H        LEU  11 -14.340   1.744   2.776
   70    HA   LEU  11           HA       LEU  11 -11.846   2.357   3.962
   71    HB2  LEU  11           HB2      LEU  11 -13.974   1.151   4.842
   72    HB3  LEU  11           HB3      LEU  11 -13.234  -0.316   4.201
   73    HG   LEU  11           HG       LEU  11 -11.176   0.976   5.611
   74   HD11  LEU  11          HD11      LEU  11 -13.532   2.041   6.582
   75   HD12  LEU  11          HD12      LEU  11 -12.019   1.940   7.482
   76   HD13  LEU  11          HD13      LEU  11 -13.245   0.689   7.677
   77   HD21  LEU  11          HD21      LEU  11 -11.563  -1.454   5.440
   78   HD22  LEU  11          HD22      LEU  11 -13.000  -1.301   6.451
   79   HD23  LEU  11          HD23      LEU  11 -11.407  -0.967   7.127
   80    H    HIS  12           H        HIS  12 -12.712  -0.457   1.904
   81    HA   HIS  12           HA       HIS  12 -10.188  -1.765   1.893
   82    HB2  HIS  12           HB2      HIS  12 -12.672  -1.685   0.300
   83    HB3  HIS  12           HB3      HIS  12 -11.258  -2.192  -0.620
   84    HD1  HIS  12           HD1      HIS  12 -12.883  -3.011   2.743
   85    HD2  HIS  12           HD2      HIS  12 -10.674  -4.865  -0.271
   86    HE1  HIS  12           HE1      HIS  12 -12.710  -5.457   3.379
   87    H    LEU  13           H        LEU  13 -11.453   0.807  -0.243
   88    HA   LEU  13           HA       LEU  13  -9.234   0.992  -2.032
   89    HB2  LEU  13           HB2      LEU  13 -11.639   2.033  -2.011
   90    HB3  LEU  13           HB3      LEU  13 -10.881   3.346  -1.111
   91    HG   LEU  13           HG       LEU  13  -9.354   2.531  -3.486
   92   HD11  LEU  13          HD11      LEU  13 -10.863   3.343  -5.150
   93   HD12  LEU  13          HD12      LEU  13 -11.994   3.938  -3.936
   94   HD13  LEU  13          HD13      LEU  13 -11.794   2.202  -4.180
   95   HD21  LEU  13          HD21      LEU  13  -9.082   4.890  -3.717
   96   HD22  LEU  13          HD22      LEU  13  -9.089   4.594  -1.978
   97   HD23  LEU  13          HD23      LEU  13 -10.532   5.225  -2.771
   98    H    HIS  14           H        HIS  14  -9.882   2.632   1.082
   99    HA   HIS  14           HA       HIS  14  -7.615   4.374   1.105
  100    HB2  HIS  14           HB2      HIS  14  -9.421   4.675   2.657
  101    HB3  HIS  14           HB3      HIS  14  -9.288   3.018   3.240
  102    HD1  HIS  14           HD1      HIS  14  -7.286   6.259   3.228
  103    HD2  HIS  14           HD2      HIS  14  -7.563   2.711   5.400
  104    HE1  HIS  14           HE1      HIS  14  -5.752   6.519   5.230
  105    H    GLN  15           H        GLN  15  -8.016   1.102   2.531
  106    HA   GLN  15           HA       GLN  15  -5.368   0.780   3.528
  107    HB2  GLN  15           HB2      GLN  15  -7.576  -1.040   2.581
  108    HB3  GLN  15           HB3      GLN  15  -6.031  -1.725   3.083
  109    HG2  GLN  15           HG2      GLN  15  -7.532   0.239   4.822
  110    HG3  GLN  15           HG3      GLN  15  -7.854  -1.493   4.895
  111   HE21  GLN  15          HE21      GLN  15  -6.448   0.467   6.862
  112   HE22  GLN  15          HE22      GLN  15  -4.987  -0.318   7.225
  113    H    ASN  16           H        ASN  16  -6.727   0.223   0.291
  114    HA   ASN  16           HA       ASN  16  -4.556  -1.147  -0.933
  115    HB2  ASN  16           HB2      ASN  16  -6.894  -0.709  -1.802
  116    HB3  ASN  16           HB3      ASN  16  -6.393   0.946  -2.144
  117   HD21  ASN  16          HD21      ASN  16  -4.896   1.300  -3.921
  118   HD22  ASN  16          HD22      ASN  16  -4.523   0.071  -5.030
  119    H    ILE  17           H        ILE  17  -5.091   2.324  -0.351
  120    HA   ILE  17           HA       ILE  17  -2.608   3.085  -1.771
  121    HB   ILE  17           HB       ILE  17  -4.680   4.624  -0.156
  122   HG12  ILE  17          HG12      ILE  17  -4.415   5.021  -3.076
  123   HG13  ILE  17          HG13      ILE  17  -4.993   3.423  -2.602
  124   HG21  ILE  17          HG21      ILE  17  -2.869   6.077  -0.108
  125   HG22  ILE  17          HG22      ILE  17  -3.587   6.523  -1.656
  126   HG23  ILE  17          HG23      ILE  17  -2.189   5.448  -1.609
  127   HD11  ILE  17          HD11      ILE  17  -6.987   4.630  -2.712
  128   HD12  ILE  17          HD12      ILE  17  -6.242   6.108  -2.106
  129   HD13  ILE  17          HD13      ILE  17  -6.579   4.774  -1.003
  130    H    VAL  18           H        VAL  18  -3.787   2.669   1.544
  131    HA   VAL  18           HA       VAL  18  -1.579   3.945   2.886
  132    HB   VAL  18           HB       VAL  18  -3.639   1.858   3.653
  133   HG11  VAL  18          HG11      VAL  18  -1.740   1.562   5.147
  134   HG12  VAL  18          HG12      VAL  18  -3.019   2.409   6.017
  135   HG13  VAL  18          HG13      VAL  18  -1.627   3.303   5.404
  136   HG21  VAL  18          HG21      VAL  18  -3.650   4.708   3.344
  137   HG22  VAL  18          HG22      VAL  18  -3.865   4.333   5.053
  138   HG23  VAL  18          HG23      VAL  18  -4.970   3.659   3.856
  139    H    ASP  19           H        ASP  19  -2.178   0.615   1.815
  140    HA   ASP  19           HA       ASP  19   0.300  -0.398   3.021
  141    HB2  ASP  19           HB2      ASP  19  -2.088  -1.488   2.405
  142    HB3  ASP  19           HB3      ASP  19  -1.202  -1.917   0.942
  143    H    VAL  20           H        VAL  20  -0.118   1.553   0.371
  144    HA   VAL  20           HA       VAL  20   2.035   0.169  -1.186
  145    HB   VAL  20           HB       VAL  20  -0.393   0.761  -2.072
  146   HG11  VAL  20          HG11      VAL  20   0.166   3.242  -1.355
  147   HG12  VAL  20          HG12      VAL  20  -0.747   2.926  -2.828
  148   HG13  VAL  20          HG13      VAL  20   0.977   3.288  -2.919
  149   HG21  VAL  20          HG21      VAL  20   1.310  -0.245  -3.474
  150   HG22  VAL  20          HG22      VAL  20   2.189   1.280  -3.576
  151   HG23  VAL  20          HG23      VAL  20   0.615   1.117  -4.353
  152    H    GLN  21           H        GLN  21   1.329   2.919   0.748
  153    HA   GLN  21           HA       GLN  21   3.584   4.504  -0.395
  154    HB2  GLN  21           HB2      GLN  21   1.323   5.090   1.542
  155    HB3  GLN  21           HB3      GLN  21   2.579   6.261   1.138
  156    HG2  GLN  21           HG2      GLN  21   1.937   5.797  -1.330
  157    HG3  GLN  21           HG3      GLN  21   0.471   5.076  -0.667
  158   HE21  GLN  21          HE21      GLN  21   2.380   8.133  -0.530
  159   HE22  GLN  21          HE22      GLN  21   1.033   9.132  -0.269
  160    H    TYR  22           H        TYR  22   2.528   2.843   2.569
  161    HA   TYR  22           HA       TYR  22   4.532   3.841   4.340
  162    HB2  TYR  22           HB2      TYR  22   3.669   2.237   5.795
  163    HB3  TYR  22           HB3      TYR  22   2.346   2.384   4.645
  164    HD1  TYR  22           HD1      TYR  22   5.177   0.279   5.749
  165    HD2  TYR  22           HD2      TYR  22   1.837   0.612   3.077
  166    HE1  TYR  22           HE1      TYR  22   5.352  -2.138   5.228
  167    HE2  TYR  22           HE2      TYR  22   2.010  -1.804   2.557
  168    HH   TYR  22           HH       TYR  22   2.895  -3.832   3.515
  169    H    MET  23           H        MET  23   4.725   1.425   1.795
  170    HA   MET  23           HA       MET  23   7.296   0.345   2.776
  171    HB2  MET  23           HB2      MET  23   5.295  -0.831   1.540
  172    HB3  MET  23           HB3      MET  23   6.042  -0.170   0.085
  173    HG2  MET  23           HG2      MET  23   7.803  -1.596   2.038
  174    HG3  MET  23           HG3      MET  23   6.739  -2.566   1.021
  175    HE1  MET  23           HE1      MET  23   6.496  -2.621  -1.120
  176    HE2  MET  23           HE2      MET  23   8.012  -3.413  -1.544
  177    HE3  MET  23           HE3      MET  23   7.498  -1.981  -2.431
  178    H    TYR  24           H        TYR  24   6.108   2.479   0.178
  179    HA   TYR  24           HA       TYR  24   8.804   2.773  -0.973
  180    HB2  TYR  24           HB2      TYR  24   6.020   3.747  -1.574
  181    HB3  TYR  24           HB3      TYR  24   7.406   4.439  -2.417
  182    HD1  TYR  24           HD1      TYR  24   5.454   1.355  -1.828
  183    HD2  TYR  24           HD2      TYR  24   8.699   3.138  -4.006
  184    HE1  TYR  24           HE1      TYR  24   5.513  -0.604  -3.344
  185    HE2  TYR  24           HE2      TYR  24   8.757   1.177  -5.523
  186    HH   TYR  24           HH       TYR  24   6.433  -0.857  -5.985
  187    H    GLY  25           H        GLY  25   6.631   4.659   1.098
  188    HA2  GLY  25           HA2      GLY  25   8.785   6.734   1.269
  189    HA3  GLY  25           HA3      GLY  25   7.078   7.162   1.278
  190    H    LEU  26           H        LEU  26   8.184   4.320   3.048
  191    HA   LEU  26           HA       LEU  26   8.432   5.780   5.594
  192    HB2  LEU  26           HB2      LEU  26   5.899   5.021   4.631
  193    HB3  LEU  26           HB3      LEU  26   6.292   3.828   5.869
  194    HG   LEU  26           HG       LEU  26   6.832   6.704   6.483
  195   HD11  LEU  26          HD11      LEU  26   4.504   7.012   7.239
  196   HD12  LEU  26          HD12      LEU  26   4.079   5.431   6.585
  197   HD13  LEU  26          HD13      LEU  26   4.567   6.733   5.499
  198   HD21  LEU  26          HD21      LEU  26   5.794   4.329   8.064
  199   HD22  LEU  26          HD22      LEU  26   6.139   5.920   8.741
  200   HD23  LEU  26          HD23      LEU  26   7.448   4.941   8.078
  201    H    SER  27           H        SER  27  10.043   3.842   4.032
  202    HA   SER  27           HA       SER  27   9.895   1.253   5.373
  203    HB2  SER  27           HB2      SER  27  11.526   2.622   3.300
  204    HB3  SER  27           HB3      SER  27  12.311   1.296   4.151
  205    HG   SER  27           HG       SER  27  10.115   1.297   2.436
  206    HA   PRO  28           HA       PRO  28  13.773   2.814   7.673
  207    HB2  PRO  28           HB2      PRO  28  14.529   5.429   7.424
  208    HB3  PRO  28           HB3      PRO  28  15.090   4.153   6.325
  209    HG2  PRO  28           HG2      PRO  28  13.021   6.231   5.908
  210    HG3  PRO  28           HG3      PRO  28  14.143   5.501   4.753
  211    HD2  PRO  28           HD2      PRO  28  11.467   4.854   5.000
  212    HD3  PRO  28           HD3      PRO  28  12.701   3.834   4.231
  213    H    ALA  29           H        ALA  29  11.387   2.726   8.776
  214    HA   ALA  29           HA       ALA  29  11.432   4.670  10.954
  215    HB1  ALA  29           HB1      ALA  29  10.375   5.893   9.016
  216    HB2  ALA  29           HB2      ALA  29   9.309   5.736  10.411
  217    HB3  ALA  29           HB3      ALA  29   9.094   4.682   9.015
  218    H    ILE  30           H        ILE  30   9.212   2.453   9.200
  219    HA   ILE  30           HA       ILE  30   7.854   1.511  11.568
  220    HB   ILE  30           HB       ILE  30   8.201   0.345   8.783
  221   HG12  ILE  30          HG12      ILE  30   5.817   1.833   9.908
  222   HG13  ILE  30          HG13      ILE  30   7.137   2.673   9.094
  223   HG21  ILE  30          HG21      ILE  30   6.224  -0.320  10.988
  224   HG22  ILE  30          HG22      ILE  30   7.450  -1.395  10.315
  225   HG23  ILE  30          HG23      ILE  30   6.086  -0.884   9.323
  226   HD11  ILE  30          HD11      ILE  30   5.444   0.453   7.905
  227   HD12  ILE  30          HD12      ILE  30   6.791   1.251   7.092
  228   HD13  ILE  30          HD13      ILE  30   5.339   2.166   7.497
  229    H    THR  31           H        THR  31  10.838   0.605   9.985
  230    HA   THR  31           HA       THR  31  11.154  -2.049  11.050
  231    HB   THR  31           HB       THR  31  13.607  -1.495  10.546
  232    HG1  THR  31           HG1      THR  31  13.854   0.613  10.682
  233   HG21  THR  31          HG21      THR  31  12.746  -2.471   8.678
  234   HG22  THR  31          HG22      THR  31  12.818  -0.834   8.024
  235   HG23  THR  31          HG23      THR  31  11.306  -1.453   8.688
  236    H    LYS  32           H        LYS  32  12.165   1.165  12.248
  237    HA   LYS  32           HA       LYS  32  13.550   0.180  14.588
  238    HB2  LYS  32           HB2      LYS  32  13.426   2.510  13.237
  239    HB3  LYS  32           HB3      LYS  32  12.298   2.885  14.541
  240    HG2  LYS  32           HG2      LYS  32  14.653   1.554  15.586
  241    HG3  LYS  32           HG3      LYS  32  15.109   2.983  14.660
  242    HD2  LYS  32           HD2      LYS  32  13.662   4.393  15.983
  243    HD3  LYS  32           HD3      LYS  32  12.960   2.992  16.796
  244    HE2  LYS  32           HE2      LYS  32  15.056   2.494  17.907
  245    HE3  LYS  32           HE3      LYS  32  15.902   3.736  16.964
  246    HZ1  LYS  32           HZ1      LYS  32  14.565   5.434  17.930
  247    HZ2  LYS  32           HZ2      LYS  32  15.157   4.487  19.211
  248    HZ3  LYS  32           HZ3      LYS  32  13.550   4.304  18.689
  249    H    TYR  33           H        TYR  33  10.216   0.371  13.856
  250    HA   TYR  33           HA       TYR  33   9.137   0.989  16.464
  251    HB2  TYR  33           HB2      TYR  33   8.130   0.923  14.021
  252    HB3  TYR  33           HB3      TYR  33   7.782  -0.757  14.424
  253    HD1  TYR  33           HD1      TYR  33   7.055   2.763  15.229
  254    HD2  TYR  33           HD2      TYR  33   6.185  -1.334  16.180
  255    HE1  TYR  33           HE1      TYR  33   5.063   3.485  16.518
  256    HE2  TYR  33           HE2      TYR  33   4.192  -0.612  17.468
  257    HH   TYR  33           HH       TYR  33   2.639   1.899  17.194
  258    H    VAL  34           H        VAL  34   9.842  -2.096  14.769
  259    HA   VAL  34           HA       VAL  34   9.120  -3.633  17.212
  260    HB   VAL  34           HB       VAL  34  10.022  -4.524  14.444
  261   HG11  VAL  34          HG11      VAL  34  10.245  -6.441  15.729
  262   HG12  VAL  34          HG12      VAL  34   8.533  -6.551  15.322
  263   HG13  VAL  34          HG13      VAL  34   9.027  -5.928  16.896
  264   HG21  VAL  34          HG21      VAL  34   7.535  -4.972  14.155
  265   HG22  VAL  34          HG22      VAL  34   7.981  -3.267  14.192
  266   HG23  VAL  34          HG23      VAL  34   7.270  -4.024  15.617
  267    H    VAL  35           H        VAL  35  11.402  -2.013  17.589
  268    HA   VAL  35           HA       VAL  35  13.529  -4.090  17.899
  269    HB   VAL  35           HB       VAL  35  13.880  -1.275  16.792
  270   HG11  VAL  35          HG11      VAL  35  15.754  -3.313  17.837
  271   HG12  VAL  35          HG12      VAL  35  15.966  -1.570  17.665
  272   HG13  VAL  35          HG13      VAL  35  16.200  -2.627  16.274
  273   HG21  VAL  35          HG21      VAL  35  12.859  -2.848  15.176
  274   HG22  VAL  35          HG22      VAL  35  14.171  -3.989  15.461
  275   HG23  VAL  35          HG23      VAL  35  14.504  -2.433  14.701
  276    H    ARG  36           H        ARG  36  11.910  -3.422  19.992
  277    HA   ARG  36           HA       ARG  36  13.581  -1.552  21.644
  278    HB2  ARG  36           HB2      ARG  36  10.762  -1.566  20.934
  279    HB3  ARG  36           HB3      ARG  36  10.963  -1.649  22.684
  280    HG2  ARG  36           HG2      ARG  36  10.988   0.662  22.285
  281    HG3  ARG  36           HG3      ARG  36  12.704   0.265  22.334
  282    HD2  ARG  36           HD2      ARG  36  12.331   1.669  20.383
  283    HD3  ARG  36           HD3      ARG  36  12.616   0.020  19.797
  284    HE   ARG  36           HE       ARG  36  10.379  -0.018  19.045
  285   HH11  ARG  36          HH11      ARG  36  10.172   2.896  18.848
  286   HH12  ARG  36          HH12      ARG  36   8.851   3.282  19.898
  287   HH21  ARG  36          HH21      ARG  36   8.945   0.231  21.562
  288   HH22  ARG  36          HH22      ARG  36   8.155   1.768  21.443
  Start of MODEL    3
    1    HA   SER   1           HA       SER   1 -19.438  -7.445 -11.309
    2    HB2  SER   1           HB2      SER   1 -20.718  -9.371 -13.275
    3    HB3  SER   1           HB3      SER   1 -21.173  -7.693 -12.987
    4    HG   SER   1           HG       SER   1 -19.800  -8.067 -14.856
    5    H    ASP   2           H        ASP   2 -19.184  -9.056  -9.207
    6    HA   ASP   2           HA       ASP   2 -21.938 -10.142  -8.717
    7    HB2  ASP   2           HB2      ASP   2 -19.244 -11.306  -7.929
    8    HB3  ASP   2           HB3      ASP   2 -20.810 -11.982  -7.483
    9    H    LEU   3           H        LEU   3 -20.976  -7.516  -7.991
   10    HA   LEU   3           HA       LEU   3 -20.787  -6.073  -6.129
   11    HB2  LEU   3           HB2      LEU   3 -22.924  -7.756  -5.914
   12    HB3  LEU   3           HB3      LEU   3 -22.092  -8.093  -4.400
   13    HG   LEU   3           HG       LEU   3 -23.731  -6.266  -4.123
   14   HD11  LEU   3          HD11      LEU   3 -20.975  -5.035  -4.043
   15   HD12  LEU   3          HD12      LEU   3 -21.444  -6.320  -2.930
   16   HD13  LEU   3          HD13      LEU   3 -22.320  -4.789  -2.928
   17   HD21  LEU   3          HD21      LEU   3 -23.336  -5.522  -6.598
   18   HD22  LEU   3          HD22      LEU   3 -22.029  -4.549  -5.921
   19   HD23  LEU   3          HD23      LEU   3 -23.689  -4.288  -5.387
   20    HA   PRO   4           HA       PRO   4 -17.474  -8.674  -4.119
   21    HB2  PRO   4           HB2      PRO   4 -15.290  -7.772  -5.490
   22    HB3  PRO   4           HB3      PRO   4 -16.269  -9.148  -6.030
   23    HG2  PRO   4           HG2      PRO   4 -16.124  -6.417  -7.100
   24    HG3  PRO   4           HG3      PRO   4 -16.609  -7.919  -7.895
   25    HD2  PRO   4           HD2      PRO   4 -18.303  -5.876  -6.892
   26    HD3  PRO   4           HD3      PRO   4 -18.789  -7.449  -7.556
   27    H    ALA   5           H        ALA   5 -18.688  -6.078  -3.392
   28    HA   ALA   5           HA       ALA   5 -16.493  -4.994  -1.774
   29    HB1  ALA   5           HB1      ALA   5 -17.858  -3.290  -3.883
   30    HB2  ALA   5           HB2      ALA   5 -16.240  -3.972  -4.052
   31    HB3  ALA   5           HB3      ALA   5 -16.567  -2.778  -2.796
   32    H    LEU   6           H        LEU   6 -19.102  -6.191  -1.218
   33    HA   LEU   6           HA       LEU   6 -21.127  -4.243  -0.653
   34    HB2  LEU   6           HB2      LEU   6 -22.054  -6.044   0.763
   35    HB3  LEU   6           HB3      LEU   6 -21.479  -6.687  -0.773
   36    HG   LEU   6           HG       LEU   6 -19.230  -6.853   0.839
   37   HD11  LEU   6          HD11      LEU   6 -21.399  -8.046   2.519
   38   HD12  LEU   6          HD12      LEU   6 -21.075  -6.320   2.689
   39   HD13  LEU   6          HD13      LEU   6 -19.791  -7.492   2.989
   40   HD21  LEU   6          HD21      LEU   6 -21.374  -8.774  -0.025
   41   HD22  LEU   6          HD22      LEU   6 -20.072  -9.339   1.022
   42   HD23  LEU   6          HD23      LEU   6 -19.699  -8.662  -0.563
   43    H    SER   7           H        SER   7 -18.272  -5.261   1.188
   44    HA   SER   7           HA       SER   7 -18.901  -3.123   3.193
   45    HB2  SER   7           HB2      SER   7 -19.337  -5.592   3.854
   46    HB3  SER   7           HB3      SER   7 -17.584  -5.761   3.864
   47    HG   SER   7           HG       SER   7 -17.451  -4.329   5.506
   48    H    THR   8           H        THR   8 -16.914  -3.685   0.755
   49    HA   THR   8           HA       THR   8 -14.521  -2.600   2.184
   50    HB   THR   8           HB       THR   8 -13.184  -4.081   0.585
   51    HG1  THR   8           HG1      THR   8 -14.470  -4.860  -0.898
   52   HG21  THR   8          HG21      THR   8 -14.993  -5.582   2.490
   53   HG22  THR   8          HG22      THR   8 -13.634  -4.588   3.017
   54   HG23  THR   8          HG23      THR   8 -13.350  -6.011   2.013
   55    H    GLY   9           H        GLY   9 -16.244  -0.879   0.949
   56    HA2  GLY   9           HA2      GLY   9 -15.318  -0.451  -1.834
   57    HA3  GLY   9           HA3      GLY   9 -16.601   0.451  -1.021
   58    H    LEU  10           H        LEU  10 -15.909   1.933   0.744
   59    HA   LEU  10           HA       LEU  10 -13.537   3.475  -0.051
   60    HB2  LEU  10           HB2      LEU  10 -15.840   3.713   1.860
   61    HB3  LEU  10           HB3      LEU  10 -14.432   4.744   2.111
   62    HG   LEU  10           HG       LEU  10 -15.613   4.534  -0.640
   63   HD11  LEU  10          HD11      LEU  10 -16.639   6.329   1.582
   64   HD12  LEU  10          HD12      LEU  10 -17.528   4.995   0.847
   65   HD13  LEU  10          HD13      LEU  10 -17.121   6.418  -0.112
   66   HD21  LEU  10          HD21      LEU  10 -14.338   6.822   0.895
   67   HD22  LEU  10          HD22      LEU  10 -14.704   6.788  -0.830
   68   HD23  LEU  10          HD23      LEU  10 -13.456   5.729  -0.172
   69    H    LEU  11           H        LEU  11 -14.510   1.367   2.643
   70    HA   LEU  11           HA       LEU  11 -12.359   1.862   4.444
   71    HB2  LEU  11           HB2      LEU  11 -14.460   0.566   4.872
   72    HB3  LEU  11           HB3      LEU  11 -13.834  -0.730   3.853
   73    HG   LEU  11           HG       LEU  11 -11.882   0.080   5.859
   74   HD11  LEU  11          HD11      LEU  11 -14.459  -1.119   6.909
   75   HD12  LEU  11          HD12      LEU  11 -14.056   0.591   7.066
   76   HD13  LEU  11          HD13      LEU  11 -13.045  -0.628   7.841
   77   HD21  LEU  11          HD21      LEU  11 -11.783  -2.015   4.580
   78   HD22  LEU  11          HD22      LEU  11 -13.334  -2.519   5.252
   79   HD23  LEU  11          HD23      LEU  11 -11.925  -2.369   6.303
   80    H    HIS  12           H        HIS  12 -12.631  -0.452   1.730
   81    HA   HIS  12           HA       HIS  12  -9.949  -1.539   2.110
   82    HB2  HIS  12           HB2      HIS  12 -12.326  -2.036   0.574
   83    HB3  HIS  12           HB3      HIS  12 -10.955  -1.960  -0.531
   84    HD1  HIS  12           HD1      HIS  12 -10.824  -4.499  -0.938
   85    HD2  HIS  12           HD2      HIS  12 -10.527  -3.464   3.091
   86    HE1  HIS  12           HE1      HIS  12 -10.107  -6.595   0.290
   87    H    LEU  13           H        LEU  13 -11.406   1.014   0.112
   88    HA   LEU  13           HA       LEU  13  -9.309   1.465  -1.743
   89    HB2  LEU  13           HB2      LEU  13 -11.747   2.606  -1.019
   90    HB3  LEU  13           HB3      LEU  13 -10.585   3.894  -0.708
   91    HG   LEU  13           HG       LEU  13 -11.397   4.036  -3.015
   92   HD11  LEU  13          HD11      LEU  13  -9.241   4.026  -4.166
   93   HD12  LEU  13          HD12      LEU  13  -8.557   2.974  -2.928
   94   HD13  LEU  13          HD13      LEU  13  -9.029   4.624  -2.521
   95   HD21  LEU  13          HD21      LEU  13 -11.152   2.245  -4.589
   96   HD22  LEU  13          HD22      LEU  13 -11.886   1.535  -3.151
   97   HD23  LEU  13          HD23      LEU  13 -10.166   1.307  -3.468
   98    H    HIS  14           H        HIS  14  -9.783   2.931   1.502
   99    HA   HIS  14           HA       HIS  14  -7.429   4.556   1.507
  100    HB2  HIS  14           HB2      HIS  14  -9.236   4.850   3.104
  101    HB3  HIS  14           HB3      HIS  14  -9.032   3.205   3.705
  102    HD1  HIS  14           HD1      HIS  14  -7.246   6.551   3.638
  103    HD2  HIS  14           HD2      HIS  14  -7.037   2.907   5.653
  104    HE1  HIS  14           HE1      HIS  14  -5.567   6.860   5.511
  105    H    GLN  15           H        GLN  15  -7.959   1.296   2.926
  106    HA   GLN  15           HA       GLN  15  -5.276   0.834   3.779
  107    HB2  GLN  15           HB2      GLN  15  -7.629  -0.421   4.053
  108    HB3  GLN  15           HB3      GLN  15  -6.978  -1.396   2.735
  109    HG2  GLN  15           HG2      GLN  15  -6.346  -2.420   4.852
  110    HG3  GLN  15           HG3      GLN  15  -4.902  -1.753   4.089
  111   HE21  GLN  15          HE21      GLN  15  -7.494  -0.635   6.362
  112   HE22  GLN  15          HE22      GLN  15  -6.434   0.241   7.356
  113    H    ASN  16           H        ASN  16  -6.874   0.244   0.654
  114    HA   ASN  16           HA       ASN  16  -4.785  -1.238  -0.617
  115    HB2  ASN  16           HB2      ASN  16  -7.164  -0.945  -1.360
  116    HB3  ASN  16           HB3      ASN  16  -6.782   0.716  -1.807
  117   HD21  ASN  16          HD21      ASN  16  -5.360   1.055  -3.673
  118   HD22  ASN  16          HD22      ASN  16  -5.032  -0.202  -4.765
  119    H    ILE  17           H        ILE  17  -5.356   2.289  -0.377
  120    HA   ILE  17           HA       ILE  17  -3.041   2.935  -2.066
  121    HB   ILE  17           HB       ILE  17  -4.963   4.522  -0.334
  122   HG12  ILE  17          HG12      ILE  17  -4.628   4.539  -3.344
  123   HG13  ILE  17          HG13      ILE  17  -5.701   3.401  -2.529
  124   HG21  ILE  17          HG21      ILE  17  -3.933   6.458  -1.792
  125   HG22  ILE  17          HG22      ILE  17  -2.541   5.381  -1.894
  126   HG23  ILE  17          HG23      ILE  17  -3.108   5.943  -0.321
  127   HD11  ILE  17          HD11      ILE  17  -6.969   5.376  -3.228
  128   HD12  ILE  17          HD12      ILE  17  -5.847   6.426  -2.361
  129   HD13  ILE  17          HD13      ILE  17  -6.884   5.315  -1.467
  130    H    VAL  18           H        VAL  18  -3.809   3.049   1.425
  131    HA   VAL  18           HA       VAL  18  -1.332   4.213   2.291
  132    HB   VAL  18           HB       VAL  18  -3.396   2.427   3.614
  133   HG11  VAL  18          HG11      VAL  18  -1.075   3.959   4.818
  134   HG12  VAL  18          HG12      VAL  18  -1.366   2.222   4.910
  135   HG13  VAL  18          HG13      VAL  18  -2.432   3.340   5.759
  136   HG21  VAL  18          HG21      VAL  18  -2.939   5.370   4.079
  137   HG22  VAL  18          HG22      VAL  18  -4.394   4.419   4.367
  138   HG23  VAL  18          HG23      VAL  18  -3.916   4.819   2.719
  139    H    ASP  19           H        ASP  19  -2.384   0.820   2.029
  140    HA   ASP  19           HA       ASP  19   0.026  -0.374   3.036
  141    HB2  ASP  19           HB2      ASP  19  -2.269  -1.395   2.776
  142    HB3  ASP  19           HB3      ASP  19  -1.972  -1.485   1.041
  143    H    VAL  20           H        VAL  20  -0.634   1.131  -0.032
  144    HA   VAL  20           HA       VAL  20   1.665  -0.288  -1.303
  145    HB   VAL  20           HB       VAL  20  -0.512   1.533  -2.386
  146   HG11  VAL  20          HG11      VAL  20   1.567  -0.081  -3.896
  147   HG12  VAL  20          HG12      VAL  20   1.658   1.662  -3.644
  148   HG13  VAL  20          HG13      VAL  20   0.341   0.976  -4.596
  149   HG21  VAL  20          HG21      VAL  20  -0.046  -1.433  -2.823
  150   HG22  VAL  20          HG22      VAL  20  -1.441  -0.488  -3.340
  151   HG23  VAL  20          HG23      VAL  20  -1.169  -0.792  -1.624
  152    H    GLN  21           H        GLN  21   0.486   2.942  -0.427
  153    HA   GLN  21           HA       GLN  21   2.681   4.445  -1.522
  154    HB2  GLN  21           HB2      GLN  21   0.272   5.043  -0.535
  155    HB3  GLN  21           HB3      GLN  21   1.209   5.327   0.931
  156    HG2  GLN  21           HG2      GLN  21   2.132   7.222   0.102
  157    HG3  GLN  21           HG3      GLN  21   2.451   6.479  -1.465
  158   HE21  GLN  21          HE21      GLN  21  -0.175   7.996   0.462
  159   HE22  GLN  21          HE22      GLN  21  -1.093   8.473  -0.883
  160    H    TYR  22           H        TYR  22   2.160   2.938   1.681
  161    HA   TYR  22           HA       TYR  22   4.445   4.088   2.980
  162    HB2  TYR  22           HB2      TYR  22   3.689   2.813   4.728
  163    HB3  TYR  22           HB3      TYR  22   2.301   2.542   3.684
  164    HD1  TYR  22           HD1      TYR  22   5.537   1.110   4.830
  165    HD2  TYR  22           HD2      TYR  22   1.864   0.400   2.727
  166    HE1  TYR  22           HE1      TYR  22   6.013  -1.323   4.815
  167    HE2  TYR  22           HE2      TYR  22   2.336  -2.031   2.714
  168    HH   TYR  22           HH       TYR  22   3.748  -3.637   4.206
  169    H    MET  23           H        MET  23   4.090   1.224   0.903
  170    HA   MET  23           HA       MET  23   6.956   0.520   1.288
  171    HB2  MET  23           HB2      MET  23   4.503  -0.842   0.760
  172    HB3  MET  23           HB3      MET  23   5.557  -1.103  -0.629
  173    HG2  MET  23           HG2      MET  23   6.723  -1.381   2.116
  174    HG3  MET  23           HG3      MET  23   5.708  -2.683   1.497
  175    HE1  MET  23           HE1      MET  23   7.560  -4.419  -1.142
  176    HE2  MET  23           HE2      MET  23   6.079  -3.468  -1.198
  177    HE3  MET  23           HE3      MET  23   6.422  -4.466   0.213
  178    H    TYR  24           H        TYR  24   5.822   2.948  -0.325
  179    HA   TYR  24           HA       TYR  24   7.019   2.279  -2.988
  180    HB2  TYR  24           HB2      TYR  24   4.648   3.617  -2.088
  181    HB3  TYR  24           HB3      TYR  24   5.652   4.795  -2.930
  182    HD1  TYR  24           HD1      TYR  24   4.776   1.158  -3.342
  183    HD2  TYR  24           HD2      TYR  24   5.207   5.009  -5.199
  184    HE1  TYR  24           HE1      TYR  24   4.094   0.185  -5.519
  185    HE2  TYR  24           HE2      TYR  24   4.526   4.035  -7.375
  186    HH   TYR  24           HH       TYR  24   2.929   1.417  -7.796
  187    H    GLY  25           H        GLY  25   8.622   2.970  -0.570
  188    HA2  GLY  25           HA2      GLY  25   9.801   5.549  -1.531
  189    HA3  GLY  25           HA3      GLY  25   9.768   5.096   0.174
  190    H    LEU  26           H        LEU  26  11.364   3.747   0.962
  191    HA   LEU  26           HA       LEU  26  13.485   2.709   1.019
  192    HB2  LEU  26           HB2      LEU  26  11.977   1.567  -1.320
  193    HB3  LEU  26           HB3      LEU  26  13.620   1.018  -0.993
  194    HG   LEU  26           HG       LEU  26  11.640   1.117   1.260
  195   HD11  LEU  26          HD11      LEU  26  10.545  -0.072  -0.663
  196   HD12  LEU  26          HD12      LEU  26  10.849  -1.116   0.725
  197   HD13  LEU  26          HD13      LEU  26  11.906  -1.195  -0.684
  198   HD21  LEU  26          HD21      LEU  26  14.017  -0.626   0.533
  199   HD22  LEU  26          HD22      LEU  26  13.019  -0.860   1.969
  200   HD23  LEU  26          HD23      LEU  26  13.967   0.616   1.784
  201    H    SER  27           H        SER  27  13.582   5.337  -0.133
  202    HA   SER  27           HA       SER  27  14.873   5.507  -2.661
  203    HB2  SER  27           HB2      SER  27  14.646   7.171  -0.190
  204    HB3  SER  27           HB3      SER  27  15.866   7.638  -1.372
  205    HG   SER  27           HG       SER  27  14.304   8.389  -2.546
  206    HA   PRO  28           HA       PRO  28  19.082   5.136  -0.510
  207    HB2  PRO  28           HB2      PRO  28  19.235   4.792   2.197
  208    HB3  PRO  28           HB3      PRO  28  19.132   6.391   1.435
  209    HG2  PRO  28           HG2      PRO  28  17.056   4.840   2.856
  210    HG3  PRO  28           HG3      PRO  28  17.270   6.589   2.723
  211    HD2  PRO  28           HD2      PRO  28  15.437   5.049   1.290
  212    HD3  PRO  28           HD3      PRO  28  15.929   6.712   0.912
  213    H    ALA  29           H        ALA  29  17.644   3.009  -1.468
  214    HA   ALA  29           HA       ALA  29  18.860   0.703  -0.075
  215    HB1  ALA  29           HB1      ALA  29  16.846   0.728   1.137
  216    HB2  ALA  29           HB2      ALA  29  16.456  -0.361  -0.194
  217    HB3  ALA  29           HB3      ALA  29  15.914   1.316  -0.239
  218    H    ILE  30           H        ILE  30  16.426   1.529  -2.592
  219    HA   ILE  30           HA       ILE  30  17.284  -0.669  -4.325
  220    HB   ILE  30           HB       ILE  30  15.437   1.710  -4.710
  221   HG12  ILE  30          HG12      ILE  30  14.418  -1.072  -4.480
  222   HG13  ILE  30          HG13      ILE  30  15.092  -0.381  -3.005
  223   HG21  ILE  30          HG21      ILE  30  16.115  -0.654  -6.445
  224   HG22  ILE  30          HG22      ILE  30  15.904   1.035  -6.904
  225   HG23  ILE  30          HG23      ILE  30  14.498   0.046  -6.508
  226   HD11  ILE  30          HD11      ILE  30  12.782   0.631  -4.661
  227   HD12  ILE  30          HD12      ILE  30  13.640   1.690  -3.543
  228   HD13  ILE  30          HD13      ILE  30  12.817   0.253  -2.939
  229    H    THR  31           H        THR  31  17.873   2.807  -4.115
  230    HA   THR  31           HA       THR  31  19.022   3.248  -6.692
  231    HB   THR  31           HB       THR  31  19.813   4.553  -4.068
  232    HG1  THR  31           HG1      THR  31  17.773   5.009  -3.934
  233   HG21  THR  31          HG21      THR  31  19.635   5.566  -6.919
  234   HG22  THR  31          HG22      THR  31  21.118   5.255  -6.016
  235   HG23  THR  31          HG23      THR  31  20.038   6.556  -5.518
  236    H    LYS  32           H        LYS  32  20.477   2.101  -3.643
  237    HA   LYS  32           HA       LYS  32  23.138   1.856  -4.938
  238    HB2  LYS  32           HB2      LYS  32  23.896   1.445  -2.671
  239    HB3  LYS  32           HB3      LYS  32  22.754   2.785  -2.619
  240    HG2  LYS  32           HG2      LYS  32  21.068   0.654  -2.296
  241    HG3  LYS  32           HG3      LYS  32  22.519   0.061  -1.489
  242    HD2  LYS  32           HD2      LYS  32  22.380   2.643  -0.556
  243    HD3  LYS  32           HD3      LYS  32  20.674   2.215  -0.688
  244    HE2  LYS  32           HE2      LYS  32  21.067   0.178   0.661
  245    HE3  LYS  32           HE3      LYS  32  22.784   0.606   0.798
  246    HZ1  LYS  32           HZ1      LYS  32  21.659   1.475   2.706
  247    HZ2  LYS  32           HZ2      LYS  32  20.460   2.202   1.745
  248    HZ3  LYS  32           HZ3      LYS  32  22.056   2.786   1.705
  249    H    TYR  33           H        TYR  33  20.597   0.061  -5.434
  250    HA   TYR  33           HA       TYR  33  21.897  -2.579  -4.863
  251    HB2  TYR  33           HB2      TYR  33  19.319  -1.530  -4.352
  252    HB3  TYR  33           HB3      TYR  33  19.112  -2.682  -5.670
  253    HD1  TYR  33           HD1      TYR  33  20.297  -2.256  -2.189
  254    HD2  TYR  33           HD2      TYR  33  19.473  -5.046  -5.349
  255    HE1  TYR  33           HE1      TYR  33  20.498  -4.135  -0.583
  256    HE2  TYR  33           HE2      TYR  33  19.674  -6.924  -3.743
  257    HH   TYR  33           HH       TYR  33  21.127  -6.985  -1.161
  258    H    VAL  34           H        VAL  34  19.879  -0.878  -7.302
  259    HA   VAL  34           HA       VAL  34  20.628  -2.817  -9.395
  260    HB   VAL  34           HB       VAL  34  18.987  -0.259  -9.338
  261   HG11  VAL  34          HG11      VAL  34  19.892  -1.983 -11.570
  262   HG12  VAL  34          HG12      VAL  34  19.345  -0.307 -11.592
  263   HG13  VAL  34          HG13      VAL  34  18.167  -1.618 -11.560
  264   HG21  VAL  34          HG21      VAL  34  18.150  -2.306  -8.085
  265   HG22  VAL  34          HG22      VAL  34  18.094  -3.141  -9.637
  266   HG23  VAL  34          HG23      VAL  34  17.077  -1.728  -9.359
  267    H    VAL  35           H        VAL  35  20.978   0.734  -8.971
  268    HA   VAL  35           HA       VAL  35  22.586   2.239  -9.802
  269    HB   VAL  35           HB       VAL  35  24.396  -0.189  -9.920
  270   HG11  VAL  35          HG11      VAL  35  25.031   2.549  -8.835
  271   HG12  VAL  35          HG12      VAL  35  25.077   2.243 -10.571
  272   HG13  VAL  35          HG13      VAL  35  26.131   1.336  -9.488
  273   HG21  VAL  35          HG21      VAL  35  23.587  -0.582  -7.794
  274   HG22  VAL  35          HG22      VAL  35  23.057   1.085  -7.573
  275   HG23  VAL  35          HG23      VAL  35  24.762   0.671  -7.395
  276    H    ARG  36           H        ARG  36  20.840   1.119 -11.759
  277    HA   ARG  36           HA       ARG  36  20.609   0.965 -14.098
  278    HB2  ARG  36           HB2      ARG  36  22.323   2.978 -13.521
  279    HB3  ARG  36           HB3      ARG  36  23.388   1.961 -14.490
  280    HG2  ARG  36           HG2      ARG  36  22.380   3.293 -16.125
  281    HG3  ARG  36           HG3      ARG  36  21.352   1.860 -16.139
  282    HD2  ARG  36           HD2      ARG  36  19.964   3.156 -14.320
  283    HD3  ARG  36           HD3      ARG  36  20.773   4.585 -14.995
  284    HE   ARG  36           HE       ARG  36  19.155   2.669 -16.638
  285   HH11  ARG  36          HH11      ARG  36  17.778   5.164 -16.001
  286   HH12  ARG  36          HH12      ARG  36  18.205   6.212 -17.312
  287   HH21  ARG  36          HH21      ARG  36  20.903   4.270 -18.329
  288   HH22  ARG  36          HH22      ARG  36  19.981   5.704 -18.636
  Start of MODEL    4
    1    HA   SER   1           HA       SER   1 -26.085  -9.338   9.506
    2    HB2  SER   1           HB2      SER   1 -26.105  -6.463  10.488
    3    HB3  SER   1           HB3      SER   1 -27.081  -7.101   9.168
    4    HG   SER   1           HG       SER   1 -28.191  -7.031  11.202
    5    H    ASP   2           H        ASP   2 -24.489  -9.747   7.977
    6    HA   ASP   2           HA       ASP   2 -22.698  -7.453   7.241
    7    HB2  ASP   2           HB2      ASP   2 -22.161 -10.181   8.098
    8    HB3  ASP   2           HB3      ASP   2 -21.446  -9.862   6.518
    9    H    LEU   3           H        LEU   3 -25.291  -8.042   6.038
   10    HA   LEU   3           HA       LEU   3 -24.942  -9.519   3.567
   11    HB2  LEU   3           HB2      LEU   3 -26.990  -8.011   4.997
   12    HB3  LEU   3           HB3      LEU   3 -27.046  -7.677   3.267
   13    HG   LEU   3           HG       LEU   3 -28.472  -9.603   3.823
   14   HD11  LEU   3          HD11      LEU   3 -27.012  -9.464   1.683
   15   HD12  LEU   3          HD12      LEU   3 -27.731 -11.021   2.092
   16   HD13  LEU   3          HD13      LEU   3 -26.031 -10.716   2.447
   17   HD21  LEU   3          HD21      LEU   3 -25.888 -10.812   4.860
   18   HD22  LEU   3          HD22      LEU   3 -27.397 -11.700   4.645
   19   HD23  LEU   3          HD23      LEU   3 -27.304 -10.390   5.822
   20    HA   PRO   4           HA       PRO   4 -24.220  -5.291   1.582
   21    HB2  PRO   4           HB2      PRO   4 -24.436  -3.001   3.052
   22    HB3  PRO   4           HB3      PRO   4 -25.831  -3.804   2.306
   23    HG2  PRO   4           HG2      PRO   4 -25.039  -3.670   5.127
   24    HG3  PRO   4           HG3      PRO   4 -26.625  -3.973   4.411
   25    HD2  PRO   4           HD2      PRO   4 -24.816  -5.879   5.507
   26    HD3  PRO   4           HD3      PRO   4 -26.373  -6.187   4.713
   27    H    ALA   5           H        ALA   5 -22.484  -6.582   3.947
   28    HA   ALA   5           HA       ALA   5 -20.243  -6.438   4.649
   29    HB1  ALA   5           HB1      ALA   5 -19.950  -4.384   2.451
   30    HB2  ALA   5           HB2      ALA   5 -20.158  -6.099   2.098
   31    HB3  ALA   5           HB3      ALA   5 -18.756  -5.552   3.019
   32    H    LEU   6           H        LEU   6 -22.373  -4.237   5.449
   33    HA   LEU   6           HA       LEU   6 -22.411  -2.297   6.784
   34    HB2  LEU   6           HB2      LEU   6 -19.892  -3.791   7.465
   35    HB3  LEU   6           HB3      LEU   6 -20.246  -2.263   8.272
   36    HG   LEU   6           HG       LEU   6 -22.616  -3.926   8.196
   37   HD11  LEU   6          HD11      LEU   6 -21.828  -5.731   9.661
   38   HD12  LEU   6          HD12      LEU   6 -20.179  -5.112   9.560
   39   HD13  LEU   6          HD13      LEU   6 -20.962  -5.774   8.126
   40   HD21  LEU   6          HD21      LEU   6 -20.859  -2.817  10.409
   41   HD22  LEU   6          HD22      LEU   6 -22.433  -3.565  10.676
   42   HD23  LEU   6          HD23      LEU   6 -22.313  -2.072   9.745
   43    H    SER   7           H        SER   7 -21.478  -1.823   4.068
   44    HA   SER   7           HA       SER   7 -20.433  -0.139   2.794
   45    HB2  SER   7           HB2      SER   7 -21.769   1.211   4.367
   46    HB3  SER   7           HB3      SER   7 -20.454   1.166   5.537
   47    HG   SER   7           HG       SER   7 -19.194   2.346   4.129
   48    H    THR   8           H        THR   8 -18.536  -1.689   2.655
   49    HA   THR   8           HA       THR   8 -16.138  -0.628   4.123
   50    HB   THR   8           HB       THR   8 -15.305  -3.034   3.458
   51    HG1  THR   8           HG1      THR   8 -16.866  -3.833   2.231
   52   HG21  THR   8          HG21      THR   8 -16.701  -3.934   5.482
   53   HG22  THR   8          HG22      THR   8 -17.261  -2.266   5.606
   54   HG23  THR   8          HG23      THR   8 -15.541  -2.632   5.747
   55    H    GLY   9           H        GLY   9 -17.468  -0.010   1.305
   56    HA2  GLY   9           HA2      GLY   9 -15.591  -0.872  -0.688
   57    HA3  GLY   9           HA3      GLY   9 -16.684   0.503  -0.849
   58    H    LEU  10           H        LEU  10 -15.975   2.447   0.616
   59    HA   LEU  10           HA       LEU  10 -13.464   3.443  -0.277
   60    HB2  LEU  10           HB2      LEU  10 -15.686   4.440   0.925
   61    HB3  LEU  10           HB3      LEU  10 -14.583   4.430   2.301
   62    HG   LEU  10           HG       LEU  10 -13.519   5.497  -0.272
   63   HD11  LEU  10          HD11      LEU  10 -14.550   7.674   0.057
   64   HD12  LEU  10          HD12      LEU  10 -15.380   7.103   1.504
   65   HD13  LEU  10          HD13      LEU  10 -15.824   6.463  -0.079
   66   HD21  LEU  10          HD21      LEU  10 -12.092   5.428   1.699
   67   HD22  LEU  10          HD22      LEU  10 -13.313   6.263   2.658
   68   HD23  LEU  10          HD23      LEU  10 -12.484   7.112   1.353
   69    H    LEU  11           H        LEU  11 -14.342   1.710   2.707
   70    HA   LEU  11           HA       LEU  11 -11.974   2.100   4.223
   71    HB2  LEU  11           HB2      LEU  11 -14.236   0.957   4.769
   72    HB3  LEU  11           HB3      LEU  11 -13.525  -0.492   4.057
   73    HG   LEU  11           HG       LEU  11 -11.841   0.938   6.043
   74   HD11  LEU  11          HD11      LEU  11 -14.160   1.033   7.014
   75   HD12  LEU  11          HD12      LEU  11 -13.035   0.058   7.959
   76   HD13  LEU  11          HD13      LEU  11 -14.220  -0.728   6.915
   77   HD21  LEU  11          HD21      LEU  11 -10.862  -1.052   5.383
   78   HD22  LEU  11          HD22      LEU  11 -12.413  -1.847   5.112
   79   HD23  LEU  11          HD23      LEU  11 -11.802  -1.641   6.754
   80    H    HIS  12           H        HIS  12 -12.741  -0.443   1.813
   81    HA   HIS  12           HA       HIS  12 -10.182  -1.777   1.971
   82    HB2  HIS  12           HB2      HIS  12 -12.555  -1.705   0.128
   83    HB3  HIS  12           HB3      HIS  12 -11.089  -2.520  -0.416
   84    HD1  HIS  12           HD1      HIS  12 -10.083  -3.992   1.944
   85    HD2  HIS  12           HD2      HIS  12 -14.172  -3.655   1.212
   86    HE1  HIS  12           HE1      HIS  12 -11.195  -5.889   3.202
   87    H    LEU  13           H        LEU  13 -11.512   0.712  -0.224
   88    HA   LEU  13           HA       LEU  13  -9.284   0.928  -1.999
   89    HB2  LEU  13           HB2      LEU  13 -11.765   2.253  -1.399
   90    HB3  LEU  13           HB3      LEU  13 -10.511   3.478  -1.588
   91    HG   LEU  13           HG       LEU  13  -9.881   1.918  -3.687
   92   HD11  LEU  13          HD11      LEU  13 -11.656   0.292  -3.304
   93   HD12  LEU  13          HD12      LEU  13 -12.020   1.200  -4.771
   94   HD13  LEU  13          HD13      LEU  13 -12.866   1.573  -3.269
   95   HD21  LEU  13          HD21      LEU  13 -12.068   4.021  -3.588
   96   HD22  LEU  13          HD22      LEU  13 -11.280   3.473  -5.067
   97   HD23  LEU  13          HD23      LEU  13 -10.346   4.309  -3.828
   98    H    HIS  14           H        HIS  14  -9.977   2.493   1.125
   99    HA   HIS  14           HA       HIS  14  -7.754   4.309   1.162
  100    HB2  HIS  14           HB2      HIS  14  -9.619   4.570   2.666
  101    HB3  HIS  14           HB3      HIS  14  -9.430   2.932   3.284
  102    HD1  HIS  14           HD1      HIS  14  -7.669   6.295   3.309
  103    HD2  HIS  14           HD2      HIS  14  -7.616   2.688   5.398
  104    HE1  HIS  14           HE1      HIS  14  -6.149   6.644   5.305
  105    H    GLN  15           H        GLN  15  -8.145   1.074   2.679
  106    HA   GLN  15           HA       GLN  15  -5.540   0.760   3.732
  107    HB2  GLN  15           HB2      GLN  15  -7.650  -0.669   3.986
  108    HB3  GLN  15           HB3      GLN  15  -7.223  -1.406   2.442
  109    HG2  GLN  15           HG2      GLN  15  -6.190  -2.871   3.927
  110    HG3  GLN  15           HG3      GLN  15  -4.873  -1.748   3.596
  111   HE21  GLN  15          HE21      GLN  15  -3.882  -0.916   5.440
  112   HE22  GLN  15          HE22      GLN  15  -4.612  -0.799   6.968
  113    H    ASN  16           H        ASN  16  -6.753   0.104   0.442
  114    HA   ASN  16           HA       ASN  16  -4.465  -1.175  -0.658
  115    HB2  ASN  16           HB2      ASN  16  -6.849  -0.753  -1.580
  116    HB3  ASN  16           HB3      ASN  16  -6.229   0.812  -2.106
  117   HD21  ASN  16          HD21      ASN  16  -4.323   0.758  -3.635
  118   HD22  ASN  16          HD22      ASN  16  -4.123  -0.590  -4.648
  119    H    ILE  17           H        ILE  17  -5.294   2.321  -0.620
  120    HA   ILE  17           HA       ILE  17  -2.793   3.155  -1.842
  121    HB   ILE  17           HB       ILE  17  -5.016   4.530  -0.303
  122   HG12  ILE  17          HG12      ILE  17  -4.311   4.966  -3.191
  123   HG13  ILE  17          HG13      ILE  17  -5.182   3.501  -2.736
  124   HG21  ILE  17          HG21      ILE  17  -3.060   5.900   0.049
  125   HG22  ILE  17          HG22      ILE  17  -4.006   6.660  -1.231
  126   HG23  ILE  17          HG23      ILE  17  -2.567   5.723  -1.634
  127   HD11  ILE  17          HD11      ILE  17  -6.088   6.253  -1.871
  128   HD12  ILE  17          HD12      ILE  17  -7.005   4.746  -1.830
  129   HD13  ILE  17          HD13      ILE  17  -6.630   5.509  -3.375
  130    H    VAL  18           H        VAL  18  -3.922   2.755   1.498
  131    HA   VAL  18           HA       VAL  18  -1.625   4.051   2.732
  132    HB   VAL  18           HB       VAL  18  -3.799   2.180   3.720
  133   HG11  VAL  18          HG11      VAL  18  -3.135   3.151   5.993
  134   HG12  VAL  18          HG12      VAL  18  -1.647   3.694   5.218
  135   HG13  VAL  18          HG13      VAL  18  -2.021   1.971   5.303
  136   HG21  VAL  18          HG21      VAL  18  -5.074   4.035   3.674
  137   HG22  VAL  18          HG22      VAL  18  -3.718   4.970   3.045
  138   HG23  VAL  18          HG23      VAL  18  -3.954   4.820   4.786
  139    H    ASP  19           H        ASP  19  -2.036   0.988   1.255
  140    HA   ASP  19           HA       ASP  19   0.230  -0.167   2.839
  141    HB2  ASP  19           HB2      ASP  19  -2.213  -1.226   1.489
  142    HB3  ASP  19           HB3      ASP  19  -0.790  -2.265   1.487
  143    H    VAL  20           H        VAL  20   0.216   1.721   0.349
  144    HA   VAL  20           HA       VAL  20   1.936  -0.008  -1.403
  145    HB   VAL  20           HB       VAL  20   0.091   2.320  -2.018
  146   HG11  VAL  20          HG11      VAL  20   1.971   2.638  -3.455
  147   HG12  VAL  20          HG12      VAL  20   0.777   1.781  -4.430
  148   HG13  VAL  20          HG13      VAL  20   2.141   0.905  -3.736
  149   HG21  VAL  20          HG21      VAL  20  -1.271   0.754  -3.100
  150   HG22  VAL  20          HG22      VAL  20  -0.703  -0.157  -1.700
  151   HG23  VAL  20          HG23      VAL  20   0.042  -0.409  -3.279
  152    H    GLN  21           H        GLN  21   1.372   3.394  -0.507
  153    HA   GLN  21           HA       GLN  21   4.145   4.157  -1.107
  154    HB2  GLN  21           HB2      GLN  21   1.822   5.609   0.217
  155    HB3  GLN  21           HB3      GLN  21   3.307   6.374  -0.352
  156    HG2  GLN  21           HG2      GLN  21   2.762   6.082  -2.597
  157    HG3  GLN  21           HG3      GLN  21   1.705   4.709  -2.270
  158   HE21  GLN  21          HE21      GLN  21   1.365   7.641  -3.496
  159   HE22  GLN  21          HE22      GLN  21  -0.087   8.151  -2.780
  160    H    TYR  22           H        TYR  22   2.417   2.944   1.633
  161    HA   TYR  22           HA       TYR  22   4.500   3.944   3.533
  162    HB2  TYR  22           HB2      TYR  22   1.822   2.646   4.128
  163    HB3  TYR  22           HB3      TYR  22   2.802   3.631   5.212
  164    HD1  TYR  22           HD1      TYR  22   0.518   3.664   2.324
  165    HD2  TYR  22           HD2      TYR  22   2.893   6.074   4.969
  166    HE1  TYR  22           HE1      TYR  22  -0.642   5.692   1.507
  167    HE2  TYR  22           HE2      TYR  22   1.731   8.106   4.151
  168    HH   TYR  22           HH       TYR  22   0.015   8.260   1.386
  169    H    MET  23           H        MET  23   2.674   0.981   2.653
  170    HA   MET  23           HA       MET  23   4.196  -0.795   4.342
  171    HB2  MET  23           HB2      MET  23   1.912  -0.885   2.788
  172    HB3  MET  23           HB3      MET  23   3.022  -1.913   1.883
  173    HG2  MET  23           HG2      MET  23   3.178  -2.422   4.749
  174    HG3  MET  23           HG3      MET  23   1.545  -2.660   4.132
  175    HE1  MET  23           HE1      MET  23   0.829  -4.570   3.810
  176    HE2  MET  23           HE2      MET  23   1.522  -5.996   3.043
  177    HE3  MET  23           HE3      MET  23   1.005  -4.635   2.051
  178    H    TYR  24           H        TYR  24   4.665   0.380   1.023
  179    HA   TYR  24           HA       TYR  24   6.893  -1.519   0.557
  180    HB2  TYR  24           HB2      TYR  24   4.993  -0.137  -0.991
  181    HB3  TYR  24           HB3      TYR  24   6.537   0.608  -1.400
  182    HD1  TYR  24           HD1      TYR  24   4.691  -2.609  -1.241
  183    HD2  TYR  24           HD2      TYR  24   8.217  -0.586  -2.626
  184    HE1  TYR  24           HE1      TYR  24   5.272  -4.577  -2.635
  185    HE2  TYR  24           HE2      TYR  24   8.798  -2.552  -4.020
  186    HH   TYR  24           HH       TYR  24   7.921  -5.384  -3.657
  187    H    GLY  25           H        GLY  25   7.336   0.246   2.751
  188    HA2  GLY  25           HA2      GLY  25   9.830   1.513   1.890
  189    HA3  GLY  25           HA3      GLY  25   8.609   2.654   2.456
  190    H    LEU  26           H        LEU  26   9.406  -0.631   3.622
  191    HA   LEU  26           HA       LEU  26   9.714   0.524   6.368
  192    HB2  LEU  26           HB2      LEU  26   8.534  -1.891   5.158
  193    HB3  LEU  26           HB3      LEU  26   9.481  -2.215   6.609
  194    HG   LEU  26           HG       LEU  26   8.171  -0.197   7.624
  195   HD11  LEU  26          HD11      LEU  26   5.869  -0.015   6.645
  196   HD12  LEU  26          HD12      LEU  26   6.416  -0.991   5.281
  197   HD13  LEU  26          HD13      LEU  26   7.130   0.595   5.573
  198   HD21  LEU  26          HD21      LEU  26   7.058  -2.948   7.057
  199   HD22  LEU  26          HD22      LEU  26   6.197  -1.800   8.082
  200   HD23  LEU  26          HD23      LEU  26   7.806  -2.355   8.539
  201    H    SER  27           H        SER  27  11.808   0.089   4.043
  202    HA   SER  27           HA       SER  27  13.674  -1.914   4.773
  203    HB2  SER  27           HB2      SER  27  13.653   0.653   3.281
  204    HB3  SER  27           HB3      SER  27  15.237   0.094   3.809
  205    HG   SER  27           HG       SER  27  15.083  -1.590   2.512
  206    HA   PRO  28           HA       PRO  28  15.795   1.281   7.659
  207    HB2  PRO  28           HB2      PRO  28  14.437   3.573   8.283
  208    HB3  PRO  28           HB3      PRO  28  15.549   3.451   6.905
  209    HG2  PRO  28           HG2      PRO  28  12.576   3.333   6.955
  210    HG3  PRO  28           HG3      PRO  28  13.658   4.088   5.774
  211    HD2  PRO  28           HD2      PRO  28  12.428   1.692   5.372
  212    HD3  PRO  28           HD3      PRO  28  13.974   2.141   4.621
  213    H    ALA  29           H        ALA  29  12.310   0.881   7.812
  214    HA   ALA  29           HA       ALA  29  12.023   1.106  10.685
  215    HB1  ALA  29           HB1      ALA  29   9.799   0.250  10.229
  216    HB2  ALA  29           HB2      ALA  29  10.324  -0.412   8.680
  217    HB3  ALA  29           HB3      ALA  29  10.238   1.335   8.910
  218    H    ILE  30           H        ILE  30  12.746  -1.589   8.474
  219    HA   ILE  30           HA       ILE  30  12.538  -3.588  10.624
  220    HB   ILE  30           HB       ILE  30  12.258  -3.550   7.877
  221   HG12  ILE  30          HG12      ILE  30  11.249  -5.148   9.480
  222   HG13  ILE  30          HG13      ILE  30  11.934  -5.972   8.081
  223   HG21  ILE  30          HG21      ILE  30  13.988  -5.032   6.960
  224   HG22  ILE  30          HG22      ILE  30  14.833  -5.025   8.507
  225   HG23  ILE  30          HG23      ILE  30  14.711  -3.541   7.562
  226   HD11  ILE  30          HD11      ILE  30  13.245  -5.685  10.803
  227   HD12  ILE  30          HD12      ILE  30  13.990  -6.448   9.399
  228   HD13  ILE  30          HD13      ILE  30  12.554  -7.161  10.132
  229    H    THR  31           H        THR  31  14.961  -1.424   9.546
  230    HA   THR  31           HA       THR  31  17.182  -3.173  10.509
  231    HB   THR  31           HB       THR  31  18.554  -1.281   9.484
  232    HG1  THR  31           HG1      THR  31  17.401   0.163   8.193
  233   HG21  THR  31          HG21      THR  31  18.024  -1.953   7.156
  234   HG22  THR  31          HG22      THR  31  16.530  -2.696   7.725
  235   HG23  THR  31          HG23      THR  31  18.087  -3.343   8.241
  236    H    LYS  32           H        LYS  32  15.651   0.002  11.110
  237    HA   LYS  32           HA       LYS  32  17.436   0.525  13.418
  238    HB2  LYS  32           HB2      LYS  32  16.155   2.059  11.515
  239    HB3  LYS  32           HB3      LYS  32  15.104   2.266  12.915
  240    HG2  LYS  32           HG2      LYS  32  16.600   3.896  13.473
  241    HG3  LYS  32           HG3      LYS  32  17.542   2.542  14.093
  242    HD2  LYS  32           HD2      LYS  32  19.054   2.626  12.371
  243    HD3  LYS  32           HD3      LYS  32  17.841   3.130  11.193
  244    HE2  LYS  32           HE2      LYS  32  17.810   5.402  12.340
  245    HE3  LYS  32           HE3      LYS  32  19.228   4.866  13.262
  246    HZ1  LYS  32           HZ1      LYS  32  20.277   4.275  11.108
  247    HZ2  LYS  32           HZ2      LYS  32  19.991   5.942  11.277
  248    HZ3  LYS  32           HZ3      LYS  32  18.969   4.997  10.302
  249    H    TYR  33           H        TYR  33  15.718  -1.806  13.678
  250    HA   TYR  33           HA       TYR  33  14.223  -1.023  16.125
  251    HB2  TYR  33           HB2      TYR  33  13.105  -1.853  13.513
  252    HB3  TYR  33           HB3      TYR  33  12.444  -2.723  14.897
  253    HD1  TYR  33           HD1      TYR  33  11.448  -1.421  16.819
  254    HD2  TYR  33           HD2      TYR  33  12.539   0.427  13.098
  255    HE1  TYR  33           HE1      TYR  33  10.039   0.540  17.380
  256    HE2  TYR  33           HE2      TYR  33  11.128   2.387  13.657
  257    HH   TYR  33           HH       TYR  33  10.234   3.284  16.397
  258    H    VAL  34           H        VAL  34  14.959  -3.743  13.905
  259    HA   VAL  34           HA       VAL  34  14.952  -5.707  16.086
  260    HB   VAL  34           HB       VAL  34  15.935  -5.961  13.222
  261   HG11  VAL  34          HG11      VAL  34  15.439  -8.304  13.488
  262   HG12  VAL  34          HG12      VAL  34  14.664  -8.020  15.047
  263   HG13  VAL  34          HG13      VAL  34  16.408  -7.817  14.879
  264   HG21  VAL  34          HG21      VAL  34  13.737  -5.113  12.966
  265   HG22  VAL  34          HG22      VAL  34  13.144  -5.986  14.380
  266   HG23  VAL  34          HG23      VAL  34  13.522  -6.862  12.896
  267    H    VAL  35           H        VAL  35  16.665  -4.369  17.292
  268    HA   VAL  35           HA       VAL  35  19.411  -5.224  16.429
  269    HB   VAL  35           HB       VAL  35  18.642  -2.623  17.806
  270   HG11  VAL  35          HG11      VAL  35  20.905  -2.905  18.240
  271   HG12  VAL  35          HG12      VAL  35  20.983  -2.089  16.680
  272   HG13  VAL  35          HG13      VAL  35  21.178  -3.839  16.770
  273   HG21  VAL  35          HG21      VAL  35  19.017  -3.298  14.881
  274   HG22  VAL  35          HG22      VAL  35  19.229  -1.657  15.489
  275   HG23  VAL  35          HG23      VAL  35  17.666  -2.457  15.640
  276    H    ARG  36           H        ARG  36  17.702  -6.687  18.224
  277    HA   ARG  36           HA       ARG  36  19.395  -6.674  20.645
  278    HB2  ARG  36           HB2      ARG  36  17.464  -6.341  22.142
  279    HB3  ARG  36           HB3      ARG  36  17.643  -4.966  21.054
  280    HG2  ARG  36           HG2      ARG  36  15.446  -5.288  20.584
  281    HG3  ARG  36           HG3      ARG  36  16.000  -6.644  19.604
  282    HD2  ARG  36           HD2      ARG  36  15.625  -8.208  21.405
  283    HD3  ARG  36           HD3      ARG  36  15.324  -6.889  22.556
  284    HE   ARG  36           HE       ARG  36  13.507  -7.661  20.318
  285   HH11  ARG  36          HH11      ARG  36  12.874  -7.674  23.328
  286   HH12  ARG  36          HH12      ARG  36  11.878  -6.262  23.456
  287   HH21  ARG  36          HH21      ARG  36  12.824  -4.998  20.358
  288   HH22  ARG  36          HH22      ARG  36  11.852  -4.740  21.768
  Start of MODEL    5
    1    HA   SER   1           HA       SER   1 -22.366 -11.111   4.167
    2    HB2  SER   1           HB2      SER   1 -22.740 -12.507   6.305
    3    HB3  SER   1           HB3      SER   1 -23.410 -13.154   4.812
    4    HG   SER   1           HG       SER   1 -21.054 -13.914   6.191
    5    H    ASP   2           H        ASP   2 -21.409  -9.451   5.272
    6    HA   ASP   2           HA       ASP   2 -19.093 -10.029   7.063
    7    HB2  ASP   2           HB2      ASP   2 -18.001  -7.961   5.975
    8    HB3  ASP   2           HB3      ASP   2 -18.025  -9.436   5.015
    9    H    LEU   3           H        LEU   3 -18.513  -7.818   8.223
   10    HA   LEU   3           HA       LEU   3 -20.717  -7.006   9.811
   11    HB2  LEU   3           HB2      LEU   3 -17.911  -6.494   9.552
   12    HB3  LEU   3           HB3      LEU   3 -18.729  -4.944   9.733
   13    HG   LEU   3           HG       LEU   3 -18.131  -5.877  11.933
   14   HD11  LEU   3          HD11      LEU   3 -21.122  -6.142  11.589
   15   HD12  LEU   3          HD12      LEU   3 -20.308  -4.580  11.502
   16   HD13  LEU   3          HD13      LEU   3 -20.234  -5.531  12.985
   17   HD21  LEU   3          HD21      LEU   3 -20.069  -8.128  11.354
   18   HD22  LEU   3          HD22      LEU   3 -18.944  -7.979  12.705
   19   HD23  LEU   3          HD23      LEU   3 -18.335  -8.294  11.080
   20    HA   PRO   4           HA       PRO   4 -21.187  -3.083   7.209
   21    HB2  PRO   4           HB2      PRO   4 -19.578  -2.654   5.034
   22    HB3  PRO   4           HB3      PRO   4 -19.118  -2.192   6.680
   23    HG2  PRO   4           HG2      PRO   4 -18.172  -4.430   5.019
   24    HG3  PRO   4           HG3      PRO   4 -17.355  -3.563   6.325
   25    HD2  PRO   4           HD2      PRO   4 -18.589  -6.085   6.480
   26    HD3  PRO   4           HD3      PRO   4 -17.983  -5.113   7.836
   27    H    ALA   5           H        ALA   5 -21.204  -2.741   4.302
   28    HA   ALA   5           HA       ALA   5 -22.227  -5.155   3.033
   29    HB1  ALA   5           HB1      ALA   5 -24.167  -4.891   4.313
   30    HB2  ALA   5           HB2      ALA   5 -24.583  -3.958   2.875
   31    HB3  ALA   5           HB3      ALA   5 -24.034  -3.133   4.335
   32    H    LEU   6           H        LEU   6 -23.348  -1.768   2.709
   33    HA   LEU   6           HA       LEU   6 -22.310  -1.777  -0.094
   34    HB2  LEU   6           HB2      LEU   6 -23.994  -0.039  -0.452
   35    HB3  LEU   6           HB3      LEU   6 -24.736  -1.419   0.353
   36    HG   LEU   6           HG       LEU   6 -23.758   0.250   2.420
   37   HD11  LEU   6          HD11      LEU   6 -25.054   2.356   1.872
   38   HD12  LEU   6          HD12      LEU   6 -25.158   1.777   0.209
   39   HD13  LEU   6          HD13      LEU   6 -23.584   2.129   0.924
   40   HD21  LEU   6          HD21      LEU   6 -26.614   0.178   1.438
   41   HD22  LEU   6          HD22      LEU   6 -26.029   0.270   3.099
   42   HD23  LEU   6          HD23      LEU   6 -25.867  -1.232   2.189
   43    H    SER   7           H        SER   7 -21.790  -0.272   3.007
   44    HA   SER   7           HA       SER   7 -20.277   1.988   1.787
   45    HB2  SER   7           HB2      SER   7 -21.122   1.316   4.625
   46    HB3  SER   7           HB3      SER   7 -20.287   2.794   4.156
   47    HG   SER   7           HG       SER   7 -22.163   3.544   3.606
   48    H    THR   8           H        THR   8 -19.046  -0.482   1.351
   49    HA   THR   8           HA       THR   8 -16.765  -0.440   3.303
   50    HB   THR   8           HB       THR   8 -18.410  -2.413   3.303
   51    HG1  THR   8           HG1      THR   8 -16.679  -3.885   3.490
   52   HG21  THR   8          HG21      THR   8 -16.908  -3.217   0.806
   53   HG22  THR   8          HG22      THR   8 -18.491  -2.443   0.741
   54   HG23  THR   8          HG23      THR   8 -18.306  -4.005   1.538
   55    H    GLY   9           H        GLY   9 -17.459   0.580   0.297
   56    HA2  GLY   9           HA2      GLY   9 -15.313  -0.657  -1.243
   57    HA3  GLY   9           HA3      GLY   9 -16.280   0.730  -1.745
   58    H    LEU  10           H        LEU  10 -15.835   2.650   0.046
   59    HA   LEU  10           HA       LEU  10 -13.157   3.556  -0.501
   60    HB2  LEU  10           HB2      LEU  10 -13.826   5.430   0.984
   61    HB3  LEU  10           HB3      LEU  10 -15.092   5.040  -0.177
   62    HG   LEU  10           HG       LEU  10 -15.730   3.396   1.946
   63   HD11  LEU  10          HD11      LEU  10 -13.870   4.875   3.128
   64   HD12  LEU  10          HD12      LEU  10 -15.351   4.444   3.981
   65   HD13  LEU  10          HD13      LEU  10 -15.189   6.040   3.248
   66   HD21  LEU  10          HD21      LEU  10 -17.527   5.062   2.377
   67   HD22  LEU  10          HD22      LEU  10 -17.299   4.768   0.653
   68   HD23  LEU  10          HD23      LEU  10 -16.652   6.234   1.391
   69    H    LEU  11           H        LEU  11 -14.596   1.874   2.273
   70    HA   LEU  11           HA       LEU  11 -12.500   2.337   4.176
   71    HB2  LEU  11           HB2      LEU  11 -14.958   1.038   4.052
   72    HB3  LEU  11           HB3      LEU  11 -13.821  -0.286   4.287
   73    HG   LEU  11           HG       LEU  11 -14.529   0.524   6.466
   74   HD11  LEU  11          HD11      LEU  11 -11.798   1.743   6.100
   75   HD12  LEU  11          HD12      LEU  11 -12.029   0.003   5.923
   76   HD13  LEU  11          HD13      LEU  11 -12.416   0.792   7.452
   77   HD21  LEU  11          HD21      LEU  11 -14.386   2.807   7.139
   78   HD22  LEU  11          HD22      LEU  11 -15.117   2.842   5.535
   79   HD23  LEU  11          HD23      LEU  11 -13.411   3.239   5.735
   80    H    HIS  12           H        HIS  12 -13.015  -0.289   1.801
   81    HA   HIS  12           HA       HIS  12 -10.610  -1.755   2.481
   82    HB2  HIS  12           HB2      HIS  12 -12.679  -1.701   0.309
   83    HB3  HIS  12           HB3      HIS  12 -11.186  -2.587   0.003
   84    HD1  HIS  12           HD1      HIS  12 -13.424  -2.312   3.102
   85    HD2  HIS  12           HD2      HIS  12 -11.663  -5.213   0.681
   86    HE1  HIS  12           HE1      HIS  12 -14.017  -4.551   4.120
   87    H    LEU  13           H        LEU  13 -11.399   0.761   0.088
   88    HA   LEU  13           HA       LEU  13  -9.013   0.703  -1.464
   89    HB2  LEU  13           HB2      LEU  13 -11.295   1.986  -1.667
   90    HB3  LEU  13           HB3      LEU  13 -10.469   3.238  -0.737
   91    HG   LEU  13           HG       LEU  13  -8.557   2.810  -2.549
   92   HD11  LEU  13          HD11      LEU  13  -9.521   2.324  -4.749
   93   HD12  LEU  13          HD12      LEU  13 -11.120   2.135  -4.029
   94   HD13  LEU  13          HD13      LEU  13  -9.839   0.982  -3.650
   95   HD21  LEU  13          HD21      LEU  13 -11.062   4.483  -2.756
   96   HD22  LEU  13          HD22      LEU  13  -9.800   4.583  -3.983
   97   HD23  LEU  13          HD23      LEU  13  -9.434   4.992  -2.307
   98    H    HIS  14           H        HIS  14  -9.757   2.431   1.574
   99    HA   HIS  14           HA       HIS  14  -7.447   4.041   1.812
  100    HB2  HIS  14           HB2      HIS  14  -9.127   4.408   3.395
  101    HB3  HIS  14           HB3      HIS  14  -9.380   2.688   3.673
  102    HD1  HIS  14           HD1      HIS  14  -8.249   1.702   5.680
  103    HD2  HIS  14           HD2      HIS  14  -6.555   5.353   4.594
  104    HE1  HIS  14           HE1      HIS  14  -6.552   2.269   7.473
  105    H    GLN  15           H        GLN  15  -7.934   0.710   3.072
  106    HA   GLN  15           HA       GLN  15  -5.269   0.337   4.051
  107    HB2  GLN  15           HB2      GLN  15  -7.359  -1.001   4.548
  108    HB3  GLN  15           HB3      GLN  15  -7.198  -1.735   2.953
  109    HG2  GLN  15           HG2      GLN  15  -6.179  -3.201   4.620
  110    HG3  GLN  15           HG3      GLN  15  -4.920  -2.532   3.585
  111   HE21  GLN  15          HE21      GLN  15  -6.647  -1.270   6.515
  112   HE22  GLN  15          HE22      GLN  15  -5.223  -0.862   7.343
  113    H    ASN  16           H        ASN  16  -6.681  -0.111   0.827
  114    HA   ASN  16           HA       ASN  16  -4.443  -1.565  -0.306
  115    HB2  ASN  16           HB2      ASN  16  -6.945  -1.276  -1.035
  116    HB3  ASN  16           HB3      ASN  16  -6.363   0.181  -1.841
  117   HD21  ASN  16          HD21      ASN  16  -4.436  -0.182  -3.383
  118   HD22  ASN  16          HD22      ASN  16  -4.380  -1.651  -4.231
  119    H    ILE  17           H        ILE  17  -5.453   1.878  -0.471
  120    HA   ILE  17           HA       ILE  17  -3.149   2.727  -2.016
  121    HB   ILE  17           HB       ILE  17  -5.158   4.201  -0.278
  122   HG12  ILE  17          HG12      ILE  17  -6.182   3.010  -2.164
  123   HG13  ILE  17          HG13      ILE  17  -6.202   4.744  -2.474
  124   HG21  ILE  17          HG21      ILE  17  -4.400   6.095  -1.969
  125   HG22  ILE  17          HG22      ILE  17  -2.916   5.144  -2.034
  126   HG23  ILE  17          HG23      ILE  17  -3.479   5.795  -0.494
  127   HD11  ILE  17          HD11      ILE  17  -4.438   2.634  -3.707
  128   HD12  ILE  17          HD12      ILE  17  -3.943   4.327  -3.700
  129   HD13  ILE  17          HD13      ILE  17  -5.434   3.847  -4.511
  130    H    VAL  18           H        VAL  18  -3.933   2.775   1.475
  131    HA   VAL  18           HA       VAL  18  -1.634   4.232   2.353
  132    HB   VAL  18           HB       VAL  18  -3.482   2.183   3.598
  133   HG11  VAL  18          HG11      VAL  18  -1.175   3.681   4.864
  134   HG12  VAL  18          HG12      VAL  18  -1.472   1.942   4.877
  135   HG13  VAL  18          HG13      VAL  18  -2.515   3.022   5.803
  136   HG21  VAL  18          HG21      VAL  18  -4.356   4.163   4.764
  137   HG22  VAL  18          HG22      VAL  18  -4.385   4.424   3.021
  138   HG23  VAL  18          HG23      VAL  18  -3.126   5.171   4.004
  139    H    ASP  19           H        ASP  19  -2.076   0.846   1.495
  140    HA   ASP  19           HA       ASP  19   0.460  -0.072   2.615
  141    HB2  ASP  19           HB2      ASP  19  -1.872  -1.114   1.163
  142    HB3  ASP  19           HB3      ASP  19  -0.364  -1.883   0.673
  143    H    VAL  20           H        VAL  20  -0.434   1.600  -0.286
  144    HA   VAL  20           HA       VAL  20   2.065   0.735  -1.669
  145    HB   VAL  20           HB       VAL  20  -0.390   2.266  -2.593
  146   HG11  VAL  20          HG11      VAL  20   1.263   2.998  -4.063
  147   HG12  VAL  20          HG12      VAL  20   0.705   1.538  -4.881
  148   HG13  VAL  20          HG13      VAL  20   2.189   1.503  -3.927
  149   HG21  VAL  20          HG21      VAL  20   0.527  -0.538  -3.301
  150   HG22  VAL  20          HG22      VAL  20  -1.007   0.222  -3.726
  151   HG23  VAL  20          HG23      VAL  20  -0.666  -0.196  -2.047
  152    H    GLN  21           H        GLN  21   0.343   3.593  -0.472
  153    HA   GLN  21           HA       GLN  21   2.234   5.562  -1.393
  154    HB2  GLN  21           HB2      GLN  21  -0.226   5.704  -0.482
  155    HB3  GLN  21           HB3      GLN  21   0.558   5.839   1.093
  156    HG2  GLN  21           HG2      GLN  21   1.610   7.858   0.544
  157    HG3  GLN  21           HG3      GLN  21   1.472   7.570  -1.191
  158   HE21  GLN  21          HE21      GLN  21  -0.182   8.872   1.617
  159   HE22  GLN  21          HE22      GLN  21  -1.564   9.407   0.789
  160    H    TYR  22           H        TYR  22   2.017   3.626   1.596
  161    HA   TYR  22           HA       TYR  22   4.089   5.048   3.025
  162    HB2  TYR  22           HB2      TYR  22   3.528   3.552   4.675
  163    HB3  TYR  22           HB3      TYR  22   2.184   3.173   3.607
  164    HD1  TYR  22           HD1      TYR  22   5.628   2.135   4.580
  165    HD2  TYR  22           HD2      TYR  22   2.002   1.050   2.558
  166    HE1  TYR  22           HE1      TYR  22   6.439  -0.200   4.376
  167    HE2  TYR  22           HE2      TYR  22   2.810  -1.283   2.352
  168    HH   TYR  22           HH       TYR  22   4.560  -2.753   3.776
  169    H    MET  23           H        MET  23   4.098   2.263   0.816
  170    HA   MET  23           HA       MET  23   6.924   1.651   1.192
  171    HB2  MET  23           HB2      MET  23   4.942   0.158   0.440
  172    HB3  MET  23           HB3      MET  23   5.171   0.889  -1.149
  173    HG2  MET  23           HG2      MET  23   7.673  -0.040   0.088
  174    HG3  MET  23           HG3      MET  23   6.518  -1.334  -0.228
  175    HE1  MET  23           HE1      MET  23   8.206  -2.462  -2.130
  176    HE2  MET  23           HE2      MET  23   9.215  -1.257  -1.336
  177    HE3  MET  23           HE3      MET  23   9.199  -1.360  -3.094
  178    H    TYR  24           H        TYR  24   5.044   3.632  -1.076
  179    HA   TYR  24           HA       TYR  24   7.288   4.076  -2.898
  180    HB2  TYR  24           HB2      TYR  24   4.445   4.811  -2.601
  181    HB3  TYR  24           HB3      TYR  24   5.430   6.050  -3.375
  182    HD1  TYR  24           HD1      TYR  24   7.184   5.059  -5.168
  183    HD2  TYR  24           HD2      TYR  24   3.509   3.181  -3.972
  184    HE1  TYR  24           HE1      TYR  24   7.160   3.760  -7.279
  185    HE2  TYR  24           HE2      TYR  24   3.486   1.883  -6.085
  186    HH   TYR  24           HH       TYR  24   4.821   2.523  -8.649
  187    H    GLY  25           H        GLY  25   6.867   5.121   0.218
  188    HA2  GLY  25           HA2      GLY  25   7.941   6.810   1.444
  189    HA3  GLY  25           HA3      GLY  25   8.806   7.248  -0.032
  190    H    LEU  26           H        LEU  26   5.275   7.150   0.379
  191    HA   LEU  26           HA       LEU  26   5.235  10.089  -0.225
  192    HB2  LEU  26           HB2      LEU  26   3.838   7.717  -1.215
  193    HB3  LEU  26           HB3      LEU  26   2.726   9.007  -0.760
  194    HG   LEU  26           HG       LEU  26   4.222  10.584  -2.109
  195   HD11  LEU  26          HD11      LEU  26   5.438   7.914  -2.723
  196   HD12  LEU  26          HD12      LEU  26   6.223   9.478  -2.506
  197   HD13  LEU  26          HD13      LEU  26   5.366   9.122  -4.006
  198   HD21  LEU  26          HD21      LEU  26   2.962  10.188  -4.043
  199   HD22  LEU  26          HD22      LEU  26   1.996   9.380  -2.810
  200   HD23  LEU  26          HD23      LEU  26   3.051   8.437  -3.862
  201    H    SER  27           H        SER  27   5.070   8.276   2.450
  202    HA   SER  27           HA       SER  27   2.539   8.861   3.657
  203    HB2  SER  27           HB2      SER  27   4.680   7.362   4.297
  204    HB3  SER  27           HB3      SER  27   5.033   8.765   5.300
  205    HG   SER  27           HG       SER  27   3.744   7.435   6.499
  206    HA   PRO  28           HA       PRO  28   4.613  12.764   5.502
  207    HB2  PRO  28           HB2      PRO  28   7.039  13.556   4.522
  208    HB3  PRO  28           HB3      PRO  28   6.867  12.456   5.903
  209    HG2  PRO  28           HG2      PRO  28   7.499  11.846   3.064
  210    HG3  PRO  28           HG3      PRO  28   8.121  11.103   4.545
  211    HD2  PRO  28           HD2      PRO  28   6.197   9.977   2.964
  212    HD3  PRO  28           HD3      PRO  28   6.374   9.647   4.700
  213    H    ALA  29           H        ALA  29   5.231  12.113   2.092
  214    HA   ALA  29           HA       ALA  29   5.078  14.772   1.061
  215    HB1  ALA  29           HB1      ALA  29   4.173  12.176  -0.225
  216    HB2  ALA  29           HB2      ALA  29   5.862  12.667  -0.082
  217    HB3  ALA  29           HB3      ALA  29   4.745  13.625  -1.054
  218    H    ILE  30           H        ILE  30   2.544  12.583   2.162
  219    HA   ILE  30           HA       ILE  30   0.461  14.374   0.984
  220    HB   ILE  30           HB       ILE  30   0.330  11.588   2.181
  221   HG12  ILE  30          HG12      ILE  30   1.566  11.632   0.063
  222   HG13  ILE  30          HG13      ILE  30  -0.013  10.893  -0.188
  223   HG21  ILE  30          HG21      ILE  30  -1.758  13.248   0.737
  224   HG22  ILE  30          HG22      ILE  30  -1.805  12.747   2.427
  225   HG23  ILE  30          HG23      ILE  30  -1.940  11.543   1.146
  226   HD11  ILE  30          HD11      ILE  30  -0.861  13.145  -0.949
  227   HD12  ILE  30          HD12      ILE  30   0.366  12.443  -2.003
  228   HD13  ILE  30          HD13      ILE  30   0.802  13.728  -0.880
  229    H    THR  31           H        THR  31   1.702  13.162   4.065
  230    HA   THR  31           HA       THR  31  -0.513  14.343   5.605
  231    HB   THR  31           HB       THR  31   0.825  12.192   6.094
  232    HG1  THR  31           HG1      THR  31   0.502  12.503   8.257
  233   HG21  THR  31          HG21      THR  31   2.750  14.049   7.475
  234   HG22  THR  31          HG22      THR  31   3.040  13.545   5.810
  235   HG23  THR  31          HG23      THR  31   2.942  12.338   7.091
  236    H    LYS  32           H        LYS  32   2.817  15.207   4.738
  237    HA   LYS  32           HA       LYS  32   2.828  17.517   6.587
  238    HB2  LYS  32           HB2      LYS  32   4.758  15.884   5.876
  239    HB3  LYS  32           HB3      LYS  32   4.870  16.922   4.455
  240    HG2  LYS  32           HG2      LYS  32   4.690  18.683   6.645
  241    HG3  LYS  32           HG3      LYS  32   5.807  17.416   7.156
  242    HD2  LYS  32           HD2      LYS  32   7.373  17.961   5.566
  243    HD3  LYS  32           HD3      LYS  32   6.157  18.467   4.392
  244    HE2  LYS  32           HE2      LYS  32   5.995  20.619   5.280
  245    HE3  LYS  32           HE3      LYS  32   6.531  20.102   6.890
  246    HZ1  LYS  32           HZ1      LYS  32   8.729  19.717   6.057
  247    HZ2  LYS  32           HZ2      LYS  32   8.274  21.292   5.611
  248    HZ3  LYS  32           HZ3      LYS  32   8.247  20.041   4.462
  249    H    TYR  33           H        TYR  33   1.193  17.102   3.822
  250    HA   TYR  33           HA       TYR  33   1.907  19.785   2.690
  251    HB2  TYR  33           HB2      TYR  33   1.083  17.147   1.583
  252    HB3  TYR  33           HB3      TYR  33   0.446  18.572   0.762
  253    HD1  TYR  33           HD1      TYR  33   3.620  17.037   2.010
  254    HD2  TYR  33           HD2      TYR  33   1.803  19.825  -0.709
  255    HE1  TYR  33           HE1      TYR  33   5.808  17.379   0.899
  256    HE2  TYR  33           HE2      TYR  33   3.994  20.167  -1.820
  257    HH   TYR  33           HH       TYR  33   6.208  18.618  -2.036
  258    H    VAL  34           H        VAL  34  -0.811  17.663   3.640
  259    HA   VAL  34           HA       VAL  34  -2.757  19.842   3.176
  260    HB   VAL  34           HB       VAL  34  -3.045  17.007   4.246
  261   HG11  VAL  34          HG11      VAL  34  -5.458  17.511   3.307
  262   HG12  VAL  34          HG12      VAL  34  -4.995  19.191   3.574
  263   HG13  VAL  34          HG13      VAL  34  -5.016  18.058   4.924
  264   HG21  VAL  34          HG21      VAL  34  -3.897  16.548   1.939
  265   HG22  VAL  34          HG22      VAL  34  -2.200  17.027   1.951
  266   HG23  VAL  34          HG23      VAL  34  -3.441  18.188   1.477
  267    H    VAL  35           H        VAL  35  -3.041  17.709   5.974
  268    HA   VAL  35           HA       VAL  35  -3.548  18.298   8.212
  269    HB   VAL  35           HB       VAL  35  -1.062  17.979   7.893
  270   HG11  VAL  35          HG11      VAL  35  -0.352  19.865   6.656
  271   HG12  VAL  35          HG12      VAL  35   0.269  20.156   8.280
  272   HG13  VAL  35          HG13      VAL  35  -1.182  20.990   7.730
  273   HG21  VAL  35          HG21      VAL  35  -0.568  18.561  10.125
  274   HG22  VAL  35          HG22      VAL  35  -2.321  18.376  10.121
  275   HG23  VAL  35          HG23      VAL  35  -1.605  19.987  10.076
  276    H    ARG  36           H        ARG  36  -4.815  20.158   6.394
  277    HA   ARG  36           HA       ARG  36  -4.803  22.622   8.102
  278    HB2  ARG  36           HB2      ARG  36  -3.892  22.310   5.437
  279    HB3  ARG  36           HB3      ARG  36  -5.434  23.152   5.325
  280    HG2  ARG  36           HG2      ARG  36  -3.634  24.786   5.560
  281    HG3  ARG  36           HG3      ARG  36  -4.630  24.797   7.012
  282    HD2  ARG  36           HD2      ARG  36  -2.222  24.825   7.602
  283    HD3  ARG  36           HD3      ARG  36  -2.968  23.309   8.137
  284    HE   ARG  36           HE       ARG  36  -1.940  22.178   6.231
  285   HH11  ARG  36          HH11      ARG  36   0.012  24.402   7.547
  286   HH12  ARG  36          HH12      ARG  36   0.903  24.813   6.122
  287   HH21  ARG  36          HH21      ARG  36  -1.281  23.169   3.969
  288   HH22  ARG  36          HH22      ARG  36   0.168  24.111   4.087
  Start of MODEL    6
    1    HA   SER   1           HA       SER   1 -10.764  -3.183  14.251
    2    HB2  SER   1           HB2      SER   1 -10.915  -2.727  16.712
    3    HB3  SER   1           HB3      SER   1 -11.859  -1.284  16.354
    4    HG   SER   1           HG       SER   1 -13.531  -2.531  16.153
    5    H    ASP   2           H        ASP   2 -12.983  -3.007  13.314
    6    HA   ASP   2           HA       ASP   2 -13.756  -0.299  12.342
    7    HB2  ASP   2           HB2      ASP   2 -12.123  -1.719  10.817
    8    HB3  ASP   2           HB3      ASP   2 -13.602  -2.586  10.400
    9    H    LEU   3           H        LEU   3 -15.989  -0.134  11.961
   10    HA   LEU   3           HA       LEU   3 -17.665  -2.583  11.966
   11    HB2  LEU   3           HB2      LEU   3 -17.102  -1.786  14.338
   12    HB3  LEU   3           HB3      LEU   3 -18.085  -0.368  13.980
   13    HG   LEU   3           HG       LEU   3 -19.985  -1.911  13.399
   14   HD11  LEU   3          HD11      LEU   3 -17.879  -3.904  14.126
   15   HD12  LEU   3          HD12      LEU   3 -19.148  -4.005  12.904
   16   HD13  LEU   3          HD13      LEU   3 -19.539  -4.258  14.604
   17   HD21  LEU   3          HD21      LEU   3 -20.482  -2.514  15.763
   18   HD22  LEU   3          HD22      LEU   3 -19.863  -0.869  15.616
   19   HD23  LEU   3          HD23      LEU   3 -18.807  -2.161  16.186
   20    HA   PRO   4           HA       PRO   4 -19.429   0.838   9.469
   21    HB2  PRO   4           HB2      PRO   4 -19.119  -0.344   7.013
   22    HB3  PRO   4           HB3      PRO   4 -17.853   0.619   7.791
   23    HG2  PRO   4           HG2      PRO   4 -17.982  -2.259   7.354
   24    HG3  PRO   4           HG3      PRO   4 -16.594  -1.243   7.762
   25    HD2  PRO   4           HD2      PRO   4 -18.176  -2.918   9.501
   26    HD3  PRO   4           HD3      PRO   4 -16.702  -2.003   9.888
   27    H    ALA   5           H        ALA   5 -20.923  -0.100   7.161
   28    HA   ALA   5           HA       ALA   5 -22.681  -2.292   8.005
   29    HB1  ALA   5           HB1      ALA   5 -23.407  -0.391   9.410
   30    HB2  ALA   5           HB2      ALA   5 -24.654  -0.803   8.231
   31    HB3  ALA   5           HB3      ALA   5 -23.618   0.599   7.966
   32    H    LEU   6           H        LEU   6 -22.115  -3.076   5.896
   33    HA   LEU   6           HA       LEU   6 -22.466  -3.407   3.585
   34    HB2  LEU   6           HB2      LEU   6 -24.814  -2.385   4.747
   35    HB3  LEU   6           HB3      LEU   6 -24.590  -1.438   3.277
   36    HG   LEU   6           HG       LEU   6 -24.288  -4.434   3.212
   37   HD11  LEU   6          HD11      LEU   6 -26.881  -2.895   2.887
   38   HD12  LEU   6          HD12      LEU   6 -26.484  -3.931   4.257
   39   HD13  LEU   6          HD13      LEU   6 -26.665  -4.628   2.648
   40   HD21  LEU   6          HD21      LEU   6 -23.564  -3.266   1.230
   41   HD22  LEU   6          HD22      LEU   6 -25.018  -2.265   1.222
   42   HD23  LEU   6          HD23      LEU   6 -25.130  -3.987   0.858
   43    H    SER   7           H        SER   7 -20.598  -1.308   4.497
   44    HA   SER   7           HA       SER   7 -20.401   0.207   1.956
   45    HB2  SER   7           HB2      SER   7 -21.823   1.520   3.560
   46    HB3  SER   7           HB3      SER   7 -20.474   1.530   4.693
   47    HG   SER   7           HG       SER   7 -19.371   2.850   3.386
   48    H    THR   8           H        THR   8 -18.639  -1.671   2.291
   49    HA   THR   8           HA       THR   8 -16.300  -0.593   3.821
   50    HB   THR   8           HB       THR   8 -16.404  -3.353   2.656
   51    HG1  THR   8           HG1      THR   8 -17.862  -2.506   4.942
   52   HG21  THR   8          HG21      THR   8 -15.699  -2.950   5.473
   53   HG22  THR   8          HG22      THR   8 -14.711  -1.996   4.368
   54   HG23  THR   8          HG23      THR   8 -14.790  -3.748   4.188
   55    H    GLY   9           H        GLY   9 -17.407  -0.285   0.772
   56    HA2  GLY   9           HA2      GLY   9 -15.241  -1.202  -0.878
   57    HA3  GLY   9           HA3      GLY   9 -16.399   0.054  -1.322
   58    H    LEU  10           H        LEU  10 -15.994   2.079   0.363
   59    HA   LEU  10           HA       LEU  10 -13.540   3.296  -0.481
   60    HB2  LEU  10           HB2      LEU  10 -15.919   3.926   1.027
   61    HB3  LEU  10           HB3      LEU  10 -14.511   4.536   1.894
   62    HG   LEU  10           HG       LEU  10 -15.305   6.246   0.346
   63   HD11  LEU  10          HD11      LEU  10 -12.739   5.511   0.606
   64   HD12  LEU  10          HD12      LEU  10 -13.230   6.822  -0.467
   65   HD13  LEU  10          HD13      LEU  10 -12.922   5.215  -1.122
   66   HD21  LEU  10          HD21      LEU  10 -15.443   5.853  -2.048
   67   HD22  LEU  10          HD22      LEU  10 -16.414   4.631  -1.229
   68   HD23  LEU  10          HD23      LEU  10 -14.819   4.216  -1.856
   69    H    LEU  11           H        LEU  11 -14.447   1.556   2.488
   70    HA   LEU  11           HA       LEU  11 -12.206   2.157   4.126
   71    HB2  LEU  11           HB2      LEU  11 -14.461   0.710   4.367
   72    HB3  LEU  11           HB3      LEU  11 -13.336  -0.613   4.059
   73    HG   LEU  11           HG       LEU  11 -11.896   0.752   5.883
   74   HD11  LEU  11          HD11      LEU  11 -13.503   1.483   7.677
   75   HD12  LEU  11          HD12      LEU  11 -14.811   1.312   6.508
   76   HD13  LEU  11          HD13      LEU  11 -13.538   2.503   6.239
   77   HD21  LEU  11          HD21      LEU  11 -12.454  -0.969   7.380
   78   HD22  LEU  11          HD22      LEU  11 -12.883  -1.673   5.822
   79   HD23  LEU  11          HD23      LEU  11 -14.139  -1.003   6.863
   80    H    HIS  12           H        HIS  12 -12.646  -0.519   1.778
   81    HA   HIS  12           HA       HIS  12 -10.029  -1.668   2.065
   82    HB2  HIS  12           HB2      HIS  12 -12.232  -1.669   0.010
   83    HB3  HIS  12           HB3      HIS  12 -10.696  -2.445  -0.369
   84    HD1  HIS  12           HD1      HIS  12 -10.983  -4.895   0.009
   85    HD2  HIS  12           HD2      HIS  12 -12.840  -2.657   2.999
   86    HE1  HIS  12           HE1      HIS  12 -11.897  -6.557   1.688
   87    H    LEU  13           H        LEU  13 -11.328   0.856  -0.093
   88    HA   LEU  13           HA       LEU  13  -9.070   1.223  -1.790
   89    HB2  LEU  13           HB2      LEU  13 -11.504   2.177  -1.801
   90    HB3  LEU  13           HB3      LEU  13 -10.838   3.457  -0.788
   91    HG   LEU  13           HG       LEU  13  -9.011   3.677  -2.608
   92   HD11  LEU  13          HD11      LEU  13  -9.382   1.693  -3.887
   93   HD12  LEU  13          HD12      LEU  13  -9.964   3.020  -4.890
   94   HD13  LEU  13          HD13      LEU  13 -11.112   2.012  -4.011
   95   HD21  LEU  13          HD21      LEU  13 -10.662   5.410  -2.303
   96   HD22  LEU  13          HD22      LEU  13 -11.911   4.430  -3.071
   97   HD23  LEU  13          HD23      LEU  13 -10.578   5.071  -4.031
   98    H    HIS  14           H        HIS  14  -9.861   2.687   1.380
   99    HA   HIS  14           HA       HIS  14  -7.627   4.477   1.546
  100    HB2  HIS  14           HB2      HIS  14  -9.461   4.741   3.054
  101    HB3  HIS  14           HB3      HIS  14  -9.409   3.048   3.538
  102    HD1  HIS  14           HD1      HIS  14  -8.810   3.195   5.990
  103    HD2  HIS  14           HD2      HIS  14  -6.319   5.562   3.626
  104    HE1  HIS  14           HE1      HIS  14  -6.973   4.051   7.510
  105    H    GLN  15           H        GLN  15  -8.067   1.180   2.896
  106    HA   GLN  15           HA       GLN  15  -5.441   0.825   3.939
  107    HB2  GLN  15           HB2      GLN  15  -7.616  -0.555   4.187
  108    HB3  GLN  15           HB3      GLN  15  -7.149  -1.329   2.673
  109    HG2  GLN  15           HG2      GLN  15  -6.178  -2.758   4.242
  110    HG3  GLN  15           HG3      GLN  15  -4.838  -1.669   3.884
  111   HE21  GLN  15          HE21      GLN  15  -3.901  -0.657   5.674
  112   HE22  GLN  15          HE22      GLN  15  -4.632  -0.517   7.199
  113    H    ASN  16           H        ASN  16  -6.751   0.294   0.674
  114    HA   ASN  16           HA       ASN  16  -4.515  -1.054  -0.485
  115    HB2  ASN  16           HB2      ASN  16  -7.036  -0.085  -1.236
  116    HB3  ASN  16           HB3      ASN  16  -5.909   0.792  -2.270
  117   HD21  ASN  16          HD21      ASN  16  -3.909  -1.072  -2.772
  118   HD22  ASN  16          HD22      ASN  16  -4.558  -2.441  -3.535
  119    H    ILE  17           H        ILE  17  -5.287   2.446  -0.323
  120    HA   ILE  17           HA       ILE  17  -2.858   3.270  -1.701
  121    HB   ILE  17           HB       ILE  17  -4.896   4.683   0.058
  122   HG12  ILE  17          HG12      ILE  17  -4.552   5.054  -2.906
  123   HG13  ILE  17          HG13      ILE  17  -5.409   3.633  -2.313
  124   HG21  ILE  17          HG21      ILE  17  -2.759   5.915   0.073
  125   HG22  ILE  17          HG22      ILE  17  -3.972   6.785  -0.865
  126   HG23  ILE  17          HG23      ILE  17  -2.712   5.865  -1.689
  127   HD11  ILE  17          HD11      ILE  17  -7.136   5.203  -2.564
  128   HD12  ILE  17          HD12      ILE  17  -6.133   6.537  -1.996
  129   HD13  ILE  17          HD13      ILE  17  -6.738   5.339  -0.852
  130    H    VAL  18           H        VAL  18  -3.825   2.933   1.708
  131    HA   VAL  18           HA       VAL  18  -1.361   4.055   2.788
  132    HB   VAL  18           HB       VAL  18  -3.682   2.438   3.873
  133   HG11  VAL  18          HG11      VAL  18  -2.820   3.192   6.139
  134   HG12  VAL  18          HG12      VAL  18  -1.307   3.617   5.338
  135   HG13  VAL  18          HG13      VAL  18  -1.856   1.940   5.355
  136   HG21  VAL  18          HG21      VAL  18  -4.014   4.735   5.046
  137   HG22  VAL  18          HG22      VAL  18  -4.412   4.614   3.333
  138   HG23  VAL  18          HG23      VAL  18  -2.889   5.347   3.835
  139    H    ASP  19           H        ASP  19  -1.973   1.145   1.221
  140    HA   ASP  19           HA       ASP  19   0.260  -0.238   2.668
  141    HB2  ASP  19           HB2      ASP  19  -2.178  -1.122   2.743
  142    HB3  ASP  19           HB3      ASP  19  -1.923  -1.568   1.055
  143    H    VAL  20           H        VAL  20  -0.326   1.466  -0.110
  144    HA   VAL  20           HA       VAL  20   1.170  -0.396  -1.895
  145    HB   VAL  20           HB       VAL  20  -1.059   0.715  -2.511
  146   HG11  VAL  20          HG11      VAL  20  -0.202   2.980  -1.556
  147   HG12  VAL  20          HG12      VAL  20  -1.127   3.006  -3.056
  148   HG13  VAL  20          HG13      VAL  20   0.630   3.143  -3.101
  149   HG21  VAL  20          HG21      VAL  20   0.353  -0.288  -4.215
  150   HG22  VAL  20          HG22      VAL  20   1.393   1.136  -4.244
  151   HG23  VAL  20          HG23      VAL  20  -0.266   1.243  -4.830
  152    H    GLN  21           H        GLN  21   1.398   2.762  -0.350
  153    HA   GLN  21           HA       GLN  21   3.988   3.317  -1.705
  154    HB2  GLN  21           HB2      GLN  21   1.786   4.802  -0.486
  155    HB3  GLN  21           HB3      GLN  21   3.349   5.355   0.118
  156    HG2  GLN  21           HG2      GLN  21   2.926   4.931  -2.835
  157    HG3  GLN  21           HG3      GLN  21   2.421   6.436  -2.063
  158   HE21  GLN  21          HE21      GLN  21   4.214   7.551  -0.711
  159   HE22  GLN  21          HE22      GLN  21   5.804   7.443  -1.297
  160    H    TYR  22           H        TYR  22   3.126   1.485   0.860
  161    HA   TYR  22           HA       TYR  22   5.595   2.194   2.405
  162    HB2  TYR  22           HB2      TYR  22   3.021   1.219   3.664
  163    HB3  TYR  22           HB3      TYR  22   4.356   2.078   4.431
  164    HD1  TYR  22           HD1      TYR  22   4.618   4.506   4.165
  165    HD2  TYR  22           HD2      TYR  22   1.383   2.399   2.286
  166    HE1  TYR  22           HE1      TYR  22   3.497   6.661   3.669
  167    HE2  TYR  22           HE2      TYR  22   0.261   4.551   1.795
  168    HH   TYR  22           HH       TYR  22   0.894   7.329   3.255
  169    H    MET  23           H        MET  23   3.068  -0.302   1.900
  170    HA   MET  23           HA       MET  23   4.751  -2.492   2.823
  171    HB2  MET  23           HB2      MET  23   2.043  -1.994   2.132
  172    HB3  MET  23           HB3      MET  23   2.599  -3.271   1.050
  173    HG2  MET  23           HG2      MET  23   3.138  -3.370   4.020
  174    HG3  MET  23           HG3      MET  23   1.646  -4.003   3.327
  175    HE1  MET  23           HE1      MET  23   2.713  -6.113   4.763
  176    HE2  MET  23           HE2      MET  23   3.002  -7.431   3.630
  177    HE3  MET  23           HE3      MET  23   1.572  -6.418   3.445
  178    H    TYR  24           H        TYR  24   4.047  -0.973  -0.303
  179    HA   TYR  24           HA       TYR  24   5.457  -3.059  -1.836
  180    HB2  TYR  24           HB2      TYR  24   3.549  -1.006  -2.277
  181    HB3  TYR  24           HB3      TYR  24   4.954  -0.600  -3.261
  182    HD1  TYR  24           HD1      TYR  24   6.032  -2.663  -4.560
  183    HD2  TYR  24           HD2      TYR  24   1.979  -2.491  -3.141
  184    HE1  TYR  24           HE1      TYR  24   5.383  -4.408  -6.197
  185    HE2  TYR  24           HE2      TYR  24   1.333  -4.237  -4.779
  186    HH   TYR  24           HH       TYR  24   3.059  -6.262  -6.083
  187    H    GLY  25           H        GLY  25   6.611  -0.696   0.162
  188    HA2  GLY  25           HA2      GLY  25   8.700   0.388  -1.597
  189    HA3  GLY  25           HA3      GLY  25   8.513   0.727   0.124
  190    H    LEU  26           H        LEU  26   8.407  -2.033   0.986
  191    HA   LEU  26           HA       LEU  26   9.876  -3.730   1.699
  192    HB2  LEU  26           HB2      LEU  26  10.492  -3.204  -1.186
  193    HB3  LEU  26           HB3      LEU  26  11.563  -4.284  -0.294
  194    HG   LEU  26           HG       LEU  26   9.060  -5.155   0.487
  195   HD11  LEU  26          HD11      LEU  26   8.985  -4.343  -2.435
  196   HD12  LEU  26          HD12      LEU  26   7.915  -3.777  -1.153
  197   HD13  LEU  26          HD13      LEU  26   7.839  -5.456  -1.687
  198   HD21  LEU  26          HD21      LEU  26  10.735  -6.731  -0.047
  199   HD22  LEU  26          HD22      LEU  26  10.998  -6.043  -1.649
  200   HD23  LEU  26          HD23      LEU  26   9.533  -6.966  -1.316
  201    H    SER  27           H        SER  27  10.613  -0.937   2.335
  202    HA   SER  27           HA       SER  27  13.587  -0.986   2.190
  203    HB2  SER  27           HB2      SER  27  11.456   1.026   2.350
  204    HB3  SER  27           HB3      SER  27  12.795   1.356   3.445
  205    HG   SER  27           HG       SER  27  13.082   2.204   1.299
  206    HA   PRO  28           HA       PRO  28  12.976  -0.567   6.911
  207    HB2  PRO  28           HB2      PRO  28  10.435  -0.656   7.940
  208    HB3  PRO  28           HB3      PRO  28  11.245   0.854   7.475
  209    HG2  PRO  28           HG2      PRO  28   9.240  -0.757   5.968
  210    HG3  PRO  28           HG3      PRO  28   9.366   1.000   6.150
  211    HD2  PRO  28           HD2      PRO  28  10.190  -0.285   3.927
  212    HD3  PRO  28           HD3      PRO  28  10.984   1.188   4.523
  213    H    ALA  29           H        ALA  29  10.835  -2.662   5.096
  214    HA   ALA  29           HA       ALA  29  10.540  -4.783   7.017
  215    HB1  ALA  29           HB1      ALA  29   9.100  -4.629   5.094
  216    HB2  ALA  29           HB2      ALA  29  10.061  -6.093   4.880
  217    HB3  ALA  29           HB3      ALA  29  10.476  -4.627   3.991
  218    H    ILE  30           H        ILE  30  13.082  -3.981   4.676
  219    HA   ILE  30           HA       ILE  30  14.562  -6.480   5.346
  220    HB   ILE  30           HB       ILE  30  14.934  -4.298   3.265
  221   HG12  ILE  30          HG12      ILE  30  14.137  -7.206   2.924
  222   HG13  ILE  30          HG13      ILE  30  12.974  -5.883   3.013
  223   HG21  ILE  30          HG21      ILE  30  16.611  -5.861   2.274
  224   HG22  ILE  30          HG22      ILE  30  16.460  -6.885   3.702
  225   HG23  ILE  30          HG23      ILE  30  17.106  -5.251   3.853
  226   HD11  ILE  30          HD11      ILE  30  13.407  -6.329   0.675
  227   HD12  ILE  30          HD12      ILE  30  15.149  -6.260   0.937
  228   HD13  ILE  30          HD13      ILE  30  14.176  -4.796   1.083
  229    H    THR  31           H        THR  31  14.936  -2.941   5.367
  230    HA   THR  31           HA       THR  31  17.587  -2.839   6.452
  231    HB   THR  31           HB       THR  31  15.273  -0.886   6.714
  232    HG1  THR  31           HG1      THR  31  17.221  -1.299   4.696
  233   HG21  THR  31          HG21      THR  31  16.900   0.000   8.109
  234   HG22  THR  31          HG22      THR  31  17.384   0.700   6.564
  235   HG23  THR  31          HG23      THR  31  18.225  -0.717   7.193
  236    H    LYS  32           H        LYS  32  14.380  -2.945   8.035
  237    HA   LYS  32           HA       LYS  32  15.609  -2.786  10.724
  238    HB2  LYS  32           HB2      LYS  32  13.289  -1.888   9.676
  239    HB3  LYS  32           HB3      LYS  32  12.734  -3.445  10.292
  240    HG2  LYS  32           HG2      LYS  32  13.310  -2.906  12.517
  241    HG3  LYS  32           HG3      LYS  32  14.368  -1.587  12.016
  242    HD2  LYS  32           HD2      LYS  32  12.547  -0.184  11.449
  243    HD3  LYS  32           HD3      LYS  32  11.407  -1.530  11.432
  244    HE2  LYS  32           HE2      LYS  32  12.197  -1.743  13.988
  245    HE3  LYS  32           HE3      LYS  32  12.499  -0.009  13.763
  246    HZ1  LYS  32           HZ1      LYS  32  10.212  -0.338  14.408
  247    HZ2  LYS  32           HZ2      LYS  32   9.971  -1.452  13.148
  248    HZ3  LYS  32           HZ3      LYS  32  10.261   0.184  12.795
  249    H    TYR  33           H        TYR  33  15.743  -5.207   8.654
  250    HA   TYR  33           HA       TYR  33  14.752  -7.344  10.496
  251    HB2  TYR  33           HB2      TYR  33  14.174  -7.018   7.942
  252    HB3  TYR  33           HB3      TYR  33  15.754  -7.757   7.689
  253    HD1  TYR  33           HD1      TYR  33  12.406  -8.252   9.214
  254    HD2  TYR  33           HD2      TYR  33  16.124 -10.088   8.097
  255    HE1  TYR  33           HE1      TYR  33  11.427 -10.490   9.636
  256    HE2  TYR  33           HE2      TYR  33  15.145 -12.327   8.519
  257    HH   TYR  33           HH       TYR  33  12.287 -13.111   8.518
  258    H    VAL  34           H        VAL  34  17.596  -6.377   8.542
  259    HA   VAL  34           HA       VAL  34  19.288  -8.459   9.759
  260    HB   VAL  34           HB       VAL  34  19.999  -6.100   7.978
  261   HG11  VAL  34          HG11      VAL  34  21.815  -7.758   7.261
  262   HG12  VAL  34          HG12      VAL  34  21.362  -8.712   8.673
  263   HG13  VAL  34          HG13      VAL  34  21.986  -7.076   8.878
  264   HG21  VAL  34          HG21      VAL  34  18.964  -8.872   7.326
  265   HG22  VAL  34          HG22      VAL  34  19.845  -7.894   6.151
  266   HG23  VAL  34          HG23      VAL  34  18.310  -7.320   6.802
  267    H    VAL  35           H        VAL  35  18.627  -7.383  11.975
  268    HA   VAL  35           HA       VAL  35  20.706  -5.332  12.675
  269    HB   VAL  35           HB       VAL  35  17.896  -5.611  13.803
  270   HG11  VAL  35          HG11      VAL  35  20.179  -3.693  14.218
  271   HG12  VAL  35          HG12      VAL  35  19.172  -4.493  15.424
  272   HG13  VAL  35          HG13      VAL  35  18.517  -3.161  14.473
  273   HG21  VAL  35          HG21      VAL  35  17.548  -4.873  11.582
  274   HG22  VAL  35          HG22      VAL  35  19.023  -3.905  11.578
  275   HG23  VAL  35          HG23      VAL  35  17.622  -3.373  12.506
  276    H    ARG  36           H        ARG  36  21.591  -7.798  12.984
  277    HA   ARG  36           HA       ARG  36  21.084  -8.529  15.851
  278    HB2  ARG  36           HB2      ARG  36  20.243 -10.091  14.025
  279    HB3  ARG  36           HB3      ARG  36  21.930 -10.357  13.585
  280    HG2  ARG  36           HG2      ARG  36  21.620 -12.108  15.073
  281    HG3  ARG  36           HG3      ARG  36  22.185 -10.858  16.180
  282    HD2  ARG  36           HD2      ARG  36  19.232 -11.120  15.619
  283    HD3  ARG  36           HD3      ARG  36  20.010 -12.186  16.804
  284    HE   ARG  36           HE       ARG  36  19.655  -9.281  17.083
  285   HH11  ARG  36          HH11      ARG  36  19.263 -11.181  19.342
  286   HH12  ARG  36          HH12      ARG  36  20.702 -10.954  20.280
  287   HH21  ARG  36          HH21      ARG  36  22.441  -9.376  17.712
  288   HH22  ARG  36          HH22      ARG  36  22.507  -9.930  19.353
  Start of MODEL    7
    1    HA   SER   1           HA       SER   1 -30.034  -2.616   2.816
    2    HB2  SER   1           HB2      SER   1 -31.737  -3.914   1.272
    3    HB3  SER   1           HB3      SER   1 -32.268  -3.317   2.839
    4    HG   SER   1           HG       SER   1 -33.327  -2.774   0.531
    5    H    ASP   2           H        ASP   2 -28.149  -2.796   1.664
    6    HA   ASP   2           HA       ASP   2 -28.294  -2.607  -1.324
    7    HB2  ASP   2           HB2      ASP   2 -26.372  -1.337   0.646
    8    HB3  ASP   2           HB3      ASP   2 -25.990  -1.491  -1.069
    9    H    LEU   3           H        LEU   3 -25.828  -3.358  -2.043
   10    HA   LEU   3           HA       LEU   3 -25.696  -6.168  -1.599
   11    HB2  LEU   3           HB2      LEU   3 -24.380  -4.134  -3.120
   12    HB3  LEU   3           HB3      LEU   3 -23.135  -5.117  -2.354
   13    HG   LEU   3           HG       LEU   3 -23.775  -6.033  -4.560
   14   HD11  LEU   3          HD11      LEU   3 -23.056  -7.541  -2.698
   15   HD12  LEU   3          HD12      LEU   3 -24.139  -8.330  -3.844
   16   HD13  LEU   3          HD13      LEU   3 -24.753  -7.783  -2.285
   17   HD21  LEU   3          HD21      LEU   3 -25.982  -6.769  -5.047
   18   HD22  LEU   3          HD22      LEU   3 -26.195  -5.180  -4.313
   19   HD23  LEU   3          HD23      LEU   3 -26.485  -6.637  -3.361
   20    HA   PRO   4           HA       PRO   4 -22.269  -5.451   1.562
   21    HB2  PRO   4           HB2      PRO   4 -21.364  -2.921   2.088
   22    HB3  PRO   4           HB3      PRO   4 -20.768  -3.899   0.738
   23    HG2  PRO   4           HG2      PRO   4 -22.488  -1.542   0.704
   24    HG3  PRO   4           HG3      PRO   4 -21.538  -2.264  -0.598
   25    HD2  PRO   4           HD2      PRO   4 -24.356  -2.501  -0.098
   26    HD3  PRO   4           HD3      PRO   4 -23.416  -3.171  -1.448
   27    H    ALA   5           H        ALA   5 -21.931  -3.591   3.727
   28    HA   ALA   5           HA       ALA   5 -24.715  -3.350   4.823
   29    HB1  ALA   5           HB1      ALA   5 -23.800  -5.279   5.840
   30    HB2  ALA   5           HB2      ALA   5 -23.479  -4.009   7.020
   31    HB3  ALA   5           HB3      ALA   5 -22.192  -4.564   5.950
   32    H    LEU   6           H        LEU   6 -21.335  -2.450   5.669
   33    HA   LEU   6           HA       LEU   6 -22.346   0.277   6.415
   34    HB2  LEU   6           HB2      LEU   6 -20.946  -1.640   7.853
   35    HB3  LEU   6           HB3      LEU   6 -19.671  -0.543   7.320
   36    HG   LEU   6           HG       LEU   6 -22.210   0.560   8.501
   37   HD11  LEU   6          HD11      LEU   6 -21.072   0.546  10.718
   38   HD12  LEU   6          HD12      LEU   6 -19.784  -0.440  10.024
   39   HD13  LEU   6          HD13      LEU   6 -21.424  -1.081  10.135
   40   HD21  LEU   6          HD21      LEU   6 -19.321   1.472   8.326
   41   HD22  LEU   6          HD22      LEU   6 -20.576   2.346   9.206
   42   HD23  LEU   6          HD23      LEU   6 -20.700   2.147   7.458
   43    H    SER   7           H        SER   7 -21.750  -0.407   3.673
   44    HA   SER   7           HA       SER   7 -20.512   0.373   1.827
   45    HB2  SER   7           HB2      SER   7 -21.209   2.466   3.194
   46    HB3  SER   7           HB3      SER   7 -19.531   2.510   3.729
   47    HG   SER   7           HG       SER   7 -20.271   3.667   1.673
   48    H    THR   8           H        THR   8 -19.141  -1.655   2.333
   49    HA   THR   8           HA       THR   8 -16.499  -1.146   3.550
   50    HB   THR   8           HB       THR   8 -17.287  -3.634   2.048
   51    HG1  THR   8           HG1      THR   8 -18.721  -4.173   3.520
   52   HG21  THR   8          HG21      THR   8 -15.789  -4.683   3.464
   53   HG22  THR   8          HG22      THR   8 -16.064  -3.535   4.775
   54   HG23  THR   8          HG23      THR   8 -15.068  -3.076   3.395
   55    H    GLY   9           H        GLY   9 -17.025   0.451   1.198
   56    HA2  GLY   9           HA2      GLY   9 -15.268  -0.811  -0.860
   57    HA3  GLY   9           HA3      GLY   9 -16.385   0.521  -1.170
   58    H    LEU  10           H        LEU  10 -15.852   2.339   0.750
   59    HA   LEU  10           HA       LEU  10 -13.418   3.593  -0.090
   60    HB2  LEU  10           HB2      LEU  10 -15.628   4.019   1.797
   61    HB3  LEU  10           HB3      LEU  10 -14.102   4.692   2.372
   62    HG   LEU  10           HG       LEU  10 -15.011   5.170  -0.459
   63   HD11  LEU  10          HD11      LEU  10 -16.882   5.905   0.908
   64   HD12  LEU  10          HD12      LEU  10 -15.987   7.327   0.370
   65   HD13  LEU  10          HD13      LEU  10 -15.792   6.733   2.019
   66   HD21  LEU  10          HD21      LEU  10 -13.194   6.578   1.517
   67   HD22  LEU  10          HD22      LEU  10 -13.662   7.279  -0.032
   68   HD23  LEU  10          HD23      LEU  10 -12.728   5.784   0.013
   69    H    LEU  11           H        LEU  11 -14.210   1.698   2.845
   70    HA   LEU  11           HA       LEU  11 -11.733   2.025   4.222
   71    HB2  LEU  11           HB2      LEU  11 -13.926   1.022   5.032
   72    HB3  LEU  11           HB3      LEU  11 -13.505  -0.440   4.141
   73    HG   LEU  11           HG       LEU  11 -11.284  -0.386   5.453
   74   HD11  LEU  11          HD11      LEU  11 -11.612   0.744   7.727
   75   HD12  LEU  11          HD12      LEU  11 -12.952   1.621   6.984
   76   HD13  LEU  11          HD13      LEU  11 -11.313   1.822   6.362
   77   HD21  LEU  11          HD21      LEU  11 -13.833  -0.811   7.043
   78   HD22  LEU  11          HD22      LEU  11 -12.276  -1.595   7.311
   79   HD23  LEU  11          HD23      LEU  11 -13.207  -1.959   5.858
   80    H    HIS  12           H        HIS  12 -12.755  -0.418   1.816
   81    HA   HIS  12           HA       HIS  12 -10.319  -1.952   1.821
   82    HB2  HIS  12           HB2      HIS  12 -12.681  -1.539   0.001
   83    HB3  HIS  12           HB3      HIS  12 -11.304  -2.474  -0.583
   84    HD1  HIS  12           HD1      HIS  12 -12.358  -4.797  -0.471
   85    HD2  HIS  12           HD2      HIS  12 -12.629  -2.733   3.143
   86    HE1  HIS  12           HE1      HIS  12 -13.182  -6.465   1.248
   87    H    LEU  13           H        LEU  13 -11.459   0.744  -0.246
   88    HA   LEU  13           HA       LEU  13  -9.113   0.867  -1.923
   89    HB2  LEU  13           HB2      LEU  13 -11.636   2.030  -1.770
   90    HB3  LEU  13           HB3      LEU  13 -10.558   3.384  -1.442
   91    HG   LEU  13           HG       LEU  13 -10.944   3.239  -3.844
   92   HD11  LEU  13          HD11      LEU  13  -8.192   2.079  -3.409
   93   HD12  LEU  13          HD12      LEU  13  -8.597   3.707  -2.867
   94   HD13  LEU  13          HD13      LEU  13  -8.699   3.296  -4.580
   95   HD21  LEU  13          HD21      LEU  13 -11.526   0.799  -3.844
   96   HD22  LEU  13          HD22      LEU  13  -9.810   0.430  -3.670
   97   HD23  LEU  13          HD23      LEU  13 -10.394   1.241  -5.122
   98    H    HIS  14           H        HIS  14  -9.977   2.358   1.181
   99    HA   HIS  14           HA       HIS  14  -7.862   4.285   1.352
  100    HB2  HIS  14           HB2      HIS  14  -9.780   4.361   2.817
  101    HB3  HIS  14           HB3      HIS  14  -9.491   2.717   3.379
  102    HD1  HIS  14           HD1      HIS  14  -8.956   3.102   5.819
  103    HD2  HIS  14           HD2      HIS  14  -6.744   5.596   3.314
  104    HE1  HIS  14           HE1      HIS  14  -7.272   4.287   7.290
  105    H    GLN  15           H        GLN  15  -8.071   0.954   2.698
  106    HA   GLN  15           HA       GLN  15  -5.400   0.847   3.726
  107    HB2  GLN  15           HB2      GLN  15  -7.696  -0.859   3.350
  108    HB3  GLN  15           HB3      GLN  15  -6.245  -1.737   2.867
  109    HG2  GLN  15           HG2      GLN  15  -6.351  -2.170   5.170
  110    HG3  GLN  15           HG3      GLN  15  -5.238  -0.805   5.093
  111   HE21  GLN  15          HE21      GLN  15  -5.983   1.269   5.899
  112   HE22  GLN  15          HE22      GLN  15  -7.442   1.428   6.752
  113    H    ASN  16           H        ASN  16  -6.736   0.108   0.516
  114    HA   ASN  16           HA       ASN  16  -4.470  -1.150  -0.663
  115    HB2  ASN  16           HB2      ASN  16  -6.571  -1.202  -1.776
  116    HB3  ASN  16           HB3      ASN  16  -6.769   0.544  -1.659
  117   HD21  ASN  16          HD21      ASN  16  -4.073  -1.529  -2.911
  118   HD22  ASN  16          HD22      ASN  16  -3.989  -0.746  -4.414
  119    H    ILE  17           H        ILE  17  -5.342   2.319  -0.461
  120    HA   ILE  17           HA       ILE  17  -2.890   3.163  -1.844
  121    HB   ILE  17           HB       ILE  17  -5.168   4.563  -0.403
  122   HG12  ILE  17          HG12      ILE  17  -4.448   4.683  -3.336
  123   HG13  ILE  17          HG13      ILE  17  -5.427   3.364  -2.694
  124   HG21  ILE  17          HG21      ILE  17  -3.393   6.104  -0.153
  125   HG22  ILE  17          HG22      ILE  17  -4.178   6.617  -1.647
  126   HG23  ILE  17          HG23      ILE  17  -2.685   5.679  -1.713
  127   HD11  ILE  17          HD11      ILE  17  -7.077   4.950  -1.844
  128   HD12  ILE  17          HD12      ILE  17  -6.815   5.246  -3.563
  129   HD13  ILE  17          HD13      ILE  17  -6.078   6.308  -2.364
  130    H    VAL  18           H        VAL  18  -3.930   2.709   1.493
  131    HA   VAL  18           HA       VAL  18  -1.672   4.246   2.607
  132    HB   VAL  18           HB       VAL  18  -3.923   2.550   3.716
  133   HG11  VAL  18          HG11      VAL  18  -1.686   3.970   5.185
  134   HG12  VAL  18          HG12      VAL  18  -2.131   2.267   5.295
  135   HG13  VAL  18          HG13      VAL  18  -3.202   3.503   5.957
  136   HG21  VAL  18          HG21      VAL  18  -4.629   4.708   2.886
  137   HG22  VAL  18          HG22      VAL  18  -3.285   5.513   3.695
  138   HG23  VAL  18          HG23      VAL  18  -4.590   4.806   4.646
  139    H    ASP  19           H        ASP  19  -2.051   1.131   1.333
  140    HA   ASP  19           HA       ASP  19   0.306   0.137   2.902
  141    HB2  ASP  19           HB2      ASP  19  -2.285  -0.897   2.728
  142    HB3  ASP  19           HB3      ASP  19  -1.360  -1.893   1.606
  143    H    VAL  20           H        VAL  20   0.263   1.716   0.367
  144    HA   VAL  20           HA       VAL  20   1.496  -0.319  -1.458
  145    HB   VAL  20           HB       VAL  20  -0.706   0.585  -2.224
  146   HG11  VAL  20          HG11      VAL  20   0.656   3.248  -2.594
  147   HG12  VAL  20          HG12      VAL  20  -0.228   2.881  -1.114
  148   HG13  VAL  20          HG13      VAL  20  -1.065   2.869  -2.664
  149   HG21  VAL  20          HG21      VAL  20   1.633   1.587  -3.871
  150   HG22  VAL  20          HG22      VAL  20   0.026   1.177  -4.471
  151   HG23  VAL  20          HG23      VAL  20   1.080  -0.086  -3.836
  152    H    GLN  21           H        GLN  21   1.545   3.105  -0.476
  153    HA   GLN  21           HA       GLN  21   4.111   3.647  -1.768
  154    HB2  GLN  21           HB2      GLN  21   2.113   5.050  -0.019
  155    HB3  GLN  21           HB3      GLN  21   3.735   5.738  -0.155
  156    HG2  GLN  21           HG2      GLN  21   3.501   5.651  -2.655
  157    HG3  GLN  21           HG3      GLN  21   1.829   5.136  -2.436
  158   HE21  GLN  21          HE21      GLN  21   4.069   7.853  -1.738
  159   HE22  GLN  21          HE22      GLN  21   2.850   9.026  -1.612
  160    H    TYR  22           H        TYR  22   3.130   2.182   1.169
  161    HA   TYR  22           HA       TYR  22   5.716   2.785   2.533
  162    HB2  TYR  22           HB2      TYR  22   3.279   1.366   3.644
  163    HB3  TYR  22           HB3      TYR  22   4.542   2.211   4.537
  164    HD1  TYR  22           HD1      TYR  22   1.522   2.592   2.472
  165    HD2  TYR  22           HD2      TYR  22   4.595   4.669   4.636
  166    HE1  TYR  22           HE1      TYR  22   0.203   4.682   2.328
  167    HE2  TYR  22           HE2      TYR  22   3.273   6.761   4.496
  168    HH   TYR  22           HH       TYR  22   0.571   7.217   4.207
  169    H    MET  23           H        MET  23   3.837   0.222   1.029
  170    HA   MET  23           HA       MET  23   5.467  -1.963   2.109
  171    HB2  MET  23           HB2      MET  23   3.974  -3.332   0.847
  172    HB3  MET  23           HB3      MET  23   2.992  -1.976   1.388
  173    HG2  MET  23           HG2      MET  23   2.407  -1.815  -0.802
  174    HG3  MET  23           HG3      MET  23   3.967  -1.019  -0.990
  175    HE1  MET  23           HE1      MET  23   2.756  -2.432  -3.622
  176    HE2  MET  23           HE2      MET  23   1.713  -3.117  -2.377
  177    HE3  MET  23           HE3      MET  23   2.592  -4.187  -3.468
  178    H    TYR  24           H        TYR  24   5.635   0.208  -0.630
  179    HA   TYR  24           HA       TYR  24   7.735  -1.509  -1.903
  180    HB2  TYR  24           HB2      TYR  24   5.453  -0.162  -2.870
  181    HB3  TYR  24           HB3      TYR  24   6.830   0.779  -3.444
  182    HD1  TYR  24           HD1      TYR  24   8.823  -0.606  -4.458
  183    HD2  TYR  24           HD2      TYR  24   4.810  -2.080  -4.042
  184    HE1  TYR  24           HE1      TYR  24   9.275  -2.323  -6.188
  185    HE2  TYR  24           HE2      TYR  24   5.263  -3.798  -5.772
  186    HH   TYR  24           HH       TYR  24   7.331  -3.751  -7.911
  187    H    GLY  25           H        GLY  25   7.919   0.598   0.421
  188    HA2  GLY  25           HA2      GLY  25   9.582   2.711  -0.745
  189    HA3  GLY  25           HA3      GLY  25   9.266   2.470   0.973
  190    H    LEU  26           H        LEU  26  10.092  -0.274   1.117
  191    HA   LEU  26           HA       LEU  26  12.029  -1.550   1.502
  192    HB2  LEU  26           HB2      LEU  26  12.321  -0.186  -1.102
  193    HB3  LEU  26           HB3      LEU  26  13.837  -0.754  -0.406
  194    HG   LEU  26           HG       LEU  26  12.450  -2.959   0.044
  195   HD11  LEU  26          HD11      LEU  26  10.913  -1.526  -2.132
  196   HD12  LEU  26          HD12      LEU  26  10.282  -2.261  -0.658
  197   HD13  LEU  26          HD13      LEU  26  10.883  -3.282  -1.966
  198   HD21  LEU  26          HD21      LEU  26  13.115  -3.737  -2.273
  199   HD22  LEU  26          HD22      LEU  26  14.403  -2.935  -1.374
  200   HD23  LEU  26          HD23      LEU  26  13.537  -2.065  -2.641
  201    H    SER  27           H        SER  27  11.779   1.251   2.732
  202    HA   SER  27           HA       SER  27  14.435   2.394   2.863
  203    HB2  SER  27           HB2      SER  27  11.804   2.683   4.234
  204    HB3  SER  27           HB3      SER  27  13.214   3.292   5.096
  205    HG   SER  27           HG       SER  27  12.649   4.953   3.826
  206    HA   PRO  28           HA       PRO  28  14.805   0.046   7.022
  207    HB2  PRO  28           HB2      PRO  28  12.920  -1.840   7.639
  208    HB3  PRO  28           HB3      PRO  28  12.777  -0.136   8.117
  209    HG2  PRO  28           HG2      PRO  28  11.478  -1.586   5.866
  210    HG3  PRO  28           HG3      PRO  28  10.822  -0.334   6.932
  211    HD2  PRO  28           HD2      PRO  28  11.673   0.150   4.391
  212    HD3  PRO  28           HD3      PRO  28  11.687   1.372   5.681
  213    H    ALA  29           H        ALA  29  13.670  -1.521   4.131
  214    HA   ALA  29           HA       ALA  29  14.792  -4.151   4.586
  215    HB1  ALA  29           HB1      ALA  29  14.306  -2.744   1.946
  216    HB2  ALA  29           HB2      ALA  29  12.992  -3.391   2.928
  217    HB3  ALA  29           HB3      ALA  29  14.222  -4.474   2.276
  218    H    ILE  30           H        ILE  30  16.012  -1.159   3.067
  219    HA   ILE  30           HA       ILE  30  18.501  -2.350   2.148
  220    HB   ILE  30           HB       ILE  30  17.526   0.492   2.569
  221   HG12  ILE  30          HG12      ILE  30  16.332  -0.768   0.827
  222   HG13  ILE  30          HG13      ILE  30  17.352   0.465   0.089
  223   HG21  ILE  30          HG21      ILE  30  19.814   0.863   2.568
  224   HG22  ILE  30          HG22      ILE  30  19.503   0.859   0.832
  225   HG23  ILE  30          HG23      ILE  30  20.155  -0.581   1.615
  226   HD11  ILE  30          HD11      ILE  30  17.789  -2.517   0.202
  227   HD12  ILE  30          HD12      ILE  30  19.139  -1.415  -0.070
  228   HD13  ILE  30          HD13      ILE  30  17.791  -1.456  -1.206
  229    H    THR  31           H        THR  31  17.533  -0.445   4.996
  230    HA   THR  31           HA       THR  31  20.192  -0.216   6.114
  231    HB   THR  31           HB       THR  31  18.886   0.399   8.175
  232    HG1  THR  31           HG1      THR  31  17.064  -0.691   8.190
  233   HG21  THR  31          HG21      THR  31  19.361   2.078   6.431
  234   HG22  THR  31          HG22      THR  31  17.794   2.370   7.186
  235   HG23  THR  31          HG23      THR  31  17.879   1.622   5.591
  236    H    LYS  32           H        LYS  32  17.534  -2.557   6.569
  237    HA   LYS  32           HA       LYS  32  18.856  -4.063   8.663
  238    HB2  LYS  32           HB2      LYS  32  16.514  -4.416   6.815
  239    HB3  LYS  32           HB3      LYS  32  17.066  -5.786   7.779
  240    HG2  LYS  32           HG2      LYS  32  16.757  -3.195   9.211
  241    HG3  LYS  32           HG3      LYS  32  15.271  -3.996   8.701
  242    HD2  LYS  32           HD2      LYS  32  15.874  -6.018   9.885
  243    HD3  LYS  32           HD3      LYS  32  17.477  -5.380  10.253
  244    HE2  LYS  32           HE2      LYS  32  16.578  -3.723  11.744
  245    HE3  LYS  32           HE3      LYS  32  14.920  -4.040  11.197
  246    HZ1  LYS  32           HZ1      LYS  32  15.131  -6.318  11.993
  247    HZ2  LYS  32           HZ2      LYS  32  15.388  -5.218  13.262
  248    HZ3  LYS  32           HZ3      LYS  32  16.707  -6.007  12.539
  249    H    TYR  33           H        TYR  33  18.893  -4.207   5.143
  250    HA   TYR  33           HA       TYR  33  20.285  -6.806   5.090
  251    HB2  TYR  33           HB2      TYR  33  18.635  -6.200   3.377
  252    HB3  TYR  33           HB3      TYR  33  19.565  -4.761   2.962
  253    HD1  TYR  33           HD1      TYR  33  19.674  -8.486   3.016
  254    HD2  TYR  33           HD2      TYR  33  21.425  -4.873   1.485
  255    HE1  TYR  33           HE1      TYR  33  21.048  -9.819   1.441
  256    HE2  TYR  33           HE2      TYR  33  22.799  -6.208  -0.091
  257    HH   TYR  33           HH       TYR  33  23.610  -9.044   0.128
  258    H    VAL  34           H        VAL  34  21.069  -3.398   4.257
  259    HA   VAL  34           HA       VAL  34  23.895  -4.029   3.785
  260    HB   VAL  34           HB       VAL  34  22.426  -1.389   4.103
  261   HG11  VAL  34          HG11      VAL  34  25.027  -1.521   4.239
  262   HG12  VAL  34          HG12      VAL  34  24.304  -0.348   3.140
  263   HG13  VAL  34          HG13      VAL  34  24.941  -1.868   2.513
  264   HG21  VAL  34          HG21      VAL  34  22.951  -3.170   1.708
  265   HG22  VAL  34          HG22      VAL  34  22.532  -1.464   1.546
  266   HG23  VAL  34          HG23      VAL  34  21.395  -2.584   2.297
  267    H    VAL  35           H        VAL  35  24.332  -4.999   5.916
  268    HA   VAL  35           HA       VAL  35  25.287  -3.000   7.864
  269    HB   VAL  35           HB       VAL  35  22.849  -3.427   8.324
  270   HG11  VAL  35          HG11      VAL  35  23.763  -6.204   9.116
  271   HG12  VAL  35          HG12      VAL  35  22.956  -5.848   7.589
  272   HG13  VAL  35          HG13      VAL  35  22.114  -5.577   9.114
  273   HG21  VAL  35          HG21      VAL  35  24.373  -4.640  10.602
  274   HG22  VAL  35          HG22      VAL  35  23.149  -3.369  10.626
  275   HG23  VAL  35          HG23      VAL  35  24.789  -3.006  10.087
  276    H    ARG  36           H        ARG  36  26.550  -4.995   6.154
  277    HA   ARG  36           HA       ARG  36  27.415  -7.138   8.038
  278    HB2  ARG  36           HB2      ARG  36  28.088  -6.701   5.109
  279    HB3  ARG  36           HB3      ARG  36  28.278  -8.192   6.028
  280    HG2  ARG  36           HG2      ARG  36  25.569  -6.889   5.722
  281    HG3  ARG  36           HG3      ARG  36  26.200  -7.980   4.490
  282    HD2  ARG  36           HD2      ARG  36  26.239  -9.829   5.979
  283    HD3  ARG  36           HD3      ARG  36  26.104  -8.786   7.408
  284    HE   ARG  36           HE       ARG  36  23.771  -8.528   6.965
  285   HH11  ARG  36          HH11      ARG  36  24.196 -11.401   5.905
  286   HH12  ARG  36          HH12      ARG  36  23.317 -11.322   4.416
  287   HH21  ARG  36          HH21      ARG  36  23.157  -7.845   4.392
  288   HH22  ARG  36          HH22      ARG  36  22.725  -9.301   3.556
  Start of MODEL    8
    1    HA   SER   1           HA       SER   1 -29.644  -5.043   2.760
    2    HB2  SER   1           HB2      SER   1 -30.498  -3.890   5.438
    3    HB3  SER   1           HB3      SER   1 -31.113  -3.389   3.866
    4    HG   SER   1           HG       SER   1 -32.490  -4.917   4.831
    5    H    ASP   2           H        ASP   2 -28.133  -3.747   1.797
    6    HA   ASP   2           HA       ASP   2 -26.643  -1.782   3.508
    7    HB2  ASP   2           HB2      ASP   2 -25.747  -3.755   1.418
    8    HB3  ASP   2           HB3      ASP   2 -24.806  -2.290   1.698
    9    H    LEU   3           H        LEU   3 -26.777   0.291   2.755
   10    HA   LEU   3           HA       LEU   3 -28.057   0.754   0.103
   11    HB2  LEU   3           HB2      LEU   3 -28.056   1.995   2.749
   12    HB3  LEU   3           HB3      LEU   3 -27.798   3.179   1.467
   13    HG   LEU   3           HG       LEU   3 -29.779   1.961   0.278
   14   HD11  LEU   3          HD11      LEU   3 -31.409   1.053   1.981
   15   HD12  LEU   3          HD12      LEU   3 -30.101   1.089   3.164
   16   HD13  LEU   3          HD13      LEU   3 -29.977   0.050   1.744
   17   HD21  LEU   3          HD21      LEU   3 -31.358   3.463   1.365
   18   HD22  LEU   3          HD22      LEU   3 -29.799   4.277   1.243
   19   HD23  LEU   3          HD23      LEU   3 -30.316   3.588   2.783
   20    HA   PRO   4           HA       PRO   4 -24.160   3.339  -0.362
   21    HB2  PRO   4           HB2      PRO   4 -22.557   3.890   1.788
   22    HB3  PRO   4           HB3      PRO   4 -24.022   4.814   1.412
   23    HG2  PRO   4           HG2      PRO   4 -23.526   2.930   3.581
   24    HG3  PRO   4           HG3      PRO   4 -24.797   4.146   3.412
   25    HD2  PRO   4           HD2      PRO   4 -24.950   1.307   2.947
   26    HD3  PRO   4           HD3      PRO   4 -26.257   2.510   2.895
   27    H    ALA   5           H        ALA   5 -21.452   3.115   0.442
   28    HA   ALA   5           HA       ALA   5 -20.801   0.235   0.694
   29    HB1  ALA   5           HB1      ALA   5 -21.289   0.571  -1.687
   30    HB2  ALA   5           HB2      ALA   5 -19.559   0.306  -1.469
   31    HB3  ALA   5           HB3      ALA   5 -20.173   1.937  -1.741
   32    H    LEU   6           H        LEU   6 -20.114   1.918   2.626
   33    HA   LEU   6           HA       LEU   6 -17.401   3.030   2.063
   34    HB2  LEU   6           HB2      LEU   6 -19.550   4.084   3.314
   35    HB3  LEU   6           HB3      LEU   6 -18.758   3.328   4.698
   36    HG   LEU   6           HG       LEU   6 -16.600   4.470   3.824
   37   HD11  LEU   6          HD11      LEU   6 -18.730   6.120   2.423
   38   HD12  LEU   6          HD12      LEU   6 -17.516   5.117   1.626
   39   HD13  LEU   6          HD13      LEU   6 -17.021   6.541   2.540
   40   HD21  LEU   6          HD21      LEU   6 -18.954   5.870   5.096
   41   HD22  LEU   6          HD22      LEU   6 -17.416   6.703   4.867
   42   HD23  LEU   6          HD23      LEU   6 -17.493   5.254   5.870
   43    H    SER   7           H        SER   7 -19.070   0.625   4.089
   44    HA   SER   7           HA       SER   7 -16.950  -0.027   5.868
   45    HB2  SER   7           HB2      SER   7 -19.350  -0.726   6.005
   46    HB3  SER   7           HB3      SER   7 -19.064  -1.839   4.670
   47    HG   SER   7           HG       SER   7 -18.863  -2.672   6.914
   48    H    THR   8           H        THR   8 -17.743  -1.419   2.679
   49    HA   THR   8           HA       THR   8 -15.025  -2.693   2.668
   50    HB   THR   8           HB       THR   8 -16.170  -4.376   1.148
   51    HG1  THR   8           HG1      THR   8 -18.199  -4.098   0.680
   52   HG21  THR   8          HG21      THR   8 -15.818  -4.729   3.604
   53   HG22  THR   8          HG22      THR   8 -17.238  -5.563   2.976
   54   HG23  THR   8          HG23      THR   8 -17.427  -4.064   3.888
   55    H    GLY   9           H        GLY   9 -16.511  -0.084   1.408
   56    HA2  GLY   9           HA2      GLY   9 -15.417  -0.478  -1.345
   57    HA3  GLY   9           HA3      GLY   9 -16.655   0.706  -0.923
   58    H    LEU  10           H        LEU  10 -15.893   2.301   0.861
   59    HA   LEU  10           HA       LEU  10 -13.499   3.649  -0.099
   60    HB2  LEU  10           HB2      LEU  10 -15.622   4.684   0.832
   61    HB3  LEU  10           HB3      LEU  10 -15.113   4.127   2.426
   62    HG   LEU  10           HG       LEU  10 -12.860   5.353   1.809
   63   HD11  LEU  10          HD11      LEU  10 -13.709   5.819  -0.539
   64   HD12  LEU  10          HD12      LEU  10 -13.118   7.233   0.332
   65   HD13  LEU  10          HD13      LEU  10 -14.853   6.952   0.180
   66   HD21  LEU  10          HD21      LEU  10 -14.892   5.923   3.471
   67   HD22  LEU  10          HD22      LEU  10 -15.071   7.281   2.360
   68   HD23  LEU  10          HD23      LEU  10 -13.551   7.039   3.221
   69    H    LEU  11           H        LEU  11 -14.305   1.657   2.752
   70    HA   LEU  11           HA       LEU  11 -11.866   2.093   4.209
   71    HB2  LEU  11           HB2      LEU  11 -14.156   0.991   4.840
   72    HB3  LEU  11           HB3      LEU  11 -13.434  -0.484   4.200
   73    HG   LEU  11           HG       LEU  11 -11.446  -0.023   5.734
   74   HD11  LEU  11          HD11      LEU  11 -11.740   2.276   6.287
   75   HD12  LEU  11          HD12      LEU  11 -12.138   1.395   7.761
   76   HD13  LEU  11          HD13      LEU  11 -13.428   2.031   6.738
   77   HD21  LEU  11          HD21      LEU  11 -14.214  -0.621   6.807
   78   HD22  LEU  11          HD22      LEU  11 -12.761  -0.784   7.793
   79   HD23  LEU  11          HD23      LEU  11 -12.958  -1.771   6.346
   80    H    HIS  12           H        HIS  12 -12.824  -0.409   1.838
   81    HA   HIS  12           HA       HIS  12 -10.387  -1.924   1.908
   82    HB2  HIS  12           HB2      HIS  12 -12.681  -1.515   0.001
   83    HB3  HIS  12           HB3      HIS  12 -11.293  -2.474  -0.510
   84    HD1  HIS  12           HD1      HIS  12 -12.341  -2.558   3.092
   85    HD2  HIS  12           HD2      HIS  12 -12.829  -4.889  -0.331
   86    HE1  HIS  12           HE1      HIS  12 -13.281  -4.777   3.864
   87    H    LEU  13           H        LEU  13 -11.448   0.802  -0.157
   88    HA   LEU  13           HA       LEU  13  -9.127   0.900  -1.844
   89    HB2  LEU  13           HB2      LEU  13 -11.485   2.034  -1.973
   90    HB3  LEU  13           HB3      LEU  13 -10.739   3.305  -1.004
   91    HG   LEU  13           HG       LEU  13  -8.829   3.160  -2.818
   92   HD11  LEU  13          HD11      LEU  13 -11.233   1.919  -4.174
   93   HD12  LEU  13          HD12      LEU  13  -9.591   1.282  -4.084
   94   HD13  LEU  13          HD13      LEU  13  -9.935   2.698  -5.078
   95   HD21  LEU  13          HD21      LEU  13 -10.115   5.172  -2.484
   96   HD22  LEU  13          HD22      LEU  13 -11.546   4.445  -3.214
   97   HD23  LEU  13          HD23      LEU  13 -10.143   4.822  -4.213
   98    H    HIS  14           H        HIS  14  -9.900   2.509   1.253
   99    HA   HIS  14           HA       HIS  14  -7.651   4.233   1.457
  100    HB2  HIS  14           HB2      HIS  14  -9.477   4.441   2.984
  101    HB3  HIS  14           HB3      HIS  14  -9.382   2.744   3.448
  102    HD1  HIS  14           HD1      HIS  14  -8.611   2.706   5.828
  103    HD2  HIS  14           HD2      HIS  14  -6.479   5.488   3.570
  104    HE1  HIS  14           HE1      HIS  14  -6.807   3.632   7.345
  105    H    GLN  15           H        GLN  15  -8.029   0.929   2.818
  106    HA   GLN  15           HA       GLN  15  -5.402   0.589   3.815
  107    HB2  GLN  15           HB2      GLN  15  -7.625  -0.843   3.893
  108    HB3  GLN  15           HB3      GLN  15  -6.920  -1.645   2.489
  109    HG2  GLN  15           HG2      GLN  15  -6.147  -2.918   4.329
  110    HG3  GLN  15           HG3      GLN  15  -4.785  -1.874   3.925
  111   HE21  GLN  15          HE21      GLN  15  -3.995  -0.546   5.593
  112   HE22  GLN  15          HE22      GLN  15  -4.800  -0.275   7.064
  113    H    ASN  16           H        ASN  16  -6.689  -0.006   0.537
  114    HA   ASN  16           HA       ASN  16  -4.290  -1.154  -0.570
  115    HB2  ASN  16           HB2      ASN  16  -6.768  -1.078  -1.385
  116    HB3  ASN  16           HB3      ASN  16  -6.330   0.480  -2.086
  117   HD21  ASN  16          HD21      ASN  16  -4.354   0.428  -3.598
  118   HD22  ASN  16          HD22      ASN  16  -4.108  -0.975  -4.521
  119    H    ILE  17           H        ILE  17  -5.508   2.213  -0.438
  120    HA   ILE  17           HA       ILE  17  -3.275   3.297  -1.978
  121    HB   ILE  17           HB       ILE  17  -5.478   4.482  -0.259
  122   HG12  ILE  17          HG12      ILE  17  -5.058   4.515  -3.266
  123   HG13  ILE  17          HG13      ILE  17  -6.062   3.328  -2.434
  124   HG21  ILE  17          HG21      ILE  17  -3.420   5.881  -2.001
  125   HG22  ILE  17          HG22      ILE  17  -3.602   6.047  -0.254
  126   HG23  ILE  17          HG23      ILE  17  -4.857   6.655  -1.332
  127   HD11  ILE  17          HD11      ILE  17  -6.487   6.305  -2.675
  128   HD12  ILE  17          HD12      ILE  17  -7.269   5.374  -1.399
  129   HD13  ILE  17          HD13      ILE  17  -7.598   4.999  -3.090
  130    H    VAL  18           H        VAL  18  -3.805   2.556   1.405
  131    HA   VAL  18           HA       VAL  18  -1.567   4.297   2.283
  132    HB   VAL  18           HB       VAL  18  -3.658   2.558   3.608
  133   HG11  VAL  18          HG11      VAL  18  -2.600   3.573   5.772
  134   HG12  VAL  18          HG12      VAL  18  -1.144   3.723   4.787
  135   HG13  VAL  18          HG13      VAL  18  -1.865   2.136   5.060
  136   HG21  VAL  18          HG21      VAL  18  -4.033   4.849   4.756
  137   HG22  VAL  18          HG22      VAL  18  -4.512   4.694   3.066
  138   HG23  VAL  18          HG23      VAL  18  -3.000   5.501   3.484
  139    H    ASP  19           H        ASP  19  -2.325   0.872   1.811
  140    HA   ASP  19           HA       ASP  19   0.277   0.011   2.923
  141    HB2  ASP  19           HB2      ASP  19  -2.196  -1.282   1.784
  142    HB3  ASP  19           HB3      ASP  19  -0.731  -2.233   2.006
  143    H    VAL  20           H        VAL  20   0.139   1.762   0.455
  144    HA   VAL  20           HA       VAL  20   1.253  -0.079  -1.607
  145    HB   VAL  20           HB       VAL  20  -0.634   1.472  -2.172
  146   HG11  VAL  20          HG11      VAL  20   0.389   3.289  -0.563
  147   HG12  VAL  20          HG12      VAL  20  -0.448   3.801  -2.027
  148   HG13  VAL  20          HG13      VAL  20   1.314   3.759  -1.989
  149   HG21  VAL  20          HG21      VAL  20   1.023   0.751  -3.886
  150   HG22  VAL  20          HG22      VAL  20   1.984   2.184  -3.527
  151   HG23  VAL  20          HG23      VAL  20   0.371   2.355  -4.218
  152    H    GLN  21           H        GLN  21   2.070   2.600   0.495
  153    HA   GLN  21           HA       GLN  21   4.779   2.852  -0.724
  154    HB2  GLN  21           HB2      GLN  21   2.942   4.488   0.995
  155    HB3  GLN  21           HB3      GLN  21   4.680   4.793   1.105
  156    HG2  GLN  21           HG2      GLN  21   4.838   5.478  -1.124
  157    HG3  GLN  21           HG3      GLN  21   3.380   4.608  -1.599
  158   HE21  GLN  21          HE21      GLN  21   4.505   7.497   0.200
  159   HE22  GLN  21          HE22      GLN  21   3.036   8.336   0.076
  160    H    TYR  22           H        TYR  22   3.117   1.793   2.200
  161    HA   TYR  22           HA       TYR  22   5.715   1.411   3.614
  162    HB2  TYR  22           HB2      TYR  22   2.967   0.887   4.744
  163    HB3  TYR  22           HB3      TYR  22   4.419   1.429   5.584
  164    HD1  TYR  22           HD1      TYR  22   5.384   3.695   4.064
  165    HD2  TYR  22           HD2      TYR  22   1.330   2.543   4.900
  166    HE1  TYR  22           HE1      TYR  22   4.650   6.040   3.745
  167    HE2  TYR  22           HE2      TYR  22   0.598   4.888   4.583
  168    HH   TYR  22           HH       TYR  22   1.885   7.031   3.064
  169    H    MET  23           H        MET  23   3.077  -0.403   2.124
  170    HA   MET  23           HA       MET  23   4.104  -2.970   3.228
  171    HB2  MET  23           HB2      MET  23   1.589  -1.872   2.469
  172    HB3  MET  23           HB3      MET  23   1.909  -3.223   1.382
  173    HG2  MET  23           HG2      MET  23   2.353  -3.518   4.347
  174    HG3  MET  23           HG3      MET  23   0.740  -3.710   3.662
  175    HE1  MET  23           HE1      MET  23   3.872  -5.021   4.615
  176    HE2  MET  23           HE2      MET  23   3.911  -6.700   4.083
  177    HE3  MET  23           HE3      MET  23   2.645  -6.161   5.184
  178    H    TYR  24           H        TYR  24   5.311  -1.176   0.873
  179    HA   TYR  24           HA       TYR  24   5.272  -3.210  -1.304
  180    HB2  TYR  24           HB2      TYR  24   5.161  -0.458  -1.228
  181    HB3  TYR  24           HB3      TYR  24   6.860  -0.743  -1.602
  182    HD1  TYR  24           HD1      TYR  24   3.382  -1.289  -2.729
  183    HD2  TYR  24           HD2      TYR  24   7.542  -1.761  -3.693
  184    HE1  TYR  24           HE1      TYR  24   2.778  -1.817  -5.074
  185    HE2  TYR  24           HE2      TYR  24   6.937  -2.288  -6.040
  186    HH   TYR  24           HH       TYR  24   4.237  -1.558  -7.448
  187    H    GLY  25           H        GLY  25   6.932  -3.126   1.439
  188    HA2  GLY  25           HA2      GLY  25   8.972  -4.119   2.059
  189    HA3  GLY  25           HA3      GLY  25   9.256  -4.483   0.356
  190    H    LEU  26           H        LEU  26   8.582  -1.227   1.533
  191    HA   LEU  26           HA       LEU  26  11.454  -0.472   1.336
  192    HB2  LEU  26           HB2      LEU  26   9.240   0.166  -0.560
  193    HB3  LEU  26           HB3      LEU  26  10.355   1.477  -0.182
  194    HG   LEU  26           HG       LEU  26  11.899  -0.890  -0.618
  195   HD11  LEU  26          HD11      LEU  26  10.150  -1.865  -1.917
  196   HD12  LEU  26          HD12      LEU  26  11.263  -1.151  -3.084
  197   HD13  LEU  26          HD13      LEU  26   9.759  -0.324  -2.680
  198   HD21  LEU  26          HD21      LEU  26  12.743   1.354  -0.969
  199   HD22  LEU  26          HD22      LEU  26  11.496   1.682  -2.174
  200   HD23  LEU  26          HD23      LEU  26  12.773   0.515  -2.520
  201    H    SER  27           H        SER  27   9.786  -0.536   3.650
  202    HA   SER  27           HA       SER  27   8.443   1.900   4.263
  203    HB2  SER  27           HB2      SER  27   9.533  -0.451   5.657
  204    HB3  SER  27           HB3      SER  27   9.488   1.001   6.655
  205    HG   SER  27           HG       SER  27   7.499   0.095   6.842
  206    HA   PRO  28           HA       PRO  28  12.523   3.599   6.022
  207    HB2  PRO  28           HB2      PRO  28  14.836   2.170   5.729
  208    HB3  PRO  28           HB3      PRO  28  13.736   1.952   7.104
  209    HG2  PRO  28           HG2      PRO  28  14.113   0.265   4.701
  210    HG3  PRO  28           HG3      PRO  28  13.693  -0.198   6.355
  211    HD2  PRO  28           HD2      PRO  28  11.910  -0.018   4.241
  212    HD3  PRO  28           HD3      PRO  28  11.471  -0.007   5.962
  213    H    ALA  29           H        ALA  29  11.572   4.079   3.535
  214    HA   ALA  29           HA       ALA  29  13.909   5.055   2.055
  215    HB1  ALA  29           HB1      ALA  29  13.741   2.677   1.368
  216    HB2  ALA  29           HB2      ALA  29  13.364   3.750   0.021
  217    HB3  ALA  29           HB3      ALA  29  12.063   2.937   0.891
  218    H    ILE  30           H        ILE  30  10.414   4.304   1.768
  219    HA   ILE  30           HA       ILE  30   9.890   6.718   0.173
  220    HB   ILE  30           HB       ILE  30   8.158   4.557   1.417
  221   HG12  ILE  30          HG12      ILE  30   8.552   4.945  -1.526
  222   HG13  ILE  30          HG13      ILE  30   9.873   4.224  -0.605
  223   HG21  ILE  30          HG21      ILE  30   6.522   5.510  -0.405
  224   HG22  ILE  30          HG22      ILE  30   7.481   6.979  -0.232
  225   HG23  ILE  30          HG23      ILE  30   6.633   6.311   1.162
  226   HD11  ILE  30          HD11      ILE  30   8.462   2.429  -1.400
  227   HD12  ILE  30          HD12      ILE  30   7.017   3.227  -0.782
  228   HD13  ILE  30          HD13      ILE  30   8.215   2.578   0.339
  229    H    THR  31           H        THR  31   9.464   5.647   3.521
  230    HA   THR  31           HA       THR  31   7.776   7.757   4.460
  231    HB   THR  31           HB       THR  31   9.974   6.233   5.902
  232    HG1  THR  31           HG1      THR  31   7.319   5.435   6.024
  233   HG21  THR  31          HG21      THR  31   9.083   8.099   7.211
  234   HG22  THR  31          HG22      THR  31   8.513   6.571   7.882
  235   HG23  THR  31          HG23      THR  31   7.434   7.558   6.896
  236    H    LYS  32           H        LYS  32  11.339   7.491   4.292
  237    HA   LYS  32           HA       LYS  32  11.879  10.081   5.471
  238    HB2  LYS  32           HB2      LYS  32  13.382   8.017   5.248
  239    HB3  LYS  32           HB3      LYS  32  13.611   8.488   3.564
  240    HG2  LYS  32           HG2      LYS  32  14.121  10.858   4.770
  241    HG3  LYS  32           HG3      LYS  32  14.649   9.757   6.042
  242    HD2  LYS  32           HD2      LYS  32  15.646   8.681   3.625
  243    HD3  LYS  32           HD3      LYS  32  15.965  10.414   3.554
  244    HE2  LYS  32           HE2      LYS  32  17.846   9.741   4.741
  245    HE3  LYS  32           HE3      LYS  32  16.731   9.967   6.102
  246    HZ1  LYS  32           HZ1      LYS  32  16.054   7.633   5.850
  247    HZ2  LYS  32           HZ2      LYS  32  17.708   7.772   6.210
  248    HZ3  LYS  32           HZ3      LYS  32  17.208   7.428   4.623
  249    H    TYR  33           H        TYR  33  11.042   9.016   2.253
  250    HA   TYR  33           HA       TYR  33  12.051  11.349   0.833
  251    HB2  TYR  33           HB2      TYR  33  10.996   8.801   0.261
  252    HB3  TYR  33           HB3      TYR  33   9.842   9.940  -0.431
  253    HD1  TYR  33           HD1      TYR  33  10.619  11.671  -2.067
  254    HD2  TYR  33           HD2      TYR  33  13.190   8.528  -0.664
  255    HE1  TYR  33           HE1      TYR  33  12.171  12.097  -3.953
  256    HE2  TYR  33           HE2      TYR  33  14.741   8.955  -2.551
  257    HH   TYR  33           HH       TYR  33  15.059  11.449  -4.138
  258    H    VAL  34           H        VAL  34   9.049  10.530   2.506
  259    HA   VAL  34           HA       VAL  34   7.673  12.930   1.411
  260    HB   VAL  34           HB       VAL  34   6.780  10.694   3.267
  261   HG11  VAL  34          HG11      VAL  34   4.528  11.494   2.879
  262   HG12  VAL  34          HG12      VAL  34   5.104  12.699   1.727
  263   HG13  VAL  34          HG13      VAL  34   5.494  12.859   3.439
  264   HG21  VAL  34          HG21      VAL  34   6.805   9.488   1.347
  265   HG22  VAL  34          HG22      VAL  34   7.069  10.922   0.356
  266   HG23  VAL  34          HG23      VAL  34   5.434  10.477   0.845
  267    H    VAL  35           H        VAL  35   8.660  11.561   4.580
  268    HA   VAL  35           HA       VAL  35   8.988  12.596   6.673
  269    HB   VAL  35           HB       VAL  35   9.421  15.018   4.888
  270   HG11  VAL  35          HG11      VAL  35  11.187  15.343   6.849
  271   HG12  VAL  35          HG12      VAL  35  10.032  14.354   7.743
  272   HG13  VAL  35          HG13      VAL  35   9.520  15.885   7.035
  273   HG21  VAL  35          HG21      VAL  35  10.929  13.503   3.982
  274   HG22  VAL  35          HG22      VAL  35  11.080  12.595   5.485
  275   HG23  VAL  35          HG23      VAL  35  11.898  14.147   5.308
  276    H    ARG  36           H        ARG  36   6.506  12.236   6.750
  277    HA   ARG  36           HA       ARG  36   5.096  14.874   7.021
  278    HB2  ARG  36           HB2      ARG  36   4.361  13.330   5.176
  279    HB3  ARG  36           HB3      ARG  36   3.955  12.129   6.402
  280    HG2  ARG  36           HG2      ARG  36   2.736  14.523   7.260
  281    HG3  ARG  36           HG3      ARG  36   2.421  14.424   5.528
  282    HD2  ARG  36           HD2      ARG  36   0.625  13.226   6.591
  283    HD3  ARG  36           HD3      ARG  36   1.717  11.980   5.956
  284    HE   ARG  36           HE       ARG  36   2.006  12.941   8.777
  285   HH11  ARG  36          HH11      ARG  36  -0.034  10.719   7.950
  286   HH12  ARG  36          HH12      ARG  36   0.872   9.308   8.384
  287   HH21  ARG  36          HH21      ARG  36   3.888  11.016   8.677
  288   HH22  ARG  36          HH22      ARG  36   3.098   9.477   8.804
  Start of MODEL    9
    1    HA   SER   1           HA       SER   1 -23.888  -4.619  13.240
    2    HB2  SER   1           HB2      SER   1 -23.472  -5.127  10.814
    3    HB3  SER   1           HB3      SER   1 -25.183  -5.013  11.209
    4    HG   SER   1           HG       SER   1 -24.460  -3.830   9.292
    5    H    ASP   2           H        ASP   2 -21.627  -4.757  11.751
    6    HA   ASP   2           HA       ASP   2 -20.091  -2.373  12.639
    7    HB2  ASP   2           HB2      ASP   2 -19.343  -5.143  11.652
    8    HB3  ASP   2           HB3      ASP   2 -18.168  -3.928  12.150
    9    H    LEU   3           H        LEU   3 -19.736  -0.800  11.145
   10    HA   LEU   3           HA       LEU   3 -20.291  -0.969   8.358
   11    HB2  LEU   3           HB2      LEU   3 -19.010   0.878  10.268
   12    HB3  LEU   3           HB3      LEU   3 -18.422   1.043   8.614
   13    HG   LEU   3           HG       LEU   3 -20.912   1.044   7.926
   14   HD11  LEU   3          HD11      LEU   3 -22.315   2.057   9.848
   15   HD12  LEU   3          HD12      LEU   3 -21.075   1.405  10.919
   16   HD13  LEU   3          HD13      LEU   3 -22.013   0.320   9.893
   17   HD21  LEU   3          HD21      LEU   3 -21.110   3.504   8.642
   18   HD22  LEU   3          HD22      LEU   3 -19.673   3.070   7.715
   19   HD23  LEU   3          HD23      LEU   3 -19.565   3.274   9.463
   20    HA   PRO   4           HA       PRO   4 -15.622  -1.707   7.629
   21    HB2  PRO   4           HB2      PRO   4 -14.014  -2.259   9.769
   22    HB3  PRO   4           HB3      PRO   4 -14.329  -0.609   9.201
   23    HG2  PRO   4           HG2      PRO   4 -15.471  -2.059  11.521
   24    HG3  PRO   4           HG3      PRO   4 -15.072  -0.346  11.342
   25    HD2  PRO   4           HD2      PRO   4 -17.614  -1.396  11.180
   26    HD3  PRO   4           HD3      PRO   4 -17.113   0.162  10.490
   27    H    ALA   5           H        ALA   5 -17.458  -3.609   7.453
   28    HA   ALA   5           HA       ALA   5 -16.023  -6.120   7.949
   29    HB1  ALA   5           HB1      ALA   5 -17.063  -5.689  10.129
   30    HB2  ALA   5           HB2      ALA   5 -17.885  -7.041   9.350
   31    HB3  ALA   5           HB3      ALA   5 -18.631  -5.443   9.357
   32    H    LEU   6           H        LEU   6 -19.323  -4.856   7.292
   33    HA   LEU   6           HA       LEU   6 -19.610  -6.866   5.101
   34    HB2  LEU   6           HB2      LEU   6 -22.005  -6.397   5.354
   35    HB3  LEU   6           HB3      LEU   6 -21.296  -6.748   6.928
   36    HG   LEU   6           HG       LEU   6 -20.998  -3.965   6.576
   37   HD11  LEU   6          HD11      LEU   6 -22.680  -4.154   4.745
   38   HD12  LEU   6          HD12      LEU   6 -23.269  -3.201   6.108
   39   HD13  LEU   6          HD13      LEU   6 -23.813  -4.866   5.894
   40   HD21  LEU   6          HD21      LEU   6 -23.109  -5.488   8.136
   41   HD22  LEU   6          HD22      LEU   6 -22.530  -3.859   8.479
   42   HD23  LEU   6          HD23      LEU   6 -21.450  -5.238   8.676
   43    H    SER   7           H        SER   7 -19.140  -3.454   5.619
   44    HA   SER   7           HA       SER   7 -20.251  -2.639   3.018
   45    HB2  SER   7           HB2      SER   7 -18.510  -1.097   4.959
   46    HB3  SER   7           HB3      SER   7 -19.607  -0.431   3.754
   47    HG   SER   7           HG       SER   7 -20.831  -0.395   5.515
   48    H    THR   8           H        THR   8 -17.026  -2.466   4.517
   49    HA   THR   8           HA       THR   8 -14.892  -2.226   3.520
   50    HB   THR   8           HB       THR   8 -15.517  -4.654   3.742
   51    HG1  THR   8           HG1      THR   8 -13.743  -5.288   2.631
   52   HG21  THR   8          HG21      THR   8 -17.235  -5.005   2.158
   53   HG22  THR   8          HG22      THR   8 -15.836  -5.818   1.459
   54   HG23  THR   8          HG23      THR   8 -16.322  -4.232   0.863
   55    H    GLY   9           H        GLY   9 -16.664  -0.438   2.186
   56    HA2  GLY   9           HA2      GLY   9 -16.135  -0.811  -0.711
   57    HA3  GLY   9           HA3      GLY   9 -17.179   0.424  -0.007
   58    H    LEU  10           H        LEU  10 -16.166   2.276   1.015
   59    HA   LEU  10           HA       LEU  10 -13.853   3.281  -0.379
   60    HB2  LEU  10           HB2      LEU  10 -15.853   4.474   0.786
   61    HB3  LEU  10           HB3      LEU  10 -14.904   4.300   2.264
   62    HG   LEU  10           HG       LEU  10 -12.965   5.337   0.857
   63   HD11  LEU  10          HD11      LEU  10 -13.886   6.957  -0.854
   64   HD12  LEU  10          HD12      LEU  10 -15.424   6.102  -0.741
   65   HD13  LEU  10          HD13      LEU  10 -13.988   5.262  -1.327
   66   HD21  LEU  10          HD21      LEU  10 -15.373   6.979   1.708
   67   HD22  LEU  10          HD22      LEU  10 -13.746   7.614   1.457
   68   HD23  LEU  10          HD23      LEU  10 -14.053   6.462   2.757
   69    H    LEU  11           H        LEU  11 -14.287   1.662   2.748
   70    HA   LEU  11           HA       LEU  11 -11.779   2.232   3.963
   71    HB2  LEU  11           HB2      LEU  11 -14.043   0.746   4.506
   72    HB3  LEU  11           HB3      LEU  11 -12.826  -0.510   4.289
   73    HG   LEU  11           HG       LEU  11 -12.911   0.173   6.641
   74   HD11  LEU  11          HD11      LEU  11 -10.594   0.448   6.976
   75   HD12  LEU  11          HD12      LEU  11 -10.404   1.416   5.514
   76   HD13  LEU  11          HD13      LEU  11 -10.690  -0.319   5.392
   77   HD21  LEU  11          HD21      LEU  11 -12.588   2.414   7.361
   78   HD22  LEU  11          HD22      LEU  11 -13.724   2.537   6.019
   79   HD23  LEU  11          HD23      LEU  11 -12.021   2.929   5.773
   80    H    HIS  12           H        HIS  12 -12.699  -0.376   1.688
   81    HA   HIS  12           HA       HIS  12 -10.218  -1.778   1.624
   82    HB2  HIS  12           HB2      HIS  12 -12.725  -1.637   0.179
   83    HB3  HIS  12           HB3      HIS  12 -11.393  -1.802  -0.964
   84    HD1  HIS  12           HD1      HIS  12 -12.854  -4.245  -1.086
   85    HD2  HIS  12           HD2      HIS  12 -10.259  -3.628   2.119
   86    HE1  HIS  12           HE1      HIS  12 -12.334  -6.533  -0.132
   87    H    LEU  13           H        LEU  13 -11.385   0.975  -0.335
   88    HA   LEU  13           HA       LEU  13  -9.106   1.246  -2.047
   89    HB2  LEU  13           HB2      LEU  13 -11.457   2.296  -2.150
   90    HB3  LEU  13           HB3      LEU  13 -10.856   3.481  -0.989
   91    HG   LEU  13           HG       LEU  13  -8.982   3.128  -3.185
   92   HD11  LEU  13          HD11      LEU  13 -11.821   3.963  -3.849
   93   HD12  LEU  13          HD12      LEU  13 -10.943   2.590  -4.522
   94   HD13  LEU  13          HD13      LEU  13 -10.433   4.234  -4.902
   95   HD21  LEU  13          HD21      LEU  13 -10.607   5.575  -2.465
   96   HD22  LEU  13          HD22      LEU  13  -8.980   5.507  -3.143
   97   HD23  LEU  13          HD23      LEU  13  -9.258   5.029  -1.468
   98    H    HIS  14           H        HIS  14  -9.824   2.584   1.182
   99    HA   HIS  14           HA       HIS  14  -7.590   4.356   1.412
  100    HB2  HIS  14           HB2      HIS  14  -9.268   4.613   3.024
  101    HB3  HIS  14           HB3      HIS  14  -9.454   2.878   3.254
  102    HD1  HIS  14           HD1      HIS  14  -7.859   1.708   4.924
  103    HD2  HIS  14           HD2      HIS  14  -7.116   5.790   4.519
  104    HE1  HIS  14           HE1      HIS  14  -6.271   2.335   6.792
  105    H    GLN  15           H        GLN  15  -7.958   0.976   2.597
  106    HA   GLN  15           HA       GLN  15  -5.283   0.646   3.532
  107    HB2  GLN  15           HB2      GLN  15  -7.565  -0.792   3.587
  108    HB3  GLN  15           HB3      GLN  15  -6.731  -1.650   2.292
  109    HG2  GLN  15           HG2      GLN  15  -6.190  -2.686   4.444
  110    HG3  GLN  15           HG3      GLN  15  -4.751  -1.915   3.776
  111   HE21  GLN  15          HE21      GLN  15  -7.503  -1.129   5.991
  112   HE22  GLN  15          HE22      GLN  15  -6.573  -0.159   7.028
  113    H    ASN  16           H        ASN  16  -6.705   0.194   0.307
  114    HA   ASN  16           HA       ASN  16  -4.524  -1.093  -0.993
  115    HB2  ASN  16           HB2      ASN  16  -6.868  -0.734  -1.827
  116    HB3  ASN  16           HB3      ASN  16  -6.473   0.965  -2.086
  117   HD21  ASN  16          HD21      ASN  16  -5.107   1.508  -3.901
  118   HD22  ASN  16          HD22      ASN  16  -4.649   0.359  -5.064
  119    H    ILE  17           H        ILE  17  -5.092   2.340  -0.253
  120    HA   ILE  17           HA       ILE  17  -2.633   3.143  -1.720
  121    HB   ILE  17           HB       ILE  17  -4.863   4.608  -0.265
  122   HG12  ILE  17          HG12      ILE  17  -4.154   4.867  -3.177
  123   HG13  ILE  17          HG13      ILE  17  -5.074   3.463  -2.635
  124   HG21  ILE  17          HG21      ILE  17  -2.849   5.937   0.001
  125   HG22  ILE  17          HG22      ILE  17  -3.831   6.677  -1.264
  126   HG23  ILE  17          HG23      ILE  17  -2.422   5.707  -1.695
  127   HD11  ILE  17          HD11      ILE  17  -6.019   6.125  -3.112
  128   HD12  ILE  17          HD12      ILE  17  -6.218   5.764  -1.398
  129   HD13  ILE  17          HD13      ILE  17  -6.944   4.710  -2.611
  130    H    VAL  18           H        VAL  18  -3.908   2.965   1.604
  131    HA   VAL  18           HA       VAL  18  -1.595   4.222   2.842
  132    HB   VAL  18           HB       VAL  18  -3.856   2.474   3.865
  133   HG11  VAL  18          HG11      VAL  18  -2.147   2.349   5.526
  134   HG12  VAL  18          HG12      VAL  18  -3.256   3.602   6.083
  135   HG13  VAL  18          HG13      VAL  18  -1.727   4.050   5.326
  136   HG21  VAL  18          HG21      VAL  18  -5.083   4.345   3.595
  137   HG22  VAL  18          HG22      VAL  18  -3.669   5.222   3.015
  138   HG23  VAL  18          HG23      VAL  18  -4.027   5.171   4.740
  139    H    ASP  19           H        ASP  19  -2.010   1.155   1.445
  140    HA   ASP  19           HA       ASP  19   0.210   0.014   3.111
  141    HB2  ASP  19           HB2      ASP  19  -2.344  -0.912   2.813
  142    HB3  ASP  19           HB3      ASP  19  -1.530  -1.778   1.513
  143    H    VAL  20           H        VAL  20  -0.214   1.493   0.212
  144    HA   VAL  20           HA       VAL  20   1.448  -0.455  -1.322
  145    HB   VAL  20           HB       VAL  20  -0.777   0.420  -2.199
  146   HG11  VAL  20          HG11      VAL  20   0.735   2.955  -2.818
  147   HG12  VAL  20          HG12      VAL  20  -0.223   2.806  -1.346
  148   HG13  VAL  20          HG13      VAL  20  -1.000   2.653  -2.921
  149   HG21  VAL  20          HG21      VAL  20   0.893  -0.545  -3.702
  150   HG22  VAL  20          HG22      VAL  20   1.736   1.002  -3.794
  151   HG23  VAL  20          HG23      VAL  20   0.121   0.835  -4.482
  152    H    GLN  21           H        GLN  21   1.360   2.903  -0.205
  153    HA   GLN  21           HA       GLN  21   4.058   3.408  -1.359
  154    HB2  GLN  21           HB2      GLN  21   1.889   5.083  -0.063
  155    HB3  GLN  21           HB3      GLN  21   3.474   5.749  -0.462
  156    HG2  GLN  21           HG2      GLN  21   2.407   4.262  -2.711
  157    HG3  GLN  21           HG3      GLN  21   1.264   5.500  -2.190
  158   HE21  GLN  21          HE21      GLN  21   2.415   7.753  -1.743
  159   HE22  GLN  21          HE22      GLN  21   3.597   8.206  -2.873
  160    H    TYR  22           H        TYR  22   2.875   2.056   1.430
  161    HA   TYR  22           HA       TYR  22   5.156   3.098   3.076
  162    HB2  TYR  22           HB2      TYR  22   2.464   2.174   4.121
  163    HB3  TYR  22           HB3      TYR  22   3.678   3.140   4.960
  164    HD1  TYR  22           HD1      TYR  22   4.041   5.517   4.353
  165    HD2  TYR  22           HD2      TYR  22   0.950   3.173   2.510
  166    HE1  TYR  22           HE1      TYR  22   2.990   7.584   3.477
  167    HE2  TYR  22           HE2      TYR  22  -0.099   5.238   1.633
  168    HH   TYR  22           HH       TYR  22   0.198   8.037   2.682
  169    H    MET  23           H        MET  23   2.865   0.376   2.630
  170    HA   MET  23           HA       MET  23   4.518  -1.520   4.106
  171    HB2  MET  23           HB2      MET  23   1.896  -1.326   3.071
  172    HB3  MET  23           HB3      MET  23   2.637  -2.685   2.225
  173    HG2  MET  23           HG2      MET  23   3.000  -2.452   5.195
  174    HG3  MET  23           HG3      MET  23   1.476  -3.069   4.563
  175    HE1  MET  23           HE1      MET  23   1.060  -5.278   3.616
  176    HE2  MET  23           HE2      MET  23   2.247  -6.257   2.757
  177    HE3  MET  23           HE3      MET  23   1.848  -4.649   2.161
  178    H    TYR  24           H        TYR  24   4.298  -0.443   0.761
  179    HA   TYR  24           HA       TYR  24   5.984  -2.699  -0.196
  180    HB2  TYR  24           HB2      TYR  24   3.914  -1.099  -1.235
  181    HB3  TYR  24           HB3      TYR  24   5.359  -0.599  -2.110
  182    HD1  TYR  24           HD1      TYR  24   6.769  -2.330  -3.280
  183    HD2  TYR  24           HD2      TYR  24   2.912  -3.238  -1.621
  184    HE1  TYR  24           HE1      TYR  24   6.668  -4.395  -4.648
  185    HE2  TYR  24           HE2      TYR  24   2.812  -5.304  -2.989
  186    HH   TYR  24           HH       TYR  24   5.131  -6.829  -4.186
  187    H    GLY  25           H        GLY  25   7.251  -0.876   1.661
  188    HA2  GLY  25           HA2      GLY  25   8.829   1.076   0.179
  189    HA3  GLY  25           HA3      GLY  25   9.086   0.599   1.857
  190    H    LEU  26           H        LEU  26   9.372  -2.220   1.413
  191    HA   LEU  26           HA       LEU  26  12.121  -2.246   0.286
  192    HB2  LEU  26           HB2      LEU  26  10.466  -3.838   2.191
  193    HB3  LEU  26           HB3      LEU  26  11.727  -4.710   1.321
  194    HG   LEU  26           HG       LEU  26  13.245  -2.690   2.026
  195   HD11  LEU  26          HD11      LEU  26  12.553  -1.751   4.228
  196   HD12  LEU  26          HD12      LEU  26  10.997  -2.565   4.062
  197   HD13  LEU  26          HD13      LEU  26  11.451  -1.290   2.930
  198   HD21  LEU  26          HD21      LEU  26  13.836  -3.881   4.091
  199   HD22  LEU  26          HD22      LEU  26  13.474  -5.041   2.812
  200   HD23  LEU  26          HD23      LEU  26  12.284  -4.717   4.073
  201    H    SER  27           H        SER  27  10.248  -1.951  -1.730
  202    HA   SER  27           HA       SER  27   9.071  -4.232  -2.882
  203    HB2  SER  27           HB2      SER  27   8.584  -2.145  -3.842
  204    HB3  SER  27           HB3      SER  27  10.277  -1.679  -3.933
  205    HG   SER  27           HG       SER  27  10.182  -2.406  -5.897
  206    HA   PRO  28           HA       PRO  28  13.126  -5.310  -5.130
  207    HB2  PRO  28           HB2      PRO  28  15.393  -3.866  -4.631
  208    HB3  PRO  28           HB3      PRO  28  14.218  -3.407  -5.876
  209    HG2  PRO  28           HG2      PRO  28  14.645  -2.275  -3.170
  210    HG3  PRO  28           HG3      PRO  28  14.146  -1.475  -4.666
  211    HD2  PRO  28           HD2      PRO  28  12.449  -2.177  -2.600
  212    HD3  PRO  28           HD3      PRO  28  11.948  -1.858  -4.274
  213    H    ALA  29           H        ALA  29  12.355  -6.446  -2.848
  214    HA   ALA  29           HA       ALA  29  14.784  -7.556  -1.675
  215    HB1  ALA  29           HB1      ALA  29  14.430  -6.677   0.573
  216    HB2  ALA  29           HB2      ALA  29  12.943  -5.878   0.063
  217    HB3  ALA  29           HB3      ALA  29  14.499  -5.318  -0.549
  218    H    ILE  30           H        ILE  30  11.292  -7.027  -1.019
  219    HA   ILE  30           HA       ILE  30  10.944  -9.696   0.129
  220    HB   ILE  30           HB       ILE  30   8.941  -7.616  -0.813
  221   HG12  ILE  30          HG12      ILE  30   9.663  -8.014   2.064
  222   HG13  ILE  30          HG13      ILE  30  10.800  -7.124   1.052
  223   HG21  ILE  30          HG21      ILE  30   7.750  -8.887   1.252
  224   HG22  ILE  30          HG22      ILE  30   8.733 -10.211   0.629
  225   HG23  ILE  30          HG23      ILE  30   7.566  -9.411  -0.422
  226   HD11  ILE  30          HD11      ILE  30   8.778  -5.740   0.279
  227   HD12  ILE  30          HD12      ILE  30   9.339  -5.466   1.928
  228   HD13  ILE  30          HD13      ILE  30   7.912  -6.460   1.635
  229    H    THR  31           H        THR  31  10.384  -8.163  -3.003
  230    HA   THR  31           HA       THR  31   8.785 -10.182  -4.237
  231    HB   THR  31           HB       THR  31   9.895  -9.152  -6.343
  232    HG1  THR  31           HG1      THR  31  10.772  -7.079  -4.742
  233   HG21  THR  31          HG21      THR  31   8.698  -6.988  -5.974
  234   HG22  THR  31          HG22      THR  31   8.508  -7.424  -4.277
  235   HG23  THR  31          HG23      THR  31   7.734  -8.396  -5.528
  236    H    LYS  32           H        LYS  32  12.331  -9.837  -3.971
  237    HA   LYS  32           HA       LYS  32  12.754 -12.379  -5.445
  238    HB2  LYS  32           HB2      LYS  32  14.126  -9.961  -5.122
  239    HB3  LYS  32           HB3      LYS  32  15.071 -11.117  -4.184
  240    HG2  LYS  32           HG2      LYS  32  14.134 -11.839  -6.951
  241    HG3  LYS  32           HG3      LYS  32  15.575 -10.843  -6.738
  242    HD2  LYS  32           HD2      LYS  32  16.138 -12.772  -4.948
  243    HD3  LYS  32           HD3      LYS  32  15.133 -13.709  -6.053
  244    HE2  LYS  32           HE2      LYS  32  17.185 -13.983  -7.104
  245    HE3  LYS  32           HE3      LYS  32  16.687 -12.465  -7.874
  246    HZ1  LYS  32           HZ1      LYS  32  17.788 -11.248  -6.080
  247    HZ2  LYS  32           HZ2      LYS  32  18.892 -12.236  -6.911
  248    HZ3  LYS  32           HZ3      LYS  32  18.306 -12.709  -5.388
  249    H    TYR  33           H        TYR  33  11.549 -12.060  -2.562
  250    HA   TYR  33           HA       TYR  33  13.465 -13.888  -1.156
  251    HB2  TYR  33           HB2      TYR  33  13.192 -11.765  -0.029
  252    HB3  TYR  33           HB3      TYR  33  11.438 -11.845  -0.191
  253    HD1  TYR  33           HD1      TYR  33  14.344 -13.669   1.312
  254    HD2  TYR  33           HD2      TYR  33  10.138 -12.819   1.506
  255    HE1  TYR  33           HE1      TYR  33  14.197 -14.887   3.465
  256    HE2  TYR  33           HE2      TYR  33   9.991 -14.037   3.660
  257    HH   TYR  33           HH       TYR  33  12.224 -14.607   5.603
  258    H    VAL  34           H        VAL  34   9.969 -13.186  -1.618
  259    HA   VAL  34           HA       VAL  34   9.171 -15.797  -0.537
  260    HB   VAL  34           HB       VAL  34   7.646 -13.633  -2.032
  261   HG11  VAL  34          HG11      VAL  34   6.790 -16.086  -0.492
  262   HG12  VAL  34          HG12      VAL  34   6.317 -15.596  -2.118
  263   HG13  VAL  34          HG13      VAL  34   5.707 -14.713  -0.719
  264   HG21  VAL  34          HG21      VAL  34   8.709 -12.852   0.080
  265   HG22  VAL  34          HG22      VAL  34   7.910 -14.163   0.947
  266   HG23  VAL  34          HG23      VAL  34   6.950 -12.884   0.203
  267    H    VAL  35           H        VAL  35   9.458 -17.610  -1.772
  268    HA   VAL  35           HA       VAL  35   8.889 -17.433  -4.713
  269    HB   VAL  35           HB       VAL  35  11.336 -17.521  -3.942
  270   HG11  VAL  35          HG11      VAL  35  12.214 -19.448  -2.978
  271   HG12  VAL  35          HG12      VAL  35  10.893 -20.464  -3.554
  272   HG13  VAL  35          HG13      VAL  35  10.636 -19.370  -2.194
  273   HG21  VAL  35          HG21      VAL  35  10.485 -18.156  -6.232
  274   HG22  VAL  35          HG22      VAL  35  10.418 -19.829  -5.679
  275   HG23  VAL  35          HG23      VAL  35  11.966 -18.989  -5.756
  276    H    ARG  36           H        ARG  36   7.205 -18.331  -2.372
  277    HA   ARG  36           HA       ARG  36   6.733 -21.162  -3.254
  278    HB2  ARG  36           HB2      ARG  36   7.736 -20.581  -0.897
  279    HB3  ARG  36           HB3      ARG  36   6.083 -20.106  -0.510
  280    HG2  ARG  36           HG2      ARG  36   6.487 -22.744  -1.853
  281    HG3  ARG  36           HG3      ARG  36   6.931 -22.616  -0.152
  282    HD2  ARG  36           HD2      ARG  36   4.232 -21.713  -1.210
  283    HD3  ARG  36           HD3      ARG  36   4.524 -23.336  -0.554
  284    HE   ARG  36           HE       ARG  36   4.640 -20.804   0.993
  285   HH11  ARG  36          HH11      ARG  36   6.860 -22.415   1.991
  286   HH12  ARG  36          HH12      ARG  36   6.120 -23.451   3.166
  287   HH21  ARG  36          HH21      ARG  36   2.895 -22.913   1.981
  288   HH22  ARG  36          HH22      ARG  36   3.862 -23.734   3.161
  Start of MODEL   10
    1    HA   SER   1           HA       SER   1 -28.496  -6.078   5.390
    2    HB2  SER   1           HB2      SER   1 -29.858  -7.071   3.349
    3    HB3  SER   1           HB3      SER   1 -29.791  -7.953   4.871
    4    HG   SER   1           HG       SER   1 -31.882  -6.490   3.713
    5    H    ASP   2           H        ASP   2 -27.693  -4.040   4.808
    6    HA   ASP   2           HA       ASP   2 -29.141  -2.622   2.592
    7    HB2  ASP   2           HB2      ASP   2 -27.672  -1.559   5.027
    8    HB3  ASP   2           HB3      ASP   2 -28.184  -0.538   3.683
    9    H    LEU   3           H        LEU   3 -27.873  -2.166   0.828
   10    HA   LEU   3           HA       LEU   3 -25.997  -2.195  -0.607
   11    HB2  LEU   3           HB2      LEU   3 -25.654  -0.364   1.239
   12    HB3  LEU   3           HB3      LEU   3 -24.399  -1.453   1.828
   13    HG   LEU   3           HG       LEU   3 -23.895  -1.399  -0.883
   14   HD11  LEU   3          HD11      LEU   3 -25.586   0.431  -1.116
   15   HD12  LEU   3          HD12      LEU   3 -23.961   0.937  -1.576
   16   HD13  LEU   3          HD13      LEU   3 -24.623   1.415  -0.013
   17   HD21  LEU   3          HD21      LEU   3 -22.780   0.397   1.296
   18   HD22  LEU   3          HD22      LEU   3 -21.994   0.076  -0.250
   19   HD23  LEU   3          HD23      LEU   3 -22.227  -1.232   0.909
   20    HA   PRO   4           HA       PRO   4 -24.374  -6.135   1.369
   21    HB2  PRO   4           HB2      PRO   4 -25.899  -7.977   0.046
   22    HB3  PRO   4           HB3      PRO   4 -26.389  -7.243   1.584
   23    HG2  PRO   4           HG2      PRO   4 -27.356  -6.708  -1.153
   24    HG3  PRO   4           HG3      PRO   4 -28.197  -6.563   0.395
   25    HD2  PRO   4           HD2      PRO   4 -27.118  -4.461  -1.106
   26    HD3  PRO   4           HD3      PRO   4 -27.659  -4.376   0.583
   27    H    ALA   5           H        ALA   5 -22.983  -4.758  -0.461
   28    HA   ALA   5           HA       ALA   5 -21.898  -6.785  -2.255
   29    HB1  ALA   5           HB1      ALA   5 -22.483  -5.452  -4.330
   30    HB2  ALA   5           HB2      ALA   5 -23.552  -4.474  -3.324
   31    HB3  ALA   5           HB3      ALA   5 -23.871  -6.196  -3.535
   32    H    LEU   6           H        LEU   6 -22.194  -3.204  -2.014
   33    HA   LEU   6           HA       LEU   6 -19.229  -2.999  -2.359
   34    HB2  LEU   6           HB2      LEU   6 -21.416  -1.709  -3.509
   35    HB3  LEU   6           HB3      LEU   6 -20.809  -0.532  -2.345
   36    HG   LEU   6           HG       LEU   6 -18.951  -1.975  -4.241
   37   HD11  LEU   6          HD11      LEU   6 -20.099   0.770  -4.757
   38   HD12  LEU   6          HD12      LEU   6 -20.864  -0.682  -5.404
   39   HD13  LEU   6          HD13      LEU   6 -19.211  -0.274  -5.867
   40   HD21  LEU   6          HD21      LEU   6 -17.786  -0.879  -2.474
   41   HD22  LEU   6          HD22      LEU   6 -18.844   0.531  -2.547
   42   HD23  LEU   6          HD23      LEU   6 -17.684   0.230  -3.842
   43    H    SER   7           H        SER   7 -20.233  -3.841   0.209
   44    HA   SER   7           HA       SER   7 -20.382  -1.549   2.011
   45    HB2  SER   7           HB2      SER   7 -20.298  -3.376   3.727
   46    HB3  SER   7           HB3      SER   7 -21.522  -3.649   2.491
   47    HG   SER   7           HG       SER   7 -20.524  -5.484   2.239
   48    H    THR   8           H        THR   8 -17.803  -3.416   0.620
   49    HA   THR   8           HA       THR   8 -15.856  -2.199   2.550
   50    HB   THR   8           HB       THR   8 -16.018  -4.674   2.568
   51    HG1  THR   8           HG1      THR   8 -13.997  -4.327   3.010
   52   HG21  THR   8          HG21      THR   8 -16.500  -5.674   0.604
   53   HG22  THR   8          HG22      THR   8 -14.795  -5.473   0.201
   54   HG23  THR   8          HG23      THR   8 -15.973  -4.272  -0.327
   55    H    GLY   9           H        GLY   9 -16.549  -0.423   0.691
   56    HA2  GLY   9           HA2      GLY   9 -14.628  -0.675  -1.580
   57    HA3  GLY   9           HA3      GLY   9 -16.003   0.429  -1.538
   58    H    LEU  10           H        LEU  10 -15.854   1.967   0.519
   59    HA   LEU  10           HA       LEU  10 -13.601   3.687   0.153
   60    HB2  LEU  10           HB2      LEU  10 -16.086   3.730   1.403
   61    HB3  LEU  10           HB3      LEU  10 -14.960   3.865   2.752
   62    HG   LEU  10           HG       LEU  10 -15.557   6.092   1.881
   63   HD11  LEU  10          HD11      LEU  10 -13.224   5.543   2.754
   64   HD12  LEU  10          HD12      LEU  10 -13.339   6.968   1.722
   65   HD13  LEU  10          HD13      LEU  10 -12.714   5.455   1.067
   66   HD21  LEU  10          HD21      LEU  10 -14.171   5.299  -0.689
   67   HD22  LEU  10          HD22      LEU  10 -15.111   6.756  -0.367
   68   HD23  LEU  10          HD23      LEU  10 -15.921   5.195  -0.493
   69    H    LEU  11           H        LEU  11 -14.343   1.394   2.815
   70    HA   LEU  11           HA       LEU  11 -12.038   1.868   4.412
   71    HB2  LEU  11           HB2      LEU  11 -14.119   0.552   4.969
   72    HB3  LEU  11           HB3      LEU  11 -13.505  -0.751   3.952
   73    HG   LEU  11           HG       LEU  11 -11.429   0.091   5.761
   74   HD11  LEU  11          HD11      LEU  11 -13.995  -0.798   7.110
   75   HD12  LEU  11          HD12      LEU  11 -13.384   0.856   7.140
   76   HD13  LEU  11          HD13      LEU  11 -12.457  -0.440   7.895
   77   HD21  LEU  11          HD21      LEU  11 -13.069  -2.459   5.583
   78   HD22  LEU  11          HD22      LEU  11 -11.512  -2.292   6.393
   79   HD23  LEU  11          HD23      LEU  11 -11.619  -2.110   4.642
   80    H    HIS  12           H        HIS  12 -12.548  -0.658   1.907
   81    HA   HIS  12           HA       HIS  12  -9.891  -1.729   1.970
   82    HB2  HIS  12           HB2      HIS  12 -12.348  -1.970   0.458
   83    HB3  HIS  12           HB3      HIS  12 -10.971  -1.972  -0.642
   84    HD1  HIS  12           HD1      HIS  12 -10.569  -4.396  -1.142
   85    HD2  HIS  12           HD2      HIS  12 -11.171  -3.732   2.930
   86    HE1  HIS  12           HE1      HIS  12 -10.151  -6.609   0.016
   87    H    LEU  13           H        LEU  13 -11.362   0.864  -0.002
   88    HA   LEU  13           HA       LEU  13  -9.206   1.389  -1.771
   89    HB2  LEU  13           HB2      LEU  13 -11.557   2.320  -1.793
   90    HB3  LEU  13           HB3      LEU  13 -11.084   3.393  -0.477
   91    HG   LEU  13           HG       LEU  13  -9.148   3.499  -2.643
   92   HD11  LEU  13          HD11      LEU  13 -11.963   4.381  -3.339
   93   HD12  LEU  13          HD12      LEU  13 -11.229   2.899  -3.949
   94   HD13  LEU  13          HD13      LEU  13 -10.533   4.463  -4.367
   95   HD21  LEU  13          HD21      LEU  13 -11.035   5.589  -1.506
   96   HD22  LEU  13          HD22      LEU  13  -9.552   5.898  -2.408
   97   HD23  LEU  13          HD23      LEU  13  -9.473   5.165  -0.806
   98    H    HIS  14           H        HIS  14  -9.816   2.651   1.524
   99    HA   HIS  14           HA       HIS  14  -7.609   4.463   1.680
  100    HB2  HIS  14           HB2      HIS  14  -9.354   4.553   3.311
  101    HB3  HIS  14           HB3      HIS  14  -9.207   2.835   3.674
  102    HD1  HIS  14           HD1      HIS  14  -8.290   2.645   5.988
  103    HD2  HIS  14           HD2      HIS  14  -6.385   5.662   3.830
  104    HE1  HIS  14           HE1      HIS  14  -6.446   3.536   7.476
  105    H    GLN  15           H        GLN  15  -7.859   1.036   2.715
  106    HA   GLN  15           HA       GLN  15  -5.101   0.777   3.524
  107    HB2  GLN  15           HB2      GLN  15  -7.413  -1.025   2.861
  108    HB3  GLN  15           HB3      GLN  15  -5.814  -1.738   3.068
  109    HG2  GLN  15           HG2      GLN  15  -6.845   0.201   5.119
  110    HG3  GLN  15           HG3      GLN  15  -7.392  -1.475   5.155
  111   HE21  GLN  15          HE21      GLN  15  -4.751   0.631   5.949
  112   HE22  GLN  15          HE22      GLN  15  -3.659  -0.572   6.435
  113    H    ASN  16           H        ASN  16  -6.819   0.232   0.462
  114    HA   ASN  16           HA       ASN  16  -4.704  -1.052  -0.980
  115    HB2  ASN  16           HB2      ASN  16  -7.104  -0.952  -1.617
  116    HB3  ASN  16           HB3      ASN  16  -6.938   0.776  -1.928
  117   HD21  ASN  16          HD21      ASN  16  -5.856  -2.439  -3.064
  118   HD22  ASN  16          HD22      ASN  16  -5.387  -1.911  -4.606
  119    H    ILE  17           H        ILE  17  -5.089   2.269   0.015
  120    HA   ILE  17           HA       ILE  17  -3.047   3.182  -1.971
  121    HB   ILE  17           HB       ILE  17  -5.005   4.610  -0.138
  122   HG12  ILE  17          HG12      ILE  17  -4.862   4.622  -3.164
  123   HG13  ILE  17          HG13      ILE  17  -5.801   3.423  -2.276
  124   HG21  ILE  17          HG21      ILE  17  -2.852   5.669  -1.983
  125   HG22  ILE  17          HG22      ILE  17  -3.115   6.058  -0.282
  126   HG23  ILE  17          HG23      ILE  17  -4.241   6.646  -1.505
  127   HD11  ILE  17          HD11      ILE  17  -7.365   5.131  -2.729
  128   HD12  ILE  17          HD12      ILE  17  -6.200   6.410  -2.388
  129   HD13  ILE  17          HD13      ILE  17  -6.870   5.452  -1.068
  130    H    VAL  18           H        VAL  18  -3.803   3.307   1.530
  131    HA   VAL  18           HA       VAL  18  -1.264   4.459   2.301
  132    HB   VAL  18           HB       VAL  18  -3.469   2.970   3.752
  133   HG11  VAL  18          HG11      VAL  18  -2.371   4.084   5.807
  134   HG12  VAL  18          HG12      VAL  18  -0.932   4.233   4.797
  135   HG13  VAL  18          HG13      VAL  18  -1.595   2.638   5.162
  136   HG21  VAL  18          HG21      VAL  18  -3.592   5.457   4.693
  137   HG22  VAL  18          HG22      VAL  18  -4.366   5.025   3.169
  138   HG23  VAL  18          HG23      VAL  18  -2.796   5.827   3.164
  139    H    ASP  19           H        ASP  19  -2.470   1.123   2.092
  140    HA   ASP  19           HA       ASP  19   0.014   0.027   3.242
  141    HB2  ASP  19           HB2      ASP  19  -2.675  -0.754   2.964
  142    HB3  ASP  19           HB3      ASP  19  -1.768  -1.875   1.951
  143    H    VAL  20           H        VAL  20  -0.766   1.183   0.174
  144    HA   VAL  20           HA       VAL  20   1.049  -0.799  -1.149
  145    HB   VAL  20           HB       VAL  20  -1.157   0.993  -2.209
  146   HG11  VAL  20          HG11      VAL  20   0.945  -0.653  -3.601
  147   HG12  VAL  20          HG12      VAL  20   0.360   0.962  -3.997
  148   HG13  VAL  20          HG13      VAL  20  -0.644  -0.447  -4.340
  149   HG21  VAL  20          HG21      VAL  20  -0.869  -2.031  -2.135
  150   HG22  VAL  20          HG22      VAL  20  -2.266  -1.131  -2.728
  151   HG23  VAL  20          HG23      VAL  20  -1.852  -1.088  -1.013
  152    H    GLN  21           H        GLN  21   0.152   2.662  -1.221
  153    HA   GLN  21           HA       GLN  21   2.367   3.618  -2.715
  154    HB2  GLN  21           HB2      GLN  21   0.153   4.720  -1.836
  155    HB3  GLN  21           HB3      GLN  21   1.131   5.149  -0.434
  156    HG2  GLN  21           HG2      GLN  21   1.145   6.961  -2.116
  157    HG3  GLN  21           HG3      GLN  21   2.757   6.283  -1.895
  158   HE21  GLN  21          HE21      GLN  21  -0.080   5.208  -3.877
  159   HE22  GLN  21          HE22      GLN  21   0.797   5.105  -5.327
  160    H    TYR  22           H        TYR  22   2.098   2.902   0.766
  161    HA   TYR  22           HA       TYR  22   4.516   4.166   1.620
  162    HB2  TYR  22           HB2      TYR  22   3.891   3.267   3.631
  163    HB3  TYR  22           HB3      TYR  22   2.413   2.858   2.772
  164    HD1  TYR  22           HD1      TYR  22   5.671   1.558   3.970
  165    HD2  TYR  22           HD2      TYR  22   1.881   0.582   2.209
  166    HE1  TYR  22           HE1      TYR  22   6.096  -0.849   4.388
  167    HE2  TYR  22           HE2      TYR  22   2.303  -1.825   2.629
  168    HH   TYR  22           HH       TYR  22   3.819  -3.140   4.411
  169    H    MET  23           H        MET  23   3.941   1.035   0.061
  170    HA   MET  23           HA       MET  23   6.867   0.412   0.259
  171    HB2  MET  23           HB2      MET  23   4.464  -1.063   0.649
  172    HB3  MET  23           HB3      MET  23   5.238  -1.720  -0.792
  173    HG2  MET  23           HG2      MET  23   6.957  -1.166   1.592
  174    HG3  MET  23           HG3      MET  23   5.904  -2.581   1.639
  175    HE1  MET  23           HE1      MET  23   8.629  -0.636  -0.183
  176    HE2  MET  23           HE2      MET  23   9.757  -1.927  -0.591
  177    HE3  MET  23           HE3      MET  23   9.339  -1.632   1.095
  178    H    TYR  24           H        TYR  24   5.014   2.056  -1.828
  179    HA   TYR  24           HA       TYR  24   6.249   0.806  -4.263
  180    HB2  TYR  24           HB2      TYR  24   3.536   1.848  -3.600
  181    HB3  TYR  24           HB3      TYR  24   4.133   2.203  -5.219
  182    HD1  TYR  24           HD1      TYR  24   3.846  -0.657  -2.799
  183    HD2  TYR  24           HD2      TYR  24   3.874   0.611  -6.904
  184    HE1  TYR  24           HE1      TYR  24   3.301  -2.966  -3.516
  185    HE2  TYR  24           HE2      TYR  24   3.329  -1.699  -7.620
  186    HH   TYR  24           HH       TYR  24   3.789  -4.280  -6.011
  187    H    GLY  25           H        GLY  25   7.435   2.889  -2.506
  188    HA2  GLY  25           HA2      GLY  25   7.148   5.407  -4.011
  189    HA3  GLY  25           HA3      GLY  25   8.163   5.159  -2.589
  190    H    LEU  26           H        LEU  26  10.048   3.556  -3.005
  191    HA   LEU  26           HA       LEU  26  12.108   3.223  -4.114
  192    HB2  LEU  26           HB2      LEU  26  10.004   2.972  -6.277
  193    HB3  LEU  26           HB3      LEU  26  11.700   2.595  -6.568
  194    HG   LEU  26           HG       LEU  26  11.247   1.217  -4.246
  195   HD11  LEU  26          HD11      LEU  26   9.069  -0.042  -4.795
  196   HD12  LEU  26          HD12      LEU  26   8.678   1.328  -5.834
  197   HD13  LEU  26          HD13      LEU  26   8.904   1.571  -4.101
  198   HD21  LEU  26          HD21      LEU  26  11.035  -0.787  -5.753
  199   HD22  LEU  26          HD22      LEU  26  12.357   0.291  -6.200
  200   HD23  LEU  26          HD23      LEU  26  10.849   0.318  -7.116
  201    H    SER  27           H        SER  27  11.549   5.970  -3.680
  202    HA   SER  27           HA       SER  27  11.645   7.684  -5.924
  203    HB2  SER  27           HB2      SER  27  12.520   7.791  -3.064
  204    HB3  SER  27           HB3      SER  27  13.015   9.100  -4.132
  205    HG   SER  27           HG       SER  27  11.013   9.766  -4.226
  206    HA   PRO  28           HA       PRO  28  16.429   7.525  -5.842
  207    HB2  PRO  28           HB2      PRO  28  17.664   5.634  -4.299
  208    HB3  PRO  28           HB3      PRO  28  17.264   7.258  -3.706
  209    HG2  PRO  28           HG2      PRO  28  15.848   4.681  -3.262
  210    HG3  PRO  28           HG3      PRO  28  16.119   6.027  -2.146
  211    HD2  PRO  28           HD2      PRO  28  13.754   5.581  -3.431
  212    HD3  PRO  28           HD3      PRO  28  14.299   7.185  -2.895
  213    H    ALA  29           H        ALA  29  14.665   4.501  -5.574
  214    HA   ALA  29           HA       ALA  29  16.428   2.901  -7.231
  215    HB1  ALA  29           HB1      ALA  29  14.203   1.524  -7.325
  216    HB2  ALA  29           HB2      ALA  29  13.608   2.727  -6.182
  217    HB3  ALA  29           HB3      ALA  29  15.003   1.732  -5.767
  218    H    ILE  30           H        ILE  30  13.463   4.802  -7.871
  219    HA   ILE  30           HA       ILE  30  13.374   4.028 -10.689
  220    HB   ILE  30           HB       ILE  30  11.481   4.696  -9.042
  221   HG12  ILE  30          HG12      ILE  30  11.249   6.207 -11.621
  222   HG13  ILE  30          HG13      ILE  30  11.514   4.465 -11.689
  223   HG21  ILE  30          HG21      ILE  30  12.128   7.468 -10.062
  224   HG22  ILE  30          HG22      ILE  30  12.688   6.895  -8.491
  225   HG23  ILE  30          HG23      ILE  30  10.961   7.005  -8.823
  226   HD11  ILE  30          HD11      ILE  30   9.576   4.431  -9.878
  227   HD12  ILE  30          HD12      ILE  30   9.196   4.525 -11.598
  228   HD13  ILE  30          HD13      ILE  30   9.171   5.984 -10.608
  229    H    THR  31           H        THR  31  15.204   6.349  -8.946
  230    HA   THR  31           HA       THR  31  15.500   8.125 -11.329
  231    HB   THR  31           HB       THR  31  16.760   9.525  -9.605
  232    HG1  THR  31           HG1      THR  31  16.493   8.887  -7.459
  233   HG21  THR  31          HG21      THR  31  14.660  10.141  -8.371
  234   HG22  THR  31          HG22      THR  31  13.884   8.729  -9.087
  235   HG23  THR  31          HG23      THR  31  14.451  10.041 -10.119
  236    H    LYS  32           H        LYS  32  17.395   6.003  -9.169
  237    HA   LYS  32           HA       LYS  32  19.863   6.505 -10.737
  238    HB2  LYS  32           HB2      LYS  32  19.523   6.221  -8.141
  239    HB3  LYS  32           HB3      LYS  32  19.538   4.498  -8.514
  240    HG2  LYS  32           HG2      LYS  32  21.805   5.059  -8.035
  241    HG3  LYS  32           HG3      LYS  32  21.713   4.941  -9.791
  242    HD2  LYS  32           HD2      LYS  32  21.123   7.541  -9.556
  243    HD3  LYS  32           HD3      LYS  32  22.048   7.356  -8.066
  244    HE2  LYS  32           HE2      LYS  32  23.793   7.821  -9.527
  245    HE3  LYS  32           HE3      LYS  32  23.720   6.061  -9.741
  246    HZ1  LYS  32           HZ1      LYS  32  22.166   8.016 -11.358
  247    HZ2  LYS  32           HZ2      LYS  32  22.240   6.334 -11.594
  248    HZ3  LYS  32           HZ3      LYS  32  23.613   7.294 -11.868
  249    H    TYR  33           H        TYR  33  17.852   5.337 -12.300
  250    HA   TYR  33           HA       TYR  33  19.062   2.694 -12.931
  251    HB2  TYR  33           HB2      TYR  33  16.525   3.163 -11.630
  252    HB3  TYR  33           HB3      TYR  33  16.243   2.442 -13.214
  253    HD1  TYR  33           HD1      TYR  33  17.347   0.273 -13.816
  254    HD2  TYR  33           HD2      TYR  33  17.524   1.908  -9.847
  255    HE1  TYR  33           HE1      TYR  33  18.033  -1.940 -12.936
  256    HE2  TYR  33           HE2      TYR  33  18.210  -0.307  -8.967
  257    HH   TYR  33           HH       TYR  33  17.750  -2.999 -10.205
  258    H    VAL  34           H        VAL  34  16.415   4.938 -13.876
  259    HA   VAL  34           HA       VAL  34  16.915   4.361 -16.744
  260    HB   VAL  34           HB       VAL  34  14.886   6.123 -15.312
  261   HG11  VAL  34          HG11      VAL  34  15.426   5.488 -18.159
  262   HG12  VAL  34          HG12      VAL  34  14.608   6.881 -17.452
  263   HG13  VAL  34          HG13      VAL  34  13.737   5.362 -17.667
  264   HG21  VAL  34          HG21      VAL  34  14.566   3.323 -16.447
  265   HG22  VAL  34          HG22      VAL  34  13.342   4.255 -15.586
  266   HG23  VAL  34          HG23      VAL  34  14.773   3.680 -14.732
  267    H    VAL  35           H        VAL  35  19.152   5.575 -15.748
  268    HA   VAL  35           HA       VAL  35  19.050   8.289 -16.987
  269    HB   VAL  35           HB       VAL  35  20.370   9.133 -15.009
  270   HG11  VAL  35          HG11      VAL  35  17.833   9.328 -15.281
  271   HG12  VAL  35          HG12      VAL  35  18.456   9.501 -13.640
  272   HG13  VAL  35          HG13      VAL  35  17.711   7.985 -14.145
  273   HG21  VAL  35          HG21      VAL  35  20.217   7.751 -12.916
  274   HG22  VAL  35          HG22      VAL  35  21.237   7.024 -14.158
  275   HG23  VAL  35          HG23      VAL  35  19.604   6.417 -13.891
  276    H    ARG  36           H        ARG  36  20.302   5.501 -17.542
  277    HA   ARG  36           HA       ARG  36  22.307   4.684 -18.470
  278    HB2  ARG  36           HB2      ARG  36  21.854   7.183 -19.422
  279    HB3  ARG  36           HB3      ARG  36  23.419   7.441 -18.651
  280    HG2  ARG  36           HG2      ARG  36  23.788   5.032 -19.957
  281    HG3  ARG  36           HG3      ARG  36  22.762   5.926 -21.081
  282    HD2  ARG  36           HD2      ARG  36  24.330   7.799 -21.102
  283    HD3  ARG  36           HD3      ARG  36  25.331   7.011 -19.866
  284    HE   ARG  36           HE       ARG  36  25.007   6.068 -22.675
  285   HH11  ARG  36          HH11      ARG  36  27.697   6.760 -21.675
  286   HH12  ARG  36          HH12      ARG  36  28.346   5.225 -21.206
  287   HH21  ARG  36          HH21      ARG  36  25.251   3.645 -21.135
  288   HH22  ARG  36          HH22      ARG  36  26.956   3.454 -20.900
  Start of MODEL   11
    1    HA   SER   1           HA       SER   1 -21.680   8.641  -1.973
    2    HB2  SER   1           HB2      SER   1 -18.947   8.102  -1.805
    3    HB3  SER   1           HB3      SER   1 -19.659   7.009  -0.623
    4    HG   SER   1           HG       SER   1 -20.648   5.959  -2.182
    5    H    ASP   2           H        ASP   2 -22.756   6.936  -0.618
    6    HA   ASP   2           HA       ASP   2 -22.517   7.230   2.320
    7    HB2  ASP   2           HB2      ASP   2 -24.045   9.032   1.305
    8    HB3  ASP   2           HB3      ASP   2 -25.154   7.717   0.913
    9    H    LEU   3           H        LEU   3 -23.800   5.570   3.452
   10    HA   LEU   3           HA       LEU   3 -24.481   3.332   3.749
   11    HB2  LEU   3           HB2      LEU   3 -26.302   4.587   2.355
   12    HB3  LEU   3           HB3      LEU   3 -25.728   3.583   1.025
   13    HG   LEU   3           HG       LEU   3 -26.000   1.840   3.228
   14   HD11  LEU   3          HD11      LEU   3 -28.441   2.187   3.753
   15   HD12  LEU   3          HD12      LEU   3 -28.337   3.750   2.944
   16   HD13  LEU   3          HD13      LEU   3 -27.384   3.444   4.396
   17   HD21  LEU   3          HD21      LEU   3 -27.856   0.905   1.830
   18   HD22  LEU   3          HD22      LEU   3 -26.394   1.233   0.898
   19   HD23  LEU   3          HD23      LEU   3 -27.764   2.341   0.809
   20    HA   PRO   4           HA       PRO   4 -21.372   1.786   0.621
   21    HB2  PRO   4           HB2      PRO   4 -19.149   1.689   2.210
   22    HB3  PRO   4           HB3      PRO   4 -19.599   3.119   1.264
   23    HG2  PRO   4           HG2      PRO   4 -19.808   2.642   4.160
   24    HG3  PRO   4           HG3      PRO   4 -19.645   4.160   3.271
   25    HD2  PRO   4           HD2      PRO   4 -22.007   3.101   4.390
   26    HD3  PRO   4           HD3      PRO   4 -21.877   4.494   3.297
   27    H    ALA   5           H        ALA   5 -23.209   0.170   1.652
   28    HA   ALA   5           HA       ALA   5 -21.819  -1.921   3.287
   29    HB1  ALA   5           HB1      ALA   5 -24.250  -2.659   3.615
   30    HB2  ALA   5           HB2      ALA   5 -24.711  -1.174   2.785
   31    HB3  ALA   5           HB3      ALA   5 -23.824  -1.094   4.308
   32    H    LEU   6           H        LEU   6 -21.014  -1.935   0.674
   33    HA   LEU   6           HA       LEU   6 -22.650  -4.063  -0.664
   34    HB2  LEU   6           HB2      LEU   6 -22.016  -1.657  -1.625
   35    HB3  LEU   6           HB3      LEU   6 -20.517  -2.482  -2.051
   36    HG   LEU   6           HG       LEU   6 -23.076  -3.877  -2.693
   37   HD11  LEU   6          HD11      LEU   6 -23.756  -1.823  -3.583
   38   HD12  LEU   6          HD12      LEU   6 -22.926  -2.561  -4.953
   39   HD13  LEU   6          HD13      LEU   6 -22.108  -1.337  -3.981
   40   HD21  LEU   6          HD21      LEU   6 -20.938  -4.947  -3.187
   41   HD22  LEU   6          HD22      LEU   6 -20.395  -3.521  -4.072
   42   HD23  LEU   6          HD23      LEU   6 -21.719  -4.500  -4.703
   43    H    SER   7           H        SER   7 -19.197  -3.036  -0.439
   44    HA   SER   7           HA       SER   7 -18.339  -5.719   0.361
   45    HB2  SER   7           HB2      SER   7 -18.457  -4.853  -2.460
   46    HB3  SER   7           HB3      SER   7 -16.909  -5.543  -1.983
   47    HG   SER   7           HG       SER   7 -19.462  -6.719  -1.551
   48    H    THR   8           H        THR   8 -17.839  -3.305   1.634
   49    HA   THR   8           HA       THR   8 -16.108  -1.934   2.466
   50    HB   THR   8           HB       THR   8 -14.100  -3.862   1.361
   51    HG1  THR   8           HG1      THR   8 -15.229  -5.498   1.994
   52   HG21  THR   8          HG21      THR   8 -13.632  -2.036   3.055
   53   HG22  THR   8          HG22      THR   8 -13.151  -3.658   3.553
   54   HG23  THR   8          HG23      THR   8 -14.629  -2.941   4.193
   55    H    GLY   9           H        GLY   9 -16.784  -0.514   0.500
   56    HA2  GLY   9           HA2      GLY   9 -14.946  -0.472  -1.774
   57    HA3  GLY   9           HA3      GLY   9 -16.232   0.693  -1.460
   58    H    LEU  10           H        LEU  10 -15.784   2.506  -0.117
   59    HA   LEU  10           HA       LEU  10 -13.198   3.660  -0.299
   60    HB2  LEU  10           HB2      LEU  10 -15.750   4.397   0.485
   61    HB3  LEU  10           HB3      LEU  10 -14.837   4.525   1.988
   62    HG   LEU  10           HG       LEU  10 -13.723   5.686  -0.556
   63   HD11  LEU  10          HD11      LEU  10 -14.840   7.782  -0.131
   64   HD12  LEU  10          HD12      LEU  10 -15.549   7.162   1.360
   65   HD13  LEU  10          HD13      LEU  10 -16.080   6.529  -0.198
   66   HD21  LEU  10          HD21      LEU  10 -13.416   6.182   2.416
   67   HD22  LEU  10          HD22      LEU  10 -12.790   7.299   1.204
   68   HD23  LEU  10          HD23      LEU  10 -12.183   5.644   1.275
   69    H    LEU  11           H        LEU  11 -14.688   1.804   2.365
   70    HA   LEU  11           HA       LEU  11 -12.736   2.213   4.378
   71    HB2  LEU  11           HB2      LEU  11 -15.061   0.847   4.125
   72    HB3  LEU  11           HB3      LEU  11 -13.922  -0.498   4.056
   73    HG   LEU  11           HG       LEU  11 -13.602   1.596   6.186
   74   HD11  LEU  11          HD11      LEU  11 -15.160  -0.800   6.931
   75   HD12  LEU  11          HD12      LEU  11 -16.019   0.340   5.895
   76   HD13  LEU  11          HD13      LEU  11 -15.360   0.877   7.439
   77   HD21  LEU  11          HD21      LEU  11 -12.065  -0.492   5.548
   78   HD22  LEU  11          HD22      LEU  11 -13.236  -1.353   6.547
   79   HD23  LEU  11          HD23      LEU  11 -12.309  -0.017   7.229
   80    H    HIS  12           H        HIS  12 -12.872  -0.431   1.939
   81    HA   HIS  12           HA       HIS  12 -10.246  -1.464   2.682
   82    HB2  HIS  12           HB2      HIS  12 -12.373  -2.548   1.520
   83    HB3  HIS  12           HB3      HIS  12 -11.580  -1.997   0.046
   84    HD1  HIS  12           HD1      HIS  12 -11.312  -4.511   2.784
   85    HD2  HIS  12           HD2      HIS  12  -9.012  -3.225  -0.445
   86    HE1  HIS  12           HE1      HIS  12  -9.492  -6.241   2.468
   87    H    LEU  13           H        LEU  13 -11.489   0.816   0.275
   88    HA   LEU  13           HA       LEU  13  -9.306   0.971  -1.521
   89    HB2  LEU  13           HB2      LEU  13 -11.444   2.094  -1.863
   90    HB3  LEU  13           HB3      LEU  13 -11.195   3.084  -0.427
   91    HG   LEU  13           HG       LEU  13  -9.202   4.108  -1.496
   92   HD11  LEU  13          HD11      LEU  13  -8.317   2.628  -3.038
   93   HD12  LEU  13          HD12      LEU  13  -9.249   3.659  -4.123
   94   HD13  LEU  13          HD13      LEU  13  -9.904   2.105  -3.605
   95   HD21  LEU  13          HD21      LEU  13 -10.479   5.329  -3.315
   96   HD22  LEU  13          HD22      LEU  13 -11.289   5.289  -1.748
   97   HD23  LEU  13          HD23      LEU  13 -11.809   4.204  -3.038
   98    H    HIS  14           H        HIS  14  -9.784   2.618   1.618
   99    HA   HIS  14           HA       HIS  14  -7.419   4.231   1.576
  100    HB2  HIS  14           HB2      HIS  14  -8.985   4.791   3.216
  101    HB3  HIS  14           HB3      HIS  14  -9.317   3.108   3.616
  102    HD1  HIS  14           HD1      HIS  14  -8.282   2.314   5.732
  103    HD2  HIS  14           HD2      HIS  14  -6.164   5.523   4.121
  104    HE1  HIS  14           HE1      HIS  14  -6.434   2.857   7.380
  105    H    GLN  15           H        GLN  15  -8.009   0.958   2.915
  106    HA   GLN  15           HA       GLN  15  -5.388   0.475   3.939
  107    HB2  GLN  15           HB2      GLN  15  -7.647  -1.248   2.901
  108    HB3  GLN  15           HB3      GLN  15  -6.162  -1.968   3.522
  109    HG2  GLN  15           HG2      GLN  15  -7.728   0.070   5.113
  110    HG3  GLN  15           HG3      GLN  15  -8.083  -1.654   5.204
  111   HE21  GLN  15          HE21      GLN  15  -5.757   0.829   6.112
  112   HE22  GLN  15          HE22      GLN  15  -4.765  -0.180   7.048
  113    H    ASN  16           H        ASN  16  -6.767  -0.006   0.692
  114    HA   ASN  16           HA       ASN  16  -4.507  -1.390  -0.446
  115    HB2  ASN  16           HB2      ASN  16  -7.050  -0.896  -1.176
  116    HB3  ASN  16           HB3      ASN  16  -6.259   0.385  -2.094
  117   HD21  ASN  16          HD21      ASN  16  -4.219  -0.453  -3.390
  118   HD22  ASN  16          HD22      ASN  16  -4.392  -1.967  -4.140
  119    H    ILE  17           H        ILE  17  -5.487   2.069  -0.546
  120    HA   ILE  17           HA       ILE  17  -3.211   2.983  -2.056
  121    HB   ILE  17           HB       ILE  17  -5.146   4.310  -0.126
  122   HG12  ILE  17          HG12      ILE  17  -4.954   4.578  -3.136
  123   HG13  ILE  17          HG13      ILE  17  -5.913   3.310  -2.373
  124   HG21  ILE  17          HG21      ILE  17  -3.310   5.794  -0.098
  125   HG22  ILE  17          HG22      ILE  17  -4.325   6.429  -1.392
  126   HG23  ILE  17          HG23      ILE  17  -2.901   5.464  -1.781
  127   HD11  ILE  17          HD11      ILE  17  -6.286   6.301  -2.176
  128   HD12  ILE  17          HD12      ILE  17  -7.027   5.193  -1.021
  129   HD13  ILE  17          HD13      ILE  17  -7.443   5.092  -2.732
  130    H    VAL  18           H        VAL  18  -3.867   3.008   1.477
  131    HA   VAL  18           HA       VAL  18  -1.358   4.126   2.274
  132    HB   VAL  18           HB       VAL  18  -3.448   2.374   3.579
  133   HG11  VAL  18          HG11      VAL  18  -2.204   3.194   5.740
  134   HG12  VAL  18          HG12      VAL  18  -0.809   3.318   4.669
  135   HG13  VAL  18          HG13      VAL  18  -1.614   1.764   4.894
  136   HG21  VAL  18          HG21      VAL  18  -4.188   4.616   3.204
  137   HG22  VAL  18          HG22      VAL  18  -2.641   5.287   3.721
  138   HG23  VAL  18          HG23      VAL  18  -3.720   4.548   4.903
  139    H    ASP  19           H        ASP  19  -2.326   0.825   1.494
  140    HA   ASP  19           HA       ASP  19  -0.037  -0.560   2.540
  141    HB2  ASP  19           HB2      ASP  19  -2.164  -1.615   1.844
  142    HB3  ASP  19           HB3      ASP  19  -1.850  -1.154   0.172
  143    H    VAL  20           H        VAL  20  -0.525   1.370  -0.359
  144    HA   VAL  20           HA       VAL  20   2.007   0.422  -1.575
  145    HB   VAL  20           HB       VAL  20  -0.040   2.504  -2.432
  146   HG11  VAL  20          HG11      VAL  20   2.193   1.138  -3.972
  147   HG12  VAL  20          HG12      VAL  20   2.199   2.820  -3.442
  148   HG13  VAL  20          HG13      VAL  20   1.028   2.279  -4.644
  149   HG21  VAL  20          HG21      VAL  20  -0.836   0.748  -3.971
  150   HG22  VAL  20          HG22      VAL  20  -0.963   0.204  -2.298
  151   HG23  VAL  20          HG23      VAL  20   0.355  -0.377  -3.316
  152    H    GLN  21           H        GLN  21   0.672   3.176   0.160
  153    HA   GLN  21           HA       GLN  21   2.827   5.036  -0.346
  154    HB2  GLN  21           HB2      GLN  21   0.418   4.776   1.336
  155    HB3  GLN  21           HB3      GLN  21   1.695   5.737   2.078
  156    HG2  GLN  21           HG2      GLN  21   1.124   6.275  -0.794
  157    HG3  GLN  21           HG3      GLN  21  -0.098   6.794   0.368
  158   HE21  GLN  21          HE21      GLN  21   3.271   7.283  -0.648
  159   HE22  GLN  21          HE22      GLN  21   3.515   8.701   0.252
  160    H    TYR  22           H        TYR  22   2.199   2.663   2.260
  161    HA   TYR  22           HA       TYR  22   4.472   3.407   3.878
  162    HB2  TYR  22           HB2      TYR  22   3.589   1.809   5.263
  163    HB3  TYR  22           HB3      TYR  22   2.239   1.831   4.135
  164    HD1  TYR  22           HD1      TYR  22   5.497   0.127   4.839
  165    HD2  TYR  22           HD2      TYR  22   1.677  -0.086   2.895
  166    HE1  TYR  22           HE1      TYR  22   5.916  -2.250   4.277
  167    HE2  TYR  22           HE2      TYR  22   2.093  -2.463   2.330
  168    HH   TYR  22           HH       TYR  22   3.974  -4.373   3.702
  169    H    MET  23           H        MET  23   4.065   1.221   1.121
  170    HA   MET  23           HA       MET  23   6.741   0.030   1.425
  171    HB2  MET  23           HB2      MET  23   4.480  -0.925   0.456
  172    HB3  MET  23           HB3      MET  23   5.010  -0.133  -1.030
  173    HG2  MET  23           HG2      MET  23   7.059  -1.404  -1.066
  174    HG3  MET  23           HG3      MET  23   6.745  -2.053   0.544
  175    HE1  MET  23           HE1      MET  23   5.241  -5.249  -0.062
  176    HE2  MET  23           HE2      MET  23   5.711  -3.994   1.083
  177    HE3  MET  23           HE3      MET  23   6.893  -4.617  -0.065
  178    H    TYR  24           H        TYR  24   5.151   2.397  -0.745
  179    HA   TYR  24           HA       TYR  24   7.769   2.939  -2.073
  180    HB2  TYR  24           HB2      TYR  24   4.862   3.313  -2.660
  181    HB3  TYR  24           HB3      TYR  24   5.990   4.442  -3.407
  182    HD1  TYR  24           HD1      TYR  24   5.366   0.789  -2.895
  183    HD2  TYR  24           HD2      TYR  24   7.207   3.814  -5.326
  184    HE1  TYR  24           HE1      TYR  24   5.961  -0.928  -4.581
  185    HE2  TYR  24           HE2      TYR  24   7.802   2.096  -7.011
  186    HH   TYR  24           HH       TYR  24   6.533  -0.540  -7.476
  187    H    GLY  25           H        GLY  25   6.970   3.895   0.745
  188    HA2  GLY  25           HA2      GLY  25   6.762   6.817   0.395
  189    HA3  GLY  25           HA3      GLY  25   6.783   5.957   1.934
  190    H    LEU  26           H        LEU  26   9.180   4.398   1.306
  191    HA   LEU  26           HA       LEU  26  11.515   4.557   1.557
  192    HB2  LEU  26           HB2      LEU  26  10.630   6.518  -0.421
  193    HB3  LEU  26           HB3      LEU  26  12.124   7.019   0.368
  194    HG   LEU  26           HG       LEU  26  12.594   5.654  -1.633
  195   HD11  LEU  26          HD11      LEU  26  14.307   4.472  -0.647
  196   HD12  LEU  26          HD12      LEU  26  13.265   3.800   0.607
  197   HD13  LEU  26          HD13      LEU  26  13.835   5.463   0.733
  198   HD21  LEU  26          HD21      LEU  26  10.428   4.324  -1.410
  199   HD22  LEU  26          HD22      LEU  26  11.246   3.366  -0.175
  200   HD23  LEU  26          HD23      LEU  26  11.857   3.381  -1.829
  201    H    SER  27           H        SER  27   9.643   5.912   3.575
  202    HA   SER  27           HA       SER  27  11.124   8.244   4.548
  203    HB2  SER  27           HB2      SER  27   8.695   6.668   5.257
  204    HB3  SER  27           HB3      SER  27   9.450   7.585   6.557
  205    HG   SER  27           HG       SER  27   7.807   8.552   4.888
  206    HA   PRO  28           HA       PRO  28  12.406   5.209   8.033
  207    HB2  PRO  28           HB2      PRO  28  11.958   2.530   7.667
  208    HB3  PRO  28           HB3      PRO  28  10.797   3.610   8.465
  209    HG2  PRO  28           HG2      PRO  28  10.815   2.585   5.669
  210    HG3  PRO  28           HG3      PRO  28   9.454   2.813   6.779
  211    HD2  PRO  28           HD2      PRO  28  10.032   4.540   4.768
  212    HD3  PRO  28           HD3      PRO  28   9.248   5.041   6.281
  213    H    ALA  29           H        ALA  29  12.827   4.641   4.673
  214    HA   ALA  29           HA       ALA  29  15.310   3.065   4.987
  215    HB1  ALA  29           HB1      ALA  29  15.242   3.227   2.468
  216    HB2  ALA  29           HB2      ALA  29  13.784   4.206   2.626
  217    HB3  ALA  29           HB3      ALA  29  13.784   2.529   3.173
  218    H    ILE  30           H        ILE  30  14.305   6.399   4.405
  219    HA   ILE  30           HA       ILE  30  17.140   7.195   3.892
  220    HB   ILE  30           HB       ILE  30  14.476   8.608   3.538
  221   HG12  ILE  30          HG12      ILE  30  14.888   6.772   1.933
  222   HG13  ILE  30          HG13      ILE  30  14.952   8.338   1.129
  223   HG21  ILE  30          HG21      ILE  30  17.295   9.497   2.856
  224   HG22  ILE  30          HG22      ILE  30  16.208  10.250   4.021
  225   HG23  ILE  30          HG23      ILE  30  15.832  10.309   2.299
  226   HD11  ILE  30          HD11      ILE  30  16.847   7.178   0.302
  227   HD12  ILE  30          HD12      ILE  30  17.250   6.534   1.894
  228   HD13  ILE  30          HD13      ILE  30  17.499   8.245   1.547
  229    H    THR  31           H        THR  31  14.320   8.049   5.900
  230    HA   THR  31           HA       THR  31  15.721   9.979   7.538
  231    HB   THR  31           HB       THR  31  13.233   8.354   8.163
  232    HG1  THR  31           HG1      THR  31  13.502  10.785   6.718
  233   HG21  THR  31          HG21      THR  31  13.832   9.596  10.083
  234   HG22  THR  31          HG22      THR  31  12.639  10.609   9.270
  235   HG23  THR  31          HG23      THR  31  14.358  10.982   9.127
  236    H    LYS  32           H        LYS  32  15.136   6.469   7.853
  237    HA   LYS  32           HA       LYS  32  16.381   6.431  10.543
  238    HB2  LYS  32           HB2      LYS  32  14.389   5.007   9.376
  239    HB3  LYS  32           HB3      LYS  32  15.751   3.934   9.054
  240    HG2  LYS  32           HG2      LYS  32  16.342   3.986  11.466
  241    HG3  LYS  32           HG3      LYS  32  14.936   5.008  11.772
  242    HD2  LYS  32           HD2      LYS  32  13.436   3.253  10.983
  243    HD3  LYS  32           HD3      LYS  32  14.809   2.239  10.538
  244    HE2  LYS  32           HE2      LYS  32  14.530   1.341  12.629
  245    HE3  LYS  32           HE3      LYS  32  15.364   2.806  13.184
  246    HZ1  LYS  32           HZ1      LYS  32  12.426   2.501  12.815
  247    HZ2  LYS  32           HZ2      LYS  32  13.212   3.935  13.278
  248    HZ3  LYS  32           HZ3      LYS  32  13.237   2.581  14.303
  249    H    TYR  33           H        TYR  33  17.815   6.965   7.765
  250    HA   TYR  33           HA       TYR  33  19.938   4.871   8.032
  251    HB2  TYR  33           HB2      TYR  33  18.483   5.719   5.862
  252    HB3  TYR  33           HB3      TYR  33  19.925   6.723   5.723
  253    HD1  TYR  33           HD1      TYR  33  22.157   5.705   5.461
  254    HD2  TYR  33           HD2      TYR  33  18.593   3.309   5.608
  255    HE1  TYR  33           HE1      TYR  33  23.422   3.768   4.571
  256    HE2  TYR  33           HE2      TYR  33  19.859   1.373   4.717
  257    HH   TYR  33           HH       TYR  33  22.781   0.876   4.836
  258    H    VAL  34           H        VAL  34  19.392   8.392   7.714
  259    HA   VAL  34           HA       VAL  34  22.230   8.873   8.548
  260    HB   VAL  34           HB       VAL  34  20.135  10.580   7.162
  261   HG11  VAL  34          HG11      VAL  34  22.230  12.076   6.795
  262   HG12  VAL  34          HG12      VAL  34  22.913  11.203   8.166
  263   HG13  VAL  34          HG13      VAL  34  21.433  12.142   8.367
  264   HG21  VAL  34          HG21      VAL  34  22.670   9.193   6.246
  265   HG22  VAL  34          HG22      VAL  34  21.865  10.441   5.294
  266   HG23  VAL  34          HG23      VAL  34  21.029   8.930   5.657
  267    H    VAL  35           H        VAL  35  22.038   8.767  10.822
  268    HA   VAL  35           HA       VAL  35  20.242  10.816  12.081
  269    HB   VAL  35           HB       VAL  35  20.986   8.070  13.154
  270   HG11  VAL  35          HG11      VAL  35  20.406   9.276  15.044
  271   HG12  VAL  35          HG12      VAL  35  18.806   8.743  14.529
  272   HG13  VAL  35          HG13      VAL  35  19.357  10.375  14.149
  273   HG21  VAL  35          HG21      VAL  35  18.574   9.064  11.624
  274   HG22  VAL  35          HG22      VAL  35  18.472   7.666  12.695
  275   HG23  VAL  35          HG23      VAL  35  19.559   7.635  11.307
  276    H    ARG  36           H        ARG  36  22.554  11.870  11.594
  277    HA   ARG  36           HA       ARG  36  24.164  11.608  14.109
  278    HB2  ARG  36           HB2      ARG  36  24.943  11.427  11.221
  279    HB3  ARG  36           HB3      ARG  36  26.083  12.178  12.339
  280    HG2  ARG  36           HG2      ARG  36  26.106  10.197  13.740
  281    HG3  ARG  36           HG3      ARG  36  24.830   9.453  12.776
  282    HD2  ARG  36           HD2      ARG  36  26.882  10.190  10.950
  283    HD3  ARG  36           HD3      ARG  36  27.672   9.381  12.318
  284    HE   ARG  36           HE       ARG  36  25.307   8.184  10.914
  285   HH11  ARG  36          HH11      ARG  36  26.130   6.812  13.386
  286   HH12  ARG  36          HH12      ARG  36  27.266   5.630  12.825
  287   HH21  ARG  36          HH21      ARG  36  27.759   7.183   9.753
  288   HH22  ARG  36          HH22      ARG  36  28.192   5.841  10.759
  Start of MODEL   12
    1    HA   SER   1           HA       SER   1 -14.122 -14.362  -0.876
    2    HB2  SER   1           HB2      SER   1 -14.531 -16.489  -2.230
    3    HB3  SER   1           HB3      SER   1 -16.253 -16.137  -2.110
    4    HG   SER   1           HG       SER   1 -15.979 -14.349  -3.319
    5    H    ASP   2           H        ASP   2 -15.142 -12.999   0.837
    6    HA   ASP   2           HA       ASP   2 -17.988 -12.341   0.161
    7    HB2  ASP   2           HB2      ASP   2 -16.713 -12.582   2.909
    8    HB3  ASP   2           HB3      ASP   2 -18.380 -12.099   2.600
    9    H    LEU   3           H        LEU   3 -16.776 -10.632  -1.113
   10    HA   LEU   3           HA       LEU   3 -15.274  -8.581   0.321
   11    HB2  LEU   3           HB2      LEU   3 -15.690  -9.425  -2.332
   12    HB3  LEU   3           HB3      LEU   3 -16.340  -7.787  -2.263
   13    HG   LEU   3           HG       LEU   3 -14.134  -7.216  -0.996
   14   HD11  LEU   3          HD11      LEU   3 -12.237  -8.665  -1.718
   15   HD12  LEU   3          HD12      LEU   3 -13.398  -9.800  -2.406
   16   HD13  LEU   3          HD13      LEU   3 -13.369  -9.514  -0.667
   17   HD21  LEU   3          HD21      LEU   3 -14.628  -6.338  -3.208
   18   HD22  LEU   3          HD22      LEU   3 -14.225  -7.886  -3.955
   19   HD23  LEU   3          HD23      LEU   3 -12.961  -6.915  -3.201
   20    HA   PRO   4           HA       PRO   4 -19.230  -5.982  -0.222
   21    HB2  PRO   4           HB2      PRO   4 -21.482  -7.130  -1.261
   22    HB3  PRO   4           HB3      PRO   4 -20.227  -6.385  -2.271
   23    HG2  PRO   4           HG2      PRO   4 -20.781  -9.247  -1.750
   24    HG3  PRO   4           HG3      PRO   4 -20.155  -8.460  -3.205
   25    HD2  PRO   4           HD2      PRO   4 -18.637  -9.854  -1.352
   26    HD3  PRO   4           HD3      PRO   4 -18.006  -8.687  -2.533
   27    H    ALA   5           H        ALA   5 -18.648  -7.190   2.060
   28    HA   ALA   5           HA       ALA   5 -20.907  -8.743   3.152
   29    HB1  ALA   5           HB1      ALA   5 -18.297  -7.685   4.283
   30    HB2  ALA   5           HB2      ALA   5 -18.624  -9.332   3.741
   31    HB3  ALA   5           HB3      ALA   5 -19.418  -8.704   5.187
   32    H    LEU   6           H        LEU   6 -19.335  -5.587   3.879
   33    HA   LEU   6           HA       LEU   6 -21.978  -4.575   4.818
   34    HB2  LEU   6           HB2      LEU   6 -20.164  -5.574   6.568
   35    HB3  LEU   6           HB3      LEU   6 -19.588  -3.911   6.470
   36    HG   LEU   6           HG       LEU   6 -21.221  -4.139   8.289
   37   HD11  LEU   6          HD11      LEU   6 -21.123  -2.086   6.698
   38   HD12  LEU   6          HD12      LEU   6 -22.515  -2.245   7.769
   39   HD13  LEU   6          HD13      LEU   6 -22.656  -2.692   6.069
   40   HD21  LEU   6          HD21      LEU   6 -22.442  -6.072   7.197
   41   HD22  LEU   6          HD22      LEU   6 -23.234  -4.894   6.151
   42   HD23  LEU   6          HD23      LEU   6 -23.493  -4.841   7.895
   43    H    SER   7           H        SER   7 -18.588  -3.366   4.888
   44    HA   SER   7           HA       SER   7 -19.336  -1.249   2.926
   45    HB2  SER   7           HB2      SER   7 -18.248  -0.818   5.728
   46    HB3  SER   7           HB3      SER   7 -18.414   0.452   4.521
   47    HG   SER   7           HG       SER   7 -20.673  -0.068   4.469
   48    H    THR   8           H        THR   8 -17.761  -3.005   1.890
   49    HA   THR   8           HA       THR   8 -14.911  -2.467   2.580
   50    HB   THR   8           HB       THR   8 -16.040  -4.402   0.536
   51    HG1  THR   8           HG1      THR   8 -16.485  -5.776   2.110
   52   HG21  THR   8          HG21      THR   8 -13.964  -5.683   1.357
   53   HG22  THR   8          HG22      THR   8 -13.476  -4.167   2.111
   54   HG23  THR   8          HG23      THR   8 -13.680  -4.256   0.362
   55    H    GLY   9           H        GLY   9 -16.324  -0.291   1.355
   56    HA2  GLY   9           HA2      GLY   9 -15.346  -0.309  -1.463
   57    HA3  GLY   9           HA3      GLY   9 -16.531   0.825  -0.809
   58    H    LEU  10           H        LEU  10 -15.789   2.562   0.525
   59    HA   LEU  10           HA       LEU  10 -13.243   3.695  -0.171
   60    HB2  LEU  10           HB2      LEU  10 -15.628   4.453   1.103
   61    HB3  LEU  10           HB3      LEU  10 -14.394   4.640   2.347
   62    HG   LEU  10           HG       LEU  10 -14.618   6.721   1.074
   63   HD11  LEU  10          HD11      LEU  10 -12.323   7.092   0.658
   64   HD12  LEU  10          HD12      LEU  10 -12.059   5.430   0.131
   65   HD13  LEU  10          HD13      LEU  10 -12.332   5.781   1.838
   66   HD21  LEU  10          HD21      LEU  10 -15.459   5.639  -1.024
   67   HD22  LEU  10          HD22      LEU  10 -13.820   5.074  -1.348
   68   HD23  LEU  10          HD23      LEU  10 -14.169   6.803  -1.320
   69    H    LEU  11           H        LEU  11 -14.365   1.870   2.682
   70    HA   LEU  11           HA       LEU  11 -12.069   2.140   4.345
   71    HB2  LEU  11           HB2      LEU  11 -14.300   1.175   4.946
   72    HB3  LEU  11           HB3      LEU  11 -13.932  -0.234   3.955
   73    HG   LEU  11           HG       LEU  11 -11.736   0.259   5.757
   74   HD11  LEU  11          HD11      LEU  11 -14.479   0.003   7.031
   75   HD12  LEU  11          HD12      LEU  11 -13.373   1.367   7.198
   76   HD13  LEU  11          HD13      LEU  11 -12.949  -0.201   7.883
   77   HD21  LEU  11          HD21      LEU  11 -13.786  -1.945   5.394
   78   HD22  LEU  11          HD22      LEU  11 -12.428  -2.072   6.512
   79   HD23  LEU  11          HD23      LEU  11 -12.132  -1.905   4.782
   80    H    HIS  12           H        HIS  12 -12.853  -0.349   1.891
   81    HA   HIS  12           HA       HIS  12 -10.370  -1.801   2.123
   82    HB2  HIS  12           HB2      HIS  12 -12.621  -2.522   1.150
   83    HB3  HIS  12           HB3      HIS  12 -12.213  -1.570  -0.276
   84    HD1  HIS  12           HD1      HIS  12 -12.308  -4.040  -1.444
   85    HD2  HIS  12           HD2      HIS  12  -9.095  -3.321   1.113
   86    HE1  HIS  12           HE1      HIS  12 -10.565  -5.800  -1.971
   87    H    LEU  13           H        LEU  13 -11.515   0.719  -0.155
   88    HA   LEU  13           HA       LEU  13  -9.234   0.857  -1.842
   89    HB2  LEU  13           HB2      LEU  13 -11.527   1.963  -2.049
   90    HB3  LEU  13           HB3      LEU  13 -10.947   3.179  -0.910
   91    HG   LEU  13           HG       LEU  13  -8.924   3.402  -2.543
   92   HD11  LEU  13          HD11      LEU  13 -10.973   1.905  -4.178
   93   HD12  LEU  13          HD12      LEU  13  -9.246   1.586  -4.022
   94   HD13  LEU  13          HD13      LEU  13  -9.805   2.983  -4.943
   95   HD21  LEU  13          HD21      LEU  13 -10.275   5.296  -2.404
   96   HD22  LEU  13          HD22      LEU  13 -11.727   4.422  -2.886
   97   HD23  LEU  13          HD23      LEU  13 -10.511   4.845  -4.092
   98    H    HIS  14           H        HIS  14  -9.913   2.525   1.247
   99    HA   HIS  14           HA       HIS  14  -7.582   4.175   1.348
  100    HB2  HIS  14           HB2      HIS  14  -9.389   4.594   2.844
  101    HB3  HIS  14           HB3      HIS  14  -9.436   2.918   3.385
  102    HD1  HIS  14           HD1      HIS  14  -8.683   2.886   5.766
  103    HD2  HIS  14           HD2      HIS  14  -6.358   5.470   3.462
  104    HE1  HIS  14           HE1      HIS  14  -6.848   3.752   7.283
  105    H    GLN  15           H        GLN  15  -8.167   0.892   2.668
  106    HA   GLN  15           HA       GLN  15  -5.648   0.445   3.877
  107    HB2  GLN  15           HB2      GLN  15  -7.721  -0.965   4.020
  108    HB3  GLN  15           HB3      GLN  15  -7.407  -1.531   2.381
  109    HG2  GLN  15           HG2      GLN  15  -6.467  -3.203   3.782
  110    HG3  GLN  15           HG3      GLN  15  -5.089  -2.240   3.253
  111   HE21  GLN  15          HE21      GLN  15  -3.912  -1.064   4.858
  112   HE22  GLN  15          HE22      GLN  15  -4.306  -1.103   6.509
  113    H    ASN  16           H        ASN  16  -6.667  -0.202   0.492
  114    HA   ASN  16           HA       ASN  16  -4.173  -1.310  -0.396
  115    HB2  ASN  16           HB2      ASN  16  -6.196  -1.602  -1.663
  116    HB3  ASN  16           HB3      ASN  16  -6.453   0.139  -1.770
  117   HD21  ASN  16          HD21      ASN  16  -3.704  -2.110  -2.536
  118   HD22  ASN  16          HD22      ASN  16  -3.395  -1.426  -4.059
  119    H    ILE  17           H        ILE  17  -5.449   2.040  -0.772
  120    HA   ILE  17           HA       ILE  17  -3.156   3.171  -2.017
  121    HB   ILE  17           HB       ILE  17  -5.289   4.296  -0.173
  122   HG12  ILE  17          HG12      ILE  17  -4.932   4.596  -3.170
  123   HG13  ILE  17          HG13      ILE  17  -5.894   3.306  -2.448
  124   HG21  ILE  17          HG21      ILE  17  -4.614   6.523  -1.129
  125   HG22  ILE  17          HG22      ILE  17  -3.193   5.743  -1.825
  126   HG23  ILE  17          HG23      ILE  17  -3.393   5.813  -0.073
  127   HD11  ILE  17          HD11      ILE  17  -7.475   5.003  -2.891
  128   HD12  ILE  17          HD12      ILE  17  -6.381   6.281  -2.362
  129   HD13  ILE  17          HD13      ILE  17  -7.115   5.203  -1.175
  130    H    VAL  18           H        VAL  18  -3.946   2.886   1.463
  131    HA   VAL  18           HA       VAL  18  -1.534   4.213   2.377
  132    HB   VAL  18           HB       VAL  18  -3.692   2.478   3.583
  133   HG11  VAL  18          HG11      VAL  18  -2.524   3.373   5.802
  134   HG12  VAL  18          HG12      VAL  18  -1.082   3.304   4.789
  135   HG13  VAL  18          HG13      VAL  18  -2.035   1.846   5.068
  136   HG21  VAL  18          HG21      VAL  18  -3.948   4.686   4.908
  137   HG22  VAL  18          HG22      VAL  18  -4.425   4.697   3.211
  138   HG23  VAL  18          HG23      VAL  18  -2.874   5.382   3.695
  139    H    ASP  19           H        ASP  19  -2.397   0.865   1.657
  140    HA   ASP  19           HA       ASP  19  -0.033  -0.342   2.840
  141    HB2  ASP  19           HB2      ASP  19  -2.292  -1.130   1.036
  142    HB3  ASP  19           HB3      ASP  19  -0.883  -2.184   1.096
  143    H    VAL  20           H        VAL  20  -0.478   1.501  -0.029
  144    HA   VAL  20           HA       VAL  20   1.875   0.220  -1.346
  145    HB   VAL  20           HB       VAL  20  -0.176   2.225  -2.346
  146   HG11  VAL  20          HG11      VAL  20   0.780   1.922  -4.512
  147   HG12  VAL  20          HG12      VAL  20   1.756   0.557  -3.970
  148   HG13  VAL  20          HG13      VAL  20   2.148   2.190  -3.433
  149   HG21  VAL  20          HG21      VAL  20  -0.003  -0.562  -3.392
  150   HG22  VAL  20          HG22      VAL  20  -1.418   0.463  -3.157
  151   HG23  VAL  20          HG23      VAL  20  -0.692  -0.366  -1.780
  152    H    GLN  21           H        GLN  21   0.663   3.300  -0.082
  153    HA   GLN  21           HA       GLN  21   2.957   4.883  -0.875
  154    HB2  GLN  21           HB2      GLN  21   0.409   5.198   0.410
  155    HB3  GLN  21           HB3      GLN  21   1.637   5.974   1.410
  156    HG2  GLN  21           HG2      GLN  21   1.454   6.421  -1.576
  157    HG3  GLN  21           HG3      GLN  21   0.607   7.437  -0.410
  158   HE21  GLN  21          HE21      GLN  21   1.851   8.977   0.790
  159   HE22  GLN  21          HE22      GLN  21   3.516   9.203   0.555
  160    H    TYR  22           H        TYR  22   2.106   3.094   2.105
  161    HA   TYR  22           HA       TYR  22   4.227   4.094   3.746
  162    HB2  TYR  22           HB2      TYR  22   3.353   2.599   5.250
  163    HB3  TYR  22           HB3      TYR  22   2.061   2.480   4.063
  164    HD1  TYR  22           HD1      TYR  22   5.121   0.856   5.379
  165    HD2  TYR  22           HD2      TYR  22   1.776   0.504   2.715
  166    HE1  TYR  22           HE1      TYR  22   5.596  -1.561   5.100
  167    HE2  TYR  22           HE2      TYR  22   2.247  -1.912   2.437
  168    HH   TYR  22           HH       TYR  22   3.485  -3.730   3.987
  169    H    MET  23           H        MET  23   4.165   1.562   1.273
  170    HA   MET  23           HA       MET  23   6.942   0.721   1.900
  171    HB2  MET  23           HB2      MET  23   4.578  -0.334   0.589
  172    HB3  MET  23           HB3      MET  23   5.980  -0.485  -0.468
  173    HG2  MET  23           HG2      MET  23   6.270  -1.245   2.415
  174    HG3  MET  23           HG3      MET  23   5.445  -2.358   1.325
  175    HE1  MET  23           HE1      MET  23   9.673  -2.319   2.166
  176    HE2  MET  23           HE2      MET  23   8.262  -3.111   2.861
  177    HE3  MET  23           HE3      MET  23   8.401  -1.356   2.928
  178    H    TYR  24           H        TYR  24   5.810   3.395   0.443
  179    HA   TYR  24           HA       TYR  24   7.622   3.273  -1.933
  180    HB2  TYR  24           HB2      TYR  24   5.097   4.634  -1.168
  181    HB3  TYR  24           HB3      TYR  24   6.216   5.606  -2.122
  182    HD1  TYR  24           HD1      TYR  24   5.716   1.901  -2.248
  183    HD2  TYR  24           HD2      TYR  24   5.180   5.666  -4.247
  184    HE1  TYR  24           HE1      TYR  24   5.001   0.709  -4.299
  185    HE2  TYR  24           HE2      TYR  24   4.464   4.473  -6.298
  186    HH   TYR  24           HH       TYR  24   5.075   1.546  -7.028
  187    H    GLY  25           H        GLY  25   8.352   3.768   1.042
  188    HA2  GLY  25           HA2      GLY  25  10.204   5.975   0.515
  189    HA3  GLY  25           HA3      GLY  25   8.989   6.340   1.740
  190    H    LEU  26           H        LEU  26  10.676   3.261   1.082
  191    HA   LEU  26           HA       LEU  26  12.203   3.493   3.618
  192    HB2  LEU  26           HB2      LEU  26   9.692   2.039   3.232
  193    HB3  LEU  26           HB3      LEU  26  10.982   0.992   3.821
  194    HG   LEU  26           HG       LEU  26  10.724   3.657   5.125
  195   HD11  LEU  26          HD11      LEU  26   8.365   2.820   4.869
  196   HD12  LEU  26          HD12      LEU  26   8.893   2.947   6.547
  197   HD13  LEU  26          HD13      LEU  26   8.836   1.371   5.757
  198   HD21  LEU  26          HD21      LEU  26  12.431   1.901   5.718
  199   HD22  LEU  26          HD22      LEU  26  11.106   0.858   6.234
  200   HD23  LEU  26          HD23      LEU  26  11.408   2.381   7.072
  201    H    SER  27           H        SER  27  12.612   2.999   0.559
  202    HA   SER  27           HA       SER  27  13.651   0.294   0.328
  203    HB2  SER  27           HB2      SER  27  13.676   2.824  -1.296
  204    HB3  SER  27           HB3      SER  27  14.685   1.464  -1.785
  205    HG   SER  27           HG       SER  27  12.787   1.051  -2.744
  206    HA   PRO  28           HA       PRO  28  17.936   2.418   0.685
  207    HB2  PRO  28           HB2      PRO  28  18.048   5.000   1.593
  208    HB3  PRO  28           HB3      PRO  28  17.929   4.579  -0.128
  209    HG2  PRO  28           HG2      PRO  28  15.807   5.484   1.749
  210    HG3  PRO  28           HG3      PRO  28  16.055   5.888   0.043
  211    HD2  PRO  28           HD2      PRO  28  14.208   4.084   0.912
  212    HD3  PRO  28           HD3      PRO  28  14.967   4.017  -0.692
  213    H    ALA  29           H        ALA  29  15.404   2.640   2.969
  214    HA   ALA  29           HA       ALA  29  17.202   2.913   5.313
  215    HB1  ALA  29           HB1      ALA  29  15.021   4.108   5.150
  216    HB2  ALA  29           HB2      ALA  29  15.064   3.010   6.530
  217    HB3  ALA  29           HB3      ALA  29  14.196   2.551   5.066
  218    H    ILE  30           H        ILE  30  15.971   0.406   3.340
  219    HA   ILE  30           HA       ILE  30  16.303  -1.593   5.550
  220    HB   ILE  30           HB       ILE  30  14.603  -1.588   3.038
  221   HG12  ILE  30          HG12      ILE  30  13.699  -0.244   4.893
  222   HG13  ILE  30          HG13      ILE  30  12.732  -1.700   4.668
  223   HG21  ILE  30          HG21      ILE  30  15.182  -3.765   5.053
  224   HG22  ILE  30          HG22      ILE  30  15.295  -3.848   3.294
  225   HG23  ILE  30          HG23      ILE  30  13.715  -3.768   4.075
  226   HD11  ILE  30          HD11      ILE  30  13.023  -1.912   6.927
  227   HD12  ILE  30          HD12      ILE  30  14.485  -0.925   6.933
  228   HD13  ILE  30          HD13      ILE  30  14.566  -2.619   6.452
  229    H    THR  31           H        THR  31  16.991  -0.873   2.138
  230    HA   THR  31           HA       THR  31  18.401  -3.281   1.497
  231    HB   THR  31           HB       THR  31  17.497  -1.506  -0.060
  232    HG1  THR  31           HG1      THR  31  19.016  -1.973  -1.538
  233   HG21  THR  31          HG21      THR  31  20.074  -0.021   0.304
  234   HG22  THR  31          HG22      THR  31  18.741   0.314   1.410
  235   HG23  THR  31          HG23      THR  31  18.529   0.554  -0.324
  236    H    LYS  32           H        LYS  32  19.408  -0.433   3.308
  237    HA   LYS  32           HA       LYS  32  22.268  -1.258   3.167
  238    HB2  LYS  32           HB2      LYS  32  20.709   1.179   3.987
  239    HB3  LYS  32           HB3      LYS  32  22.364   0.978   4.559
  240    HG2  LYS  32           HG2      LYS  32  21.855   0.527   1.652
  241    HG3  LYS  32           HG3      LYS  32  21.817   2.191   2.235
  242    HD2  LYS  32           HD2      LYS  32  24.056   1.532   3.439
  243    HD3  LYS  32           HD3      LYS  32  24.102   0.240   2.240
  244    HE2  LYS  32           HE2      LYS  32  24.022   1.848   0.414
  245    HE3  LYS  32           HE3      LYS  32  23.785   3.186   1.555
  246    HZ1  LYS  32           HZ1      LYS  32  26.123   1.345   1.542
  247    HZ2  LYS  32           HZ2      LYS  32  25.890   2.663   2.591
  248    HZ3  LYS  32           HZ3      LYS  32  26.132   2.927   0.930
  249    H    TYR  33           H        TYR  33  19.604  -1.931   5.102
  250    HA   TYR  33           HA       TYR  33  21.230  -2.137   7.606
  251    HB2  TYR  33           HB2      TYR  33  18.305  -1.894   6.928
  252    HB3  TYR  33           HB3      TYR  33  18.798  -2.506   8.505
  253    HD1  TYR  33           HD1      TYR  33  19.237   0.368   6.161
  254    HD2  TYR  33           HD2      TYR  33  19.510  -1.034  10.212
  255    HE1  TYR  33           HE1      TYR  33  19.650   2.688   6.936
  256    HE2  TYR  33           HE2      TYR  33  19.922   1.284  10.987
  257    HH   TYR  33           HH       TYR  33  19.233   3.931   9.309
  258    H    VAL  34           H        VAL  34  20.339  -4.084   5.026
  259    HA   VAL  34           HA       VAL  34  20.209  -6.524   6.771
  260    HB   VAL  34           HB       VAL  34  19.011  -6.025   4.019
  261   HG11  VAL  34          HG11      VAL  34  17.763  -8.185   5.332
  262   HG12  VAL  34          HG12      VAL  34  19.495  -8.425   5.568
  263   HG13  VAL  34          HG13      VAL  34  18.840  -8.269   3.939
  264   HG21  VAL  34          HG21      VAL  34  16.854  -5.968   5.187
  265   HG22  VAL  34          HG22      VAL  34  17.915  -4.722   5.841
  266   HG23  VAL  34          HG23      VAL  34  17.663  -6.221   6.734
  267    H    VAL  35           H        VAL  35  20.998  -5.589   3.394
  268    HA   VAL  35           HA       VAL  35  22.719  -6.269   1.958
  269    HB   VAL  35           HB       VAL  35  23.736  -5.313   4.335
  270   HG11  VAL  35          HG11      VAL  35  24.169  -7.908   4.782
  271   HG12  VAL  35          HG12      VAL  35  25.353  -6.688   5.246
  272   HG13  VAL  35          HG13      VAL  35  25.571  -7.603   3.755
  273   HG21  VAL  35          HG21      VAL  35  25.786  -4.954   3.066
  274   HG22  VAL  35          HG22      VAL  35  24.396  -4.737   2.004
  275   HG23  VAL  35          HG23      VAL  35  25.338  -6.226   1.930
  276    H    ARG  36           H        ARG  36  20.933  -8.412   3.345
  277    HA   ARG  36           HA       ARG  36  20.740 -10.756   3.300
  278    HB2  ARG  36           HB2      ARG  36  21.581  -9.955   0.926
  279    HB3  ARG  36           HB3      ARG  36  23.071 -10.773   1.395
  280    HG2  ARG  36           HG2      ARG  36  21.186 -12.634   2.106
  281    HG3  ARG  36           HG3      ARG  36  20.444 -11.912   0.678
  282    HD2  ARG  36           HD2      ARG  36  21.788 -13.641  -0.229
  283    HD3  ARG  36           HD3      ARG  36  22.822 -12.208  -0.397
  284    HE   ARG  36           HE       ARG  36  23.603 -12.986   2.038
  285   HH11  ARG  36          HH11      ARG  36  22.301 -15.661   1.744
  286   HH12  ARG  36          HH12      ARG  36  23.581 -16.627   1.090
  287   HH21  ARG  36          HH21      ARG  36  25.500 -13.893   0.123
  288   HH22  ARG  36          HH22      ARG  36  25.401 -15.622   0.169
  Start of MODEL   13
    1    HA   SER   1           HA       SER   1 -25.898  -6.461   4.978
    2    HB2  SER   1           HB2      SER   1 -24.069  -6.869   3.236
    3    HB3  SER   1           HB3      SER   1 -24.490  -8.258   4.233
    4    HG   SER   1           HG       SER   1 -25.182  -7.692   1.550
    5    H    ASP   2           H        ASP   2 -26.292  -4.340   4.495
    6    HA   ASP   2           HA       ASP   2 -26.961  -3.624   1.655
    7    HB2  ASP   2           HB2      ASP   2 -28.137  -2.634   4.274
    8    HB3  ASP   2           HB3      ASP   2 -28.510  -1.940   2.697
    9    H    LEU   3           H        LEU   3 -24.320  -3.509   2.585
   10    HA   LEU   3           HA       LEU   3 -23.781  -0.604   2.415
   11    HB2  LEU   3           HB2      LEU   3 -24.174  -1.464   4.851
   12    HB3  LEU   3           HB3      LEU   3 -22.576  -2.187   4.677
   13    HG   LEU   3           HG       LEU   3 -21.867   0.194   3.854
   14   HD11  LEU   3          HD11      LEU   3 -24.321   0.862   5.509
   15   HD12  LEU   3          HD12      LEU   3 -24.223   1.033   3.757
   16   HD13  LEU   3          HD13      LEU   3 -23.190   2.013   4.798
   17   HD21  LEU   3          HD21      LEU   3 -21.917   0.864   6.465
   18   HD22  LEU   3          HD22      LEU   3 -20.826  -0.365   5.827
   19   HD23  LEU   3          HD23      LEU   3 -22.333  -0.844   6.609
   20    HA   PRO   4           HA       PRO   4 -20.621  -3.588   0.613
   21    HB2  PRO   4           HB2      PRO   4 -21.226  -3.315  -2.038
   22    HB3  PRO   4           HB3      PRO   4 -21.971  -4.540  -0.995
   23    HG2  PRO   4           HG2      PRO   4 -23.081  -1.992  -2.004
   24    HG3  PRO   4           HG3      PRO   4 -23.899  -3.514  -1.627
   25    HD2  PRO   4           HD2      PRO   4 -23.877  -1.240  -0.023
   26    HD3  PRO   4           HD3      PRO   4 -24.318  -2.876   0.508
   27    H    ALA   5           H        ALA   5 -21.509  -0.307   0.278
   28    HA   ALA   5           HA       ALA   5 -19.030   0.387  -1.240
   29    HB1  ALA   5           HB1      ALA   5 -21.447   2.036  -0.428
   30    HB2  ALA   5           HB2      ALA   5 -21.250   1.233  -1.987
   31    HB3  ALA   5           HB3      ALA   5 -20.167   2.548  -1.528
   32    H    LEU   6           H        LEU   6 -20.615   0.797   1.911
   33    HA   LEU   6           HA       LEU   6 -18.534   2.680   2.846
   34    HB2  LEU   6           HB2      LEU   6 -21.215   2.223   3.390
   35    HB3  LEU   6           HB3      LEU   6 -20.406   1.534   4.798
   36    HG   LEU   6           HG       LEU   6 -19.007   3.794   4.669
   37   HD11  LEU   6          HD11      LEU   6 -21.661   4.477   3.364
   38   HD12  LEU   6          HD12      LEU   6 -20.068   4.618   2.624
   39   HD13  LEU   6          HD13      LEU   6 -20.507   5.662   3.975
   40   HD21  LEU   6          HD21      LEU   6 -21.742   3.284   5.834
   41   HD22  LEU   6          HD22      LEU   6 -20.933   4.829   6.098
   42   HD23  LEU   6          HD23      LEU   6 -20.184   3.334   6.657
   43    H    SER   7           H        SER   7 -19.436  -0.735   3.254
   44    HA   SER   7           HA       SER   7 -17.519  -1.208   5.411
   45    HB2  SER   7           HB2      SER   7 -19.234  -2.945   3.630
   46    HB3  SER   7           HB3      SER   7 -18.188  -3.615   4.877
   47    HG   SER   7           HG       SER   7 -20.088  -3.291   5.887
   48    H    THR   8           H        THR   8 -17.671  -2.075   1.948
   49    HA   THR   8           HA       THR   8 -14.703  -2.535   2.039
   50    HB   THR   8           HB       THR   8 -15.286  -4.229   0.175
   51    HG1  THR   8           HG1      THR   8 -17.307  -4.097  -0.365
   52   HG21  THR   8          HG21      THR   8 -15.967  -5.945   1.849
   53   HG22  THR   8          HG22      THR   8 -16.258  -4.654   3.013
   54   HG23  THR   8          HG23      THR   8 -14.627  -4.946   2.409
   55    H    GLY   9           H        GLY   9 -16.354  -0.088   1.205
   56    HA2  GLY   9           HA2      GLY   9 -15.618   0.020  -1.686
   57    HA3  GLY   9           HA3      GLY   9 -16.730   1.131  -0.885
   58    H    LEU  10           H        LEU  10 -15.780   2.615   0.748
   59    HA   LEU  10           HA       LEU  10 -13.258   3.762  -0.201
   60    HB2  LEU  10           HB2      LEU  10 -15.488   4.414   1.624
   61    HB3  LEU  10           HB3      LEU  10 -13.925   5.035   2.155
   62    HG   LEU  10           HG       LEU  10 -13.969   5.555  -0.591
   63   HD11  LEU  10          HD11      LEU  10 -16.105   6.825  -0.855
   64   HD12  LEU  10          HD12      LEU  10 -16.659   6.152   0.678
   65   HD13  LEU  10          HD13      LEU  10 -16.361   5.087  -0.696
   66   HD21  LEU  10          HD21      LEU  10 -13.055   6.996   1.199
   67   HD22  LEU  10          HD22      LEU  10 -14.693   7.375   1.729
   68   HD23  LEU  10          HD23      LEU  10 -14.135   7.906   0.143
   69    H    LEU  11           H        LEU  11 -14.328   1.837   2.594
   70    HA   LEU  11           HA       LEU  11 -11.961   2.066   4.195
   71    HB2  LEU  11           HB2      LEU  11 -14.389   1.037   4.558
   72    HB3  LEU  11           HB3      LEU  11 -13.592  -0.452   4.053
   73    HG   LEU  11           HG       LEU  11 -11.776   0.175   5.799
   74   HD11  LEU  11          HD11      LEU  11 -14.112   1.839   6.792
   75   HD12  LEU  11          HD12      LEU  11 -12.596   2.486   6.165
   76   HD13  LEU  11          HD13      LEU  11 -12.605   1.553   7.661
   77   HD21  LEU  11          HD21      LEU  11 -13.289  -0.749   7.661
   78   HD22  LEU  11          HD22      LEU  11 -13.149  -1.731   6.203
   79   HD23  LEU  11          HD23      LEU  11 -14.584  -0.738   6.463
   80    H    HIS  12           H        HIS  12 -12.910  -0.320   1.701
   81    HA   HIS  12           HA       HIS  12 -10.564  -1.966   1.872
   82    HB2  HIS  12           HB2      HIS  12 -12.985  -1.912   0.509
   83    HB3  HIS  12           HB3      HIS  12 -11.802  -1.690  -0.780
   84    HD1  HIS  12           HD1      HIS  12 -10.188  -3.643  -1.279
   85    HD2  HIS  12           HD2      HIS  12 -12.805  -4.422   1.873
   86    HE1  HIS  12           HE1      HIS  12  -9.996  -6.119  -0.781
   87    H    LEU  13           H        LEU  13 -11.336   0.918  -0.084
   88    HA   LEU  13           HA       LEU  13  -8.924   0.889  -1.672
   89    HB2  LEU  13           HB2      LEU  13 -11.305   2.214  -1.688
   90    HB3  LEU  13           HB3      LEU  13 -10.252   3.467  -1.029
   91    HG   LEU  13           HG       LEU  13  -8.650   2.779  -2.989
   92   HD11  LEU  13          HD11      LEU  13  -9.645   1.762  -4.871
   93   HD12  LEU  13          HD12      LEU  13 -11.280   2.044  -4.272
   94   HD13  LEU  13          HD13      LEU  13 -10.263   0.815  -3.518
   95   HD21  LEU  13          HD21      LEU  13  -9.796   4.412  -4.467
   96   HD22  LEU  13          HD22      LEU  13  -9.760   4.970  -2.794
   97   HD23  LEU  13          HD23      LEU  13 -11.243   4.289  -3.465
   98    H    HIS  14           H        HIS  14  -9.765   2.332   1.473
   99    HA   HIS  14           HA       HIS  14  -7.498   4.032   1.806
  100    HB2  HIS  14           HB2      HIS  14  -9.336   4.232   3.305
  101    HB3  HIS  14           HB3      HIS  14  -9.348   2.503   3.651
  102    HD1  HIS  14           HD1      HIS  14  -8.041   1.746   5.661
  103    HD2  HIS  14           HD2      HIS  14  -6.946   5.583   4.454
  104    HE1  HIS  14           HE1      HIS  14  -6.446   2.623   7.421
  105    H    GLN  15           H        GLN  15  -7.962   0.762   3.231
  106    HA   GLN  15           HA       GLN  15  -5.260   0.372   4.047
  107    HB2  GLN  15           HB2      GLN  15  -7.704  -0.969   4.136
  108    HB3  GLN  15           HB3      GLN  15  -6.678  -2.045   3.187
  109    HG2  GLN  15           HG2      GLN  15  -6.407  -2.639   5.512
  110    HG3  GLN  15           HG3      GLN  15  -4.926  -1.836   4.990
  111   HE21  GLN  15          HE21      GLN  15  -4.226  -0.584   6.743
  112   HE22  GLN  15          HE22      GLN  15  -5.222   0.441   7.659
  113    H    ASN  16           H        ASN  16  -6.781   0.004   0.891
  114    HA   ASN  16           HA       ASN  16  -4.647  -1.602  -0.291
  115    HB2  ASN  16           HB2      ASN  16  -7.109  -1.462  -0.946
  116    HB3  ASN  16           HB3      ASN  16  -6.746   0.114  -1.647
  117   HD21  ASN  16          HD21      ASN  16  -5.002   0.119  -3.398
  118   HD22  ASN  16          HD22      ASN  16  -4.836  -1.268  -4.362
  119    H    ILE  17           H        ILE  17  -5.554   1.869  -0.379
  120    HA   ILE  17           HA       ILE  17  -3.265   2.560  -2.092
  121    HB   ILE  17           HB       ILE  17  -5.400   4.121  -0.602
  122   HG12  ILE  17          HG12      ILE  17  -4.967   3.778  -3.582
  123   HG13  ILE  17          HG13      ILE  17  -5.965   2.673  -2.638
  124   HG21  ILE  17          HG21      ILE  17  -4.602   6.042  -2.074
  125   HG22  ILE  17          HG22      ILE  17  -3.160   5.084  -2.404
  126   HG23  ILE  17          HG23      ILE  17  -3.513   5.607  -0.758
  127   HD11  ILE  17          HD11      ILE  17  -6.378   5.672  -2.825
  128   HD12  ILE  17          HD12      ILE  17  -7.387   4.546  -1.918
  129   HD13  ILE  17          HD13      ILE  17  -7.331   4.459  -3.678
  130    H    VAL  18           H        VAL  18  -4.101   2.828   1.360
  131    HA   VAL  18           HA       VAL  18  -1.878   4.458   2.151
  132    HB   VAL  18           HB       VAL  18  -3.661   2.450   3.550
  133   HG11  VAL  18          HG11      VAL  18  -1.543   4.271   4.724
  134   HG12  VAL  18          HG12      VAL  18  -1.626   2.513   4.853
  135   HG13  VAL  18          HG13      VAL  18  -2.821   3.516   5.675
  136   HG21  VAL  18          HG21      VAL  18  -4.612   4.548   4.526
  137   HG22  VAL  18          HG22      VAL  18  -4.769   4.480   2.770
  138   HG23  VAL  18          HG23      VAL  18  -3.517   5.480   3.505
  139    H    ASP  19           H        ASP  19  -2.213   0.955   1.739
  140    HA   ASP  19           HA       ASP  19   0.474   0.423   2.836
  141    HB2  ASP  19           HB2      ASP  19  -1.955  -0.990   2.292
  142    HB3  ASP  19           HB3      ASP  19  -0.651  -1.797   1.424
  143    H    VAL  20           H        VAL  20  -0.121   2.016   0.170
  144    HA   VAL  20           HA       VAL  20   1.448   0.339  -1.725
  145    HB   VAL  20           HB       VAL  20  -0.341   2.760  -1.899
  146   HG11  VAL  20          HG11      VAL  20   0.233   2.632  -4.420
  147   HG12  VAL  20          HG12      VAL  20   1.699   1.801  -3.899
  148   HG13  VAL  20          HG13      VAL  20   1.380   3.448  -3.355
  149   HG21  VAL  20          HG21      VAL  20  -0.910   0.136  -2.065
  150   HG22  VAL  20          HG22      VAL  20  -0.465   0.428  -3.747
  151   HG23  VAL  20          HG23      VAL  20  -1.775   1.350  -3.008
  152    H    GLN  21           H        GLN  21   1.441   3.596  -0.271
  153    HA   GLN  21           HA       GLN  21   3.859   4.568  -1.421
  154    HB2  GLN  21           HB2      GLN  21   2.122   5.135   0.927
  155    HB3  GLN  21           HB3      GLN  21   3.758   5.788   1.006
  156    HG2  GLN  21           HG2      GLN  21   2.607   7.508  -0.084
  157    HG3  GLN  21           HG3      GLN  21   3.276   6.600  -1.438
  158   HE21  GLN  21          HE21      GLN  21   1.425   7.473  -2.754
  159   HE22  GLN  21          HE22      GLN  21  -0.104   6.748  -2.620
  160    H    TYR  22           H        TYR  22   3.334   2.314   1.237
  161    HA   TYR  22           HA       TYR  22   5.965   2.501   2.434
  162    HB2  TYR  22           HB2      TYR  22   4.100   0.106   2.354
  163    HB3  TYR  22           HB3      TYR  22   5.287   0.487   3.595
  164    HD1  TYR  22           HD1      TYR  22   4.561   3.578   3.518
  165    HD2  TYR  22           HD2      TYR  22   2.273  -0.031   3.962
  166    HE1  TYR  22           HE1      TYR  22   2.822   4.832   4.757
  167    HE2  TYR  22           HE2      TYR  22   0.535   1.223   5.201
  168    HH   TYR  22           HH       TYR  22   0.823   3.774   6.691
  169    H    MET  23           H        MET  23   4.524   0.253   0.056
  170    HA   MET  23           HA       MET  23   7.037  -1.166  -0.416
  171    HB2  MET  23           HB2      MET  23   4.205  -1.291  -1.148
  172    HB3  MET  23           HB3      MET  23   5.255  -1.678  -2.509
  173    HG2  MET  23           HG2      MET  23   5.668  -2.917   0.216
  174    HG3  MET  23           HG3      MET  23   4.580  -3.630  -0.974
  175    HE1  MET  23           HE1      MET  23   8.648  -4.820  -0.462
  176    HE2  MET  23           HE2      MET  23   7.071  -5.292   0.165
  177    HE3  MET  23           HE3      MET  23   7.730  -3.706   0.560
  178    H    TYR  24           H        TYR  24   5.260   1.490  -1.958
  179    HA   TYR  24           HA       TYR  24   7.413   1.703  -4.038
  180    HB2  TYR  24           HB2      TYR  24   4.487   2.450  -3.893
  181    HB3  TYR  24           HB3      TYR  24   5.542   3.147  -5.120
  182    HD1  TYR  24           HD1      TYR  24   4.094  -0.008  -3.819
  183    HD2  TYR  24           HD2      TYR  24   6.355   1.835  -6.972
  184    HE1  TYR  24           HE1      TYR  24   3.847  -2.056  -5.194
  185    HE2  TYR  24           HE2      TYR  24   6.108  -0.213  -8.346
  186    HH   TYR  24           HH       TYR  24   5.526  -3.014  -7.383
  187    H    GLY  25           H        GLY  25   8.239   2.709  -1.656
  188    HA2  GLY  25           HA2      GLY  25   7.925   5.664  -1.999
  189    HA3  GLY  25           HA3      GLY  25   7.891   4.935  -0.395
  190    H    LEU  26           H        LEU  26   9.900   3.525   0.092
  191    HA   LEU  26           HA       LEU  26  12.228   3.484   0.479
  192    HB2  LEU  26           HB2      LEU  26  11.889   4.031  -2.466
  193    HB3  LEU  26           HB3      LEU  26  13.503   3.946  -1.764
  194    HG   LEU  26           HG       LEU  26  11.563   1.766  -1.102
  195   HD11  LEU  26          HD11      LEU  26  12.086   0.553  -3.132
  196   HD12  LEU  26          HD12      LEU  26  13.170   1.835  -3.672
  197   HD13  LEU  26          HD13      LEU  26  11.433   2.126  -3.590
  198   HD21  LEU  26          HD21      LEU  26  13.792   1.838  -0.053
  199   HD22  LEU  26          HD22      LEU  26  14.549   1.875  -1.646
  200   HD23  LEU  26          HD23      LEU  26  13.661   0.443  -1.124
  201    H    SER  27           H        SER  27  10.748   6.063   0.905
  202    HA   SER  27           HA       SER  27  12.257   8.314   0.013
  203    HB2  SER  27           HB2      SER  27  10.836   8.118   2.670
  204    HB3  SER  27           HB3      SER  27  10.955   9.506   1.596
  205    HG   SER  27           HG       SER  27   9.519   8.578   0.230
  206    HA   PRO  28           HA       PRO  28  14.718   8.011   4.132
  207    HB2  PRO  28           HB2      PRO  28  14.640   5.641   5.502
  208    HB3  PRO  28           HB3      PRO  28  13.522   6.983   5.819
  209    HG2  PRO  28           HG2      PRO  28  13.095   4.502   4.227
  210    HG3  PRO  28           HG3      PRO  28  11.994   5.332   5.338
  211    HD2  PRO  28           HD2      PRO  28  11.804   5.550   2.645
  212    HD3  PRO  28           HD3      PRO  28  11.326   6.851   3.755
  213    H    ALA  29           H        ALA  29  14.370   5.142   2.124
  214    HA   ALA  29           HA       ALA  29  16.988   4.028   2.424
  215    HB1  ALA  29           HB1      ALA  29  14.991   4.063   0.138
  216    HB2  ALA  29           HB2      ALA  29  15.152   2.827   1.386
  217    HB3  ALA  29           HB3      ALA  29  16.417   3.026   0.173
  218    H    ILE  30           H        ILE  30  15.743   6.605   0.292
  219    HA   ILE  30           HA       ILE  30  18.396   6.926  -0.994
  220    HB   ILE  30           HB       ILE  30  15.692   8.266  -1.332
  221   HG12  ILE  30          HG12      ILE  30  17.062   6.538  -3.373
  222   HG13  ILE  30          HG13      ILE  30  16.225   5.767  -2.026
  223   HG21  ILE  30          HG21      ILE  30  17.425   9.836  -1.997
  224   HG22  ILE  30          HG22      ILE  30  16.693   9.163  -3.454
  225   HG23  ILE  30          HG23      ILE  30  18.265   8.581  -2.908
  226   HD11  ILE  30          HD11      ILE  30  14.818   6.152  -4.117
  227   HD12  ILE  30          HD12      ILE  30  14.921   7.876  -3.759
  228   HD13  ILE  30          HD13      ILE  30  14.141   6.782  -2.616
  229    H    THR  31           H        THR  31  16.238   8.638   1.234
  230    HA   THR  31           HA       THR  31  17.758  11.086   1.392
  231    HB   THR  31           HB       THR  31  15.849   9.756   3.346
  232    HG1  THR  31           HG1      THR  31  14.675  10.100   1.589
  233   HG21  THR  31          HG21      THR  31  15.447  12.168   4.029
  234   HG22  THR  31          HG22      THR  31  16.890  12.587   3.104
  235   HG23  THR  31          HG23      THR  31  17.014  11.509   4.495
  236    H    LYS  32           H        LYS  32  17.800   8.072   3.323
  237    HA   LYS  32           HA       LYS  32  19.907   9.121   5.106
  238    HB2  LYS  32           HB2      LYS  32  17.870   7.411   5.453
  239    HB3  LYS  32           HB3      LYS  32  19.109   6.243   4.996
  240    HG2  LYS  32           HG2      LYS  32  20.347   6.603   6.898
  241    HG3  LYS  32           HG3      LYS  32  19.885   8.303   7.004
  242    HD2  LYS  32           HD2      LYS  32  17.826   7.815   8.022
  243    HD3  LYS  32           HD3      LYS  32  17.837   6.144   7.460
  244    HE2  LYS  32           HE2      LYS  32  20.135   6.225   8.980
  245    HE3  LYS  32           HE3      LYS  32  19.054   7.302   9.884
  246    HZ1  LYS  32           HZ1      LYS  32  18.636   5.048  10.563
  247    HZ2  LYS  32           HZ2      LYS  32  18.443   4.544   8.952
  248    HZ3  LYS  32           HZ3      LYS  32  17.305   5.589   9.660
  249    H    TYR  33           H        TYR  33  20.287   8.525   2.042
  250    HA   TYR  33           HA       TYR  33  22.658   6.714   2.326
  251    HB2  TYR  33           HB2      TYR  33  20.393   6.595   0.683
  252    HB3  TYR  33           HB3      TYR  33  21.670   7.188  -0.378
  253    HD1  TYR  33           HD1      TYR  33  20.651   4.429   1.874
  254    HD2  TYR  33           HD2      TYR  33  23.550   5.805  -0.983
  255    HE1  TYR  33           HE1      TYR  33  21.601   2.143   1.737
  256    HE2  TYR  33           HE2      TYR  33  24.499   3.518  -1.121
  257    HH   TYR  33           HH       TYR  33  24.325   1.334   0.891
  258    H    VAL  34           H        VAL  34  21.602   9.930   1.466
  259    HA   VAL  34           HA       VAL  34  24.347  10.524   0.412
  260    HB   VAL  34           HB       VAL  34  21.700  11.862  -0.268
  261   HG11  VAL  34          HG11      VAL  34  22.877  13.287  -1.609
  262   HG12  VAL  34          HG12      VAL  34  24.045  12.048  -2.067
  263   HG13  VAL  34          HG13      VAL  34  24.216  12.895  -0.529
  264   HG21  VAL  34          HG21      VAL  34  21.997  10.676  -2.467
  265   HG22  VAL  34          HG22      VAL  34  21.687   9.583  -1.118
  266   HG23  VAL  34          HG23      VAL  34  23.326   9.767  -1.747
  267    H    VAL  35           H        VAL  35  22.229  13.217   0.894
  268    HA   VAL  35           HA       VAL  35  22.389  15.049   2.366
  269    HB   VAL  35           HB       VAL  35  22.732  12.727   4.300
  270   HG11  VAL  35          HG11      VAL  35  22.116  15.645   4.625
  271   HG12  VAL  35          HG12      VAL  35  23.113  14.597   5.631
  272   HG13  VAL  35          HG13      VAL  35  21.356  14.490   5.721
  273   HG21  VAL  35          HG21      VAL  35  20.756  12.493   2.825
  274   HG22  VAL  35          HG22      VAL  35  20.230  14.114   3.278
  275   HG23  VAL  35          HG23      VAL  35  20.271  12.831   4.486
  276    H    ARG  36           H        ARG  36  24.626  15.216   1.158
  277    HA   ARG  36           HA       ARG  36  26.883  15.873   1.293
  278    HB2  ARG  36           HB2      ARG  36  25.553  16.714   3.589
  279    HB3  ARG  36           HB3      ARG  36  26.982  15.900   4.227
  280    HG2  ARG  36           HG2      ARG  36  27.660  17.549   1.931
  281    HG3  ARG  36           HG3      ARG  36  26.866  18.503   3.185
  282    HD2  ARG  36           HD2      ARG  36  28.504  17.923   4.819
  283    HD3  ARG  36           HD3      ARG  36  29.143  16.603   3.817
  284    HE   ARG  36           HE       ARG  36  30.149  18.244   2.349
  285   HH11  ARG  36          HH11      ARG  36  28.162  20.414   2.398
  286   HH12  ARG  36          HH12      ARG  36  28.926  21.629   3.370
  287   HH21  ARG  36          HH21      ARG  36  31.252  19.435   4.737
  288   HH22  ARG  36          HH22      ARG  36  30.684  21.072   4.701
  Start of MODEL   14
    1    HA   SER   1           HA       SER   1 -14.227  -8.318  -2.134
    2    HB2  SER   1           HB2      SER   1 -12.095 -10.432  -2.586
    3    HB3  SER   1           HB3      SER   1 -13.705 -10.483  -3.299
    4    HG   SER   1           HG       SER   1 -12.373  -9.494  -4.768
    5    H    ASP   2           H        ASP   2 -15.897  -9.340  -1.068
    6    HA   ASP   2           HA       ASP   2 -15.382 -11.662   0.689
    7    HB2  ASP   2           HB2      ASP   2 -15.260  -9.040   1.662
    8    HB3  ASP   2           HB3      ASP   2 -16.873  -9.591   2.113
    9    H    LEU   3           H        LEU   3 -17.735 -11.914   1.974
   10    HA   LEU   3           HA       LEU   3 -19.646 -12.472  -0.156
   11    HB2  LEU   3           HB2      LEU   3 -19.101 -13.301   2.497
   12    HB3  LEU   3           HB3      LEU   3 -20.737 -12.643   2.519
   13    HG   LEU   3           HG       LEU   3 -19.808 -14.614   0.419
   14   HD11  LEU   3          HD11      LEU   3 -21.344 -15.236   2.959
   15   HD12  LEU   3          HD12      LEU   3 -19.623 -15.559   2.747
   16   HD13  LEU   3          HD13      LEU   3 -20.806 -16.385   1.734
   17   HD21  LEU   3          HD21      LEU   3 -22.540 -13.742   1.417
   18   HD22  LEU   3          HD22      LEU   3 -22.257 -14.971   0.184
   19   HD23  LEU   3          HD23      LEU   3 -21.811 -13.293  -0.124
   20    HA   PRO   4           HA       PRO   4 -22.129  -8.935   1.718
   21    HB2  PRO   4           HB2      PRO   4 -21.319  -7.726   4.037
   22    HB3  PRO   4           HB3      PRO   4 -22.260  -9.227   4.009
   23    HG2  PRO   4           HG2      PRO   4 -19.464  -8.809   4.718
   24    HG3  PRO   4           HG3      PRO   4 -20.518 -10.186   5.057
   25    HD2  PRO   4           HD2      PRO   4 -18.513  -9.916   3.005
   26    HD3  PRO   4           HD3      PRO   4 -19.485 -11.344   3.423
   27    H    ALA   5           H        ALA   5 -21.649  -6.354   2.559
   28    HA   ALA   5           HA       ALA   5 -19.103  -5.333   1.501
   29    HB1  ALA   5           HB1      ALA   5 -20.735  -5.976  -0.422
   30    HB2  ALA   5           HB2      ALA   5 -19.968  -4.389  -0.483
   31    HB3  ALA   5           HB3      ALA   5 -21.637  -4.541   0.068
   32    H    LEU   6           H        LEU   6 -20.290  -4.993   4.044
   33    HA   LEU   6           HA       LEU   6 -21.772  -2.469   4.176
   34    HB2  LEU   6           HB2      LEU   6 -20.568  -4.466   6.073
   35    HB3  LEU   6           HB3      LEU   6 -21.033  -2.884   6.695
   36    HG   LEU   6           HG       LEU   6 -23.192  -3.683   5.087
   37   HD11  LEU   6          HD11      LEU   6 -22.204  -5.980   5.135
   38   HD12  LEU   6          HD12      LEU   6 -23.780  -5.895   5.924
   39   HD13  LEU   6          HD13      LEU   6 -22.310  -5.952   6.896
   40   HD21  LEU   6          HD21      LEU   6 -22.781  -3.810   8.093
   41   HD22  LEU   6          HD22      LEU   6 -24.352  -3.874   7.293
   42   HD23  LEU   6          HD23      LEU   6 -23.360  -2.419   7.175
   43    H    SER   7           H        SER   7 -18.490  -3.470   5.235
   44    HA   SER   7           HA       SER   7 -17.599  -0.624   4.865
   45    HB2  SER   7           HB2      SER   7 -17.276  -2.626   7.057
   46    HB3  SER   7           HB3      SER   7 -15.896  -1.583   6.725
   47    HG   SER   7           HG       SER   7 -17.227  -0.556   8.198
   48    H    THR   8           H        THR   8 -17.404  -2.165   2.658
   49    HA   THR   8           HA       THR   8 -14.536  -3.051   2.589
   50    HB   THR   8           HB       THR   8 -16.720  -4.187   0.844
   51    HG1  THR   8           HG1      THR   8 -17.586  -4.663   2.753
   52   HG21  THR   8          HG21      THR   8 -14.151  -5.322   1.982
   53   HG22  THR   8          HG22      THR   8 -14.375  -4.736   0.334
   54   HG23  THR   8          HG23      THR   8 -15.248  -6.165   0.888
   55    H    GLY   9           H        GLY   9 -16.235  -0.501   1.713
   56    HA2  GLY   9           HA2      GLY   9 -15.342  -0.445  -1.134
   57    HA3  GLY   9           HA3      GLY   9 -16.567   0.621  -0.440
   58    H    LEU  10           H        LEU  10 -15.832   2.244   1.132
   59    HA   LEU  10           HA       LEU  10 -13.478   3.662   0.298
   60    HB2  LEU  10           HB2      LEU  10 -15.563   3.820   2.419
   61    HB3  LEU  10           HB3      LEU  10 -14.064   4.690   2.744
   62    HG   LEU  10           HG       LEU  10 -14.366   5.574   0.287
   63   HD11  LEU  10          HD11      LEU  10 -16.840   5.852  -0.202
   64   HD12  LEU  10          HD12      LEU  10 -17.148   4.648   1.049
   65   HD13  LEU  10          HD13      LEU  10 -16.228   4.209  -0.390
   66   HD21  LEU  10          HD21      LEU  10 -16.106   6.491   2.599
   67   HD22  LEU  10          HD22      LEU  10 -15.734   7.457   1.172
   68   HD23  LEU  10          HD23      LEU  10 -14.446   6.997   2.286
   69    H    LEU  11           H        LEU  11 -14.068   1.329   2.914
   70    HA   LEU  11           HA       LEU  11 -11.623   1.743   4.369
   71    HB2  LEU  11           HB2      LEU  11 -13.810   0.475   4.956
   72    HB3  LEU  11           HB3      LEU  11 -13.107  -0.876   4.066
   73    HG   LEU  11           HG       LEU  11 -10.998  -0.336   5.594
   74   HD11  LEU  11          HD11      LEU  11 -13.349   0.604   7.269
   75   HD12  LEU  11          HD12      LEU  11 -12.066   1.642   6.643
   76   HD13  LEU  11          HD13      LEU  11 -11.691   0.397   7.836
   77   HD21  LEU  11          HD21      LEU  11 -12.359  -2.451   5.501
   78   HD22  LEU  11          HD22      LEU  11 -13.441  -1.751   6.704
   79   HD23  LEU  11          HD23      LEU  11 -11.756  -2.073   7.113
   80    H    HIS  12           H        HIS  12 -12.496  -0.611   1.803
   81    HA   HIS  12           HA       HIS  12  -9.868  -1.816   1.666
   82    HB2  HIS  12           HB2      HIS  12 -12.470  -1.920   0.287
   83    HB3  HIS  12           HB3      HIS  12 -11.098  -2.269  -0.764
   84    HD1  HIS  12           HD1      HIS  12 -10.063  -4.549  -0.561
   85    HD2  HIS  12           HD2      HIS  12 -12.502  -3.651   2.699
   86    HE1  HIS  12           HE1      HIS  12 -10.203  -6.660   0.833
   87    H    LEU  13           H        LEU  13 -11.505   0.705  -0.298
   88    HA   LEU  13           HA       LEU  13  -9.405   1.091  -2.204
   89    HB2  LEU  13           HB2      LEU  13 -11.942   2.100  -1.661
   90    HB3  LEU  13           HB3      LEU  13 -10.898   3.498  -1.424
   91    HG   LEU  13           HG       LEU  13 -11.618   3.400  -3.758
   92   HD11  LEU  13          HD11      LEU  13  -9.478   3.577  -4.809
   93   HD12  LEU  13          HD12      LEU  13  -8.741   2.469  -3.652
   94   HD13  LEU  13          HD13      LEU  13  -9.240   4.080  -3.136
   95   HD21  LEU  13          HD21      LEU  13 -10.577   1.353  -5.068
   96   HD22  LEU  13          HD22      LEU  13 -12.135   1.185  -4.260
   97   HD23  LEU  13          HD23      LEU  13 -10.673   0.561  -3.495
   98    H    HIS  14           H        HIS  14 -10.051   2.699   0.931
   99    HA   HIS  14           HA       HIS  14  -7.822   4.517   0.836
  100    HB2  HIS  14           HB2      HIS  14  -9.766   4.759   2.326
  101    HB3  HIS  14           HB3      HIS  14  -9.351   3.253   3.142
  102    HD1  HIS  14           HD1      HIS  14  -7.355   6.407   2.271
  103    HD2  HIS  14           HD2      HIS  14  -8.086   3.876   5.500
  104    HE1  HIS  14           HE1      HIS  14  -5.983   7.296   4.205
  105    H    GLN  15           H        GLN  15  -8.201   1.346   2.503
  106    HA   GLN  15           HA       GLN  15  -5.559   1.128   3.522
  107    HB2  GLN  15           HB2      GLN  15  -7.898  -0.542   3.059
  108    HB3  GLN  15           HB3      GLN  15  -6.412  -1.453   2.800
  109    HG2  GLN  15           HG2      GLN  15  -6.970  -1.651   5.136
  110    HG3  GLN  15           HG3      GLN  15  -5.584  -0.566   5.018
  111   HE21  GLN  15          HE21      GLN  15  -5.878   1.646   5.659
  112   HE22  GLN  15          HE22      GLN  15  -7.336   2.229   6.302
  113    H    ASN  16           H        ASN  16  -6.850   0.326   0.297
  114    HA   ASN  16           HA       ASN  16  -4.627  -1.066  -0.785
  115    HB2  ASN  16           HB2      ASN  16  -6.952  -0.639  -1.749
  116    HB3  ASN  16           HB3      ASN  16  -6.373   0.962  -2.213
  117   HD21  ASN  16          HD21      ASN  16  -4.703   1.085  -3.897
  118   HD22  ASN  16          HD22      ASN  16  -4.369  -0.246  -4.895
  119    H    ILE  17           H        ILE  17  -5.248   2.451  -0.577
  120    HA   ILE  17           HA       ILE  17  -2.650   3.104  -1.826
  121    HB   ILE  17           HB       ILE  17  -4.876   4.752  -0.564
  122   HG12  ILE  17          HG12      ILE  17  -4.315   4.892  -3.468
  123   HG13  ILE  17          HG13      ILE  17  -4.923   3.333  -2.912
  124   HG21  ILE  17          HG21      ILE  17  -2.792   6.010  -0.478
  125   HG22  ILE  17          HG22      ILE  17  -3.787   6.657  -1.782
  126   HG23  ILE  17          HG23      ILE  17  -2.429   5.593  -2.153
  127   HD11  ILE  17          HD11      ILE  17  -6.261   6.002  -2.898
  128   HD12  ILE  17          HD12      ILE  17  -6.636   4.890  -1.583
  129   HD13  ILE  17          HD13      ILE  17  -6.934   4.412  -3.253
  130    H    VAL  18           H        VAL  18  -3.935   2.636   1.382
  131    HA   VAL  18           HA       VAL  18  -1.787   4.155   2.720
  132    HB   VAL  18           HB       VAL  18  -4.095   2.409   3.637
  133   HG11  VAL  18          HG11      VAL  18  -2.447   2.254   5.373
  134   HG12  VAL  18          HG12      VAL  18  -3.614   3.468   5.898
  135   HG13  VAL  18          HG13      VAL  18  -2.057   3.970   5.241
  136   HG21  VAL  18          HG21      VAL  18  -5.320   4.299   3.545
  137   HG22  VAL  18          HG22      VAL  18  -3.973   5.055   2.696
  138   HG23  VAL  18          HG23      VAL  18  -4.101   5.197   4.449
  139    H    ASP  19           H        ASP  19  -2.222   0.994   1.465
  140    HA   ASP  19           HA       ASP  19   0.030  -0.054   3.152
  141    HB2  ASP  19           HB2      ASP  19  -2.583  -1.008   2.698
  142    HB3  ASP  19           HB3      ASP  19  -1.541  -2.049   1.730
  143    H    VAL  20           H        VAL  20  -0.001   1.501   0.486
  144    HA   VAL  20           HA       VAL  20   1.396  -0.545  -1.201
  145    HB   VAL  20           HB       VAL  20  -0.684   0.392  -2.164
  146   HG11  VAL  20          HG11      VAL  20  -0.966   2.720  -2.604
  147   HG12  VAL  20          HG12      VAL  20   0.703   3.078  -2.162
  148   HG13  VAL  20          HG13      VAL  20  -0.455   2.607  -0.922
  149   HG21  VAL  20          HG21      VAL  20   1.021  -0.201  -3.757
  150   HG22  VAL  20          HG22      VAL  20   1.912   1.289  -3.441
  151   HG23  VAL  20          HG23      VAL  20   0.355   1.351  -4.268
  152    H    GLN  21           H        GLN  21   1.487   2.820  -0.084
  153    HA   GLN  21           HA       GLN  21   4.206   3.242  -1.165
  154    HB2  GLN  21           HB2      GLN  21   2.026   4.831   0.162
  155    HB3  GLN  21           HB3      GLN  21   3.671   5.477   0.177
  156    HG2  GLN  21           HG2      GLN  21   2.977   4.456  -2.456
  157    HG3  GLN  21           HG3      GLN  21   1.822   5.677  -1.922
  158   HE21  GLN  21          HE21      GLN  21   2.497   7.851  -2.038
  159   HE22  GLN  21          HE22      GLN  21   4.090   8.338  -2.360
  160    H    TYR  22           H        TYR  22   2.861   1.941   1.675
  161    HA   TYR  22           HA       TYR  22   5.274   2.679   3.291
  162    HB2  TYR  22           HB2      TYR  22   2.561   1.710   4.247
  163    HB3  TYR  22           HB3      TYR  22   3.819   2.495   5.205
  164    HD1  TYR  22           HD1      TYR  22   4.288   4.907   4.947
  165    HD2  TYR  22           HD2      TYR  22   1.136   2.991   2.745
  166    HE1  TYR  22           HE1      TYR  22   3.356   7.123   4.341
  167    HE2  TYR  22           HE2      TYR  22   0.202   5.206   2.144
  168    HH   TYR  22           HH       TYR  22   1.786   7.942   2.217
  169    H    MET  23           H        MET  23   3.625   0.060   1.745
  170    HA   MET  23           HA       MET  23   5.092  -1.949   3.408
  171    HB2  MET  23           HB2      MET  23   2.442  -1.731   2.425
  172    HB3  MET  23           HB3      MET  23   3.198  -3.034   1.508
  173    HG2  MET  23           HG2      MET  23   3.719  -3.007   4.435
  174    HG3  MET  23           HG3      MET  23   2.081  -3.421   3.934
  175    HE1  MET  23           HE1      MET  23   3.910  -5.562   5.501
  176    HE2  MET  23           HE2      MET  23   3.270  -6.930   4.595
  177    HE3  MET  23           HE3      MET  23   2.214  -5.579   4.998
  178    H    TYR  24           H        TYR  24   6.070  -0.213   0.998
  179    HA   TYR  24           HA       TYR  24   6.781  -2.411  -0.902
  180    HB2  TYR  24           HB2      TYR  24   5.773   0.058  -1.336
  181    HB3  TYR  24           HB3      TYR  24   7.492   0.449  -1.375
  182    HD1  TYR  24           HD1      TYR  24   4.908  -1.808  -2.844
  183    HD2  TYR  24           HD2      TYR  24   8.832  -0.108  -3.250
  184    HE1  TYR  24           HE1      TYR  24   5.066  -2.721  -5.143
  185    HE2  TYR  24           HE2      TYR  24   8.988  -1.021  -5.550
  186    HH   TYR  24           HH       TYR  24   7.517  -3.313  -6.720
  187    H    GLY  25           H        GLY  25   8.050  -1.865   1.845
  188    HA2  GLY  25           HA2      GLY  25  10.571  -2.702   1.700
  189    HA3  GLY  25           HA3      GLY  25  10.800  -1.073   1.063
  190    H    LEU  26           H        LEU  26   9.105  -2.612   3.830
  191    HA   LEU  26           HA       LEU  26  10.524  -0.803   5.702
  192    HB2  LEU  26           HB2      LEU  26   7.761  -0.489   4.734
  193    HB3  LEU  26           HB3      LEU  26   7.894  -0.478   6.491
  194    HG   LEU  26           HG       LEU  26   9.960   1.113   5.109
  195   HD11  LEU  26          HD11      LEU  26   8.462   2.965   4.558
  196   HD12  LEU  26          HD12      LEU  26   7.067   2.023   5.082
  197   HD13  LEU  26          HD13      LEU  26   7.980   1.528   3.656
  198   HD21  LEU  26          HD21      LEU  26   7.980   1.770   7.314
  199   HD22  LEU  26          HD22      LEU  26   9.444   2.671   6.916
  200   HD23  LEU  26          HD23      LEU  26   9.564   1.042   7.579
  201    H    SER  27           H        SER  27  11.097  -3.327   5.878
  202    HA   SER  27           HA       SER  27   9.238  -5.083   7.209
  203    HB2  SER  27           HB2      SER  27  12.165  -4.969   6.618
  204    HB3  SER  27           HB3      SER  27  11.627  -6.121   7.837
  205    HG   SER  27           HG       SER  27  10.794  -7.289   6.303
  206    HA   PRO  28           HA       PRO  28  11.405  -3.817  11.267
  207    HB2  PRO  28           HB2      PRO  28  13.196  -1.753  11.254
  208    HB3  PRO  28           HB3      PRO  28  13.663  -3.437  10.949
  209    HG2  PRO  28           HG2      PRO  28  13.284  -1.204   9.037
  210    HG3  PRO  28           HG3      PRO  28  14.426  -2.554   8.992
  211    HD2  PRO  28           HD2      PRO  28  12.103  -2.393   7.508
  212    HD3  PRO  28           HD3      PRO  28  12.978  -3.893   7.876
  213    H    ALA  29           H        ALA  29   9.039  -2.869  10.513
  214    HA   ALA  29           HA       ALA  29   8.799  -0.265  11.877
  215    HB1  ALA  29           HB1      ALA  29   7.653   0.739   9.885
  216    HB2  ALA  29           HB2      ALA  29   8.090  -0.695   8.956
  217    HB3  ALA  29           HB3      ALA  29   9.351   0.368   9.579
  218    H    ILE  30           H        ILE  30   6.925  -2.414   9.677
  219    HA   ILE  30           HA       ILE  30   4.430  -2.031  11.086
  220    HB   ILE  30           HB       ILE  30   5.449  -4.091   9.102
  221   HG12  ILE  30          HG12      ILE  30   3.552  -1.740   8.770
  222   HG13  ILE  30          HG13      ILE  30   5.267  -1.697   8.359
  223   HG21  ILE  30          HG21      ILE  30   2.721  -3.702  10.342
  224   HG22  ILE  30          HG22      ILE  30   3.634  -5.198  10.142
  225   HG23  ILE  30          HG23      ILE  30   2.901  -4.419   8.740
  226   HD11  ILE  30          HD11      ILE  30   4.801  -3.738   6.873
  227   HD12  ILE  30          HD12      ILE  30   4.154  -2.195   6.315
  228   HD13  ILE  30          HD13      ILE  30   3.089  -3.368   7.091
  229    H    THR  31           H        THR  31   7.149  -4.164  11.575
  230    HA   THR  31           HA       THR  31   5.903  -6.302  13.010
  231    HB   THR  31           HB       THR  31   8.251  -6.500  13.989
  232    HG1  THR  31           HG1      THR  31   9.093  -4.541  14.031
  233   HG21  THR  31          HG21      THR  31   7.516  -6.448  11.115
  234   HG22  THR  31          HG22      THR  31   8.185  -7.760  12.085
  235   HG23  THR  31          HG23      THR  31   9.243  -6.490  11.469
  236    H    LYS  32           H        LYS  32   7.205  -3.165  14.124
  237    HA   LYS  32           HA       LYS  32   6.736  -3.606  16.935
  238    HB2  LYS  32           HB2      LYS  32   8.138  -1.843  15.504
  239    HB3  LYS  32           HB3      LYS  32   6.670  -0.883  15.689
  240    HG2  LYS  32           HG2      LYS  32   7.660  -2.212  18.152
  241    HG3  LYS  32           HG3      LYS  32   8.668  -0.909  17.525
  242    HD2  LYS  32           HD2      LYS  32   7.183   0.674  18.151
  243    HD3  LYS  32           HD3      LYS  32   5.824  -0.227  17.478
  244    HE2  LYS  32           HE2      LYS  32   5.334  -1.245  19.483
  245    HE3  LYS  32           HE3      LYS  32   7.036  -1.329  19.974
  246    HZ1  LYS  32           HZ1      LYS  32   7.009   1.101  20.239
  247    HZ2  LYS  32           HZ2      LYS  32   5.903   0.339  21.279
  248    HZ3  LYS  32           HZ3      LYS  32   5.353   1.121  19.875
  249    H    TYR  33           H        TYR  33   4.679  -2.612  14.292
  250    HA   TYR  33           HA       TYR  33   2.576  -1.463  15.985
  251    HB2  TYR  33           HB2      TYR  33   3.327  -1.565  13.233
  252    HB3  TYR  33           HB3      TYR  33   1.702  -2.238  13.353
  253    HD1  TYR  33           HD1      TYR  33  -0.101  -0.905  14.537
  254    HD2  TYR  33           HD2      TYR  33   3.717   0.767  13.497
  255    HE1  TYR  33           HE1      TYR  33  -1.028   1.381  14.802
  256    HE2  TYR  33           HE2      TYR  33   2.790   3.051  13.762
  257    HH   TYR  33           HH       TYR  33   0.435   3.903  15.359
  258    H    VAL  34           H        VAL  34   3.331  -4.610  14.560
  259    HA   VAL  34           HA       VAL  34   0.673  -5.714  15.282
  260    HB   VAL  34           HB       VAL  34   3.147  -6.878  13.953
  261   HG11  VAL  34          HG11      VAL  34   1.905  -8.689  14.935
  262   HG12  VAL  34          HG12      VAL  34   1.498  -8.663  13.218
  263   HG13  VAL  34          HG13      VAL  34   0.370  -8.003  14.402
  264   HG21  VAL  34          HG21      VAL  34   1.737  -5.007  12.810
  265   HG22  VAL  34          HG22      VAL  34   0.500  -6.254  12.642
  266   HG23  VAL  34          HG23      VAL  34   2.080  -6.470  11.888
  267    H    VAL  35           H        VAL  35   4.106  -6.057  16.223
  268    HA   VAL  35           HA       VAL  35   3.311  -7.926  18.411
  269    HB   VAL  35           HB       VAL  35   6.076  -7.117  17.457
  270   HG11  VAL  35          HG11      VAL  35   6.201  -8.239  19.558
  271   HG12  VAL  35          HG12      VAL  35   6.556  -9.474  18.349
  272   HG13  VAL  35          HG13      VAL  35   4.958  -9.403  19.093
  273   HG21  VAL  35          HG21      VAL  35   6.010  -9.175  16.071
  274   HG22  VAL  35          HG22      VAL  35   4.787  -8.015  15.555
  275   HG23  VAL  35          HG23      VAL  35   4.321  -9.414  16.521
  276    H    ARG  36           H        ARG  36   3.306  -4.709  18.194
  277    HA   ARG  36           HA       ARG  36   3.560  -2.942  19.725
  278    HB2  ARG  36           HB2      ARG  36   3.449  -5.447  21.393
  279    HB3  ARG  36           HB3      ARG  36   3.722  -3.893  22.179
  280    HG2  ARG  36           HG2      ARG  36   1.440  -3.803  22.199
  281    HG3  ARG  36           HG3      ARG  36   1.653  -3.244  20.541
  282    HD2  ARG  36           HD2      ARG  36   0.097  -5.006  20.295
  283    HD3  ARG  36           HD3      ARG  36   1.640  -5.815  19.957
  284    HE   ARG  36           HE       ARG  36   0.772  -5.777  22.789
  285   HH11  ARG  36          HH11      ARG  36   2.807  -7.665  21.527
  286   HH12  ARG  36          HH12      ARG  36   1.902  -9.140  21.458
  287   HH21  ARG  36          HH21      ARG  36  -1.167  -7.583  21.955
  288   HH22  ARG  36          HH22      ARG  36  -0.357  -9.094  21.704
  Start of MODEL   15
    1    HA   SER   1           HA       SER   1 -24.830 -12.473  -0.117
    2    HB2  SER   1           HB2      SER   1 -23.281 -14.210   0.835
    3    HB3  SER   1           HB3      SER   1 -24.361 -14.852  -0.400
    4    HG   SER   1           HG       SER   1 -21.603 -14.366  -0.472
    5    H    ASP   2           H        ASP   2 -23.058 -12.039   1.677
    6    HA   ASP   2           HA       ASP   2 -21.409 -10.571   2.500
    7    HB2  ASP   2           HB2      ASP   2 -20.140 -11.238  -0.176
    8    HB3  ASP   2           HB3      ASP   2 -19.298 -10.675   1.265
    9    H    LEU   3           H        LEU   3 -22.982  -8.769   2.230
   10    HA   LEU   3           HA       LEU   3 -21.863  -6.627   0.569
   11    HB2  LEU   3           HB2      LEU   3 -24.080  -6.272  -0.594
   12    HB3  LEU   3           HB3      LEU   3 -23.223  -7.731  -1.080
   13    HG   LEU   3           HG       LEU   3 -24.915  -8.295   1.199
   14   HD11  LEU   3          HD11      LEU   3 -26.278  -6.422   0.387
   15   HD12  LEU   3          HD12      LEU   3 -27.096  -7.951   0.069
   16   HD13  LEU   3          HD13      LEU   3 -26.270  -7.105  -1.239
   17   HD21  LEU   3          HD21      LEU   3 -23.932  -9.622  -0.973
   18   HD22  LEU   3          HD22      LEU   3 -25.597  -9.349  -1.484
   19   HD23  LEU   3          HD23      LEU   3 -25.267 -10.217   0.015
   20    HA   PRO   4           HA       PRO   4 -23.803  -5.082   4.373
   21    HB2  PRO   4           HB2      PRO   4 -21.685  -3.517   5.115
   22    HB3  PRO   4           HB3      PRO   4 -21.783  -5.249   5.482
   23    HG2  PRO   4           HG2      PRO   4 -20.121  -3.842   3.510
   24    HG3  PRO   4           HG3      PRO   4 -19.873  -5.409   4.288
   25    HD2  PRO   4           HD2      PRO   4 -20.835  -4.922   1.663
   26    HD3  PRO   4           HD3      PRO   4 -20.720  -6.487   2.491
   27    H    ALA   5           H        ALA   5 -24.932  -4.066   2.254
   28    HA   ALA   5           HA       ALA   5 -25.757  -2.134   1.175
   29    HB1  ALA   5           HB1      ALA   5 -24.682  -0.770   3.656
   30    HB2  ALA   5           HB2      ALA   5 -26.131  -1.776   3.671
   31    HB3  ALA   5           HB3      ALA   5 -26.087  -0.306   2.697
   32    H    LEU   6           H        LEU   6 -22.936  -2.866   0.612
   33    HA   LEU   6           HA       LEU   6 -21.053  -1.968  -0.486
   34    HB2  LEU   6           HB2      LEU   6 -23.392  -0.743  -1.381
   35    HB3  LEU   6           HB3      LEU   6 -22.312   0.613  -1.059
   36    HG   LEU   6           HG       LEU   6 -21.253  -1.770  -2.546
   37   HD11  LEU   6          HD11      LEU   6 -23.353  -1.216  -3.696
   38   HD12  LEU   6          HD12      LEU   6 -21.971  -0.718  -4.672
   39   HD13  LEU   6          HD13      LEU   6 -22.883   0.483  -3.758
   40   HD21  LEU   6          HD21      LEU   6 -19.964   0.117  -3.661
   41   HD22  LEU   6          HD22      LEU   6 -19.648  -0.079  -1.938
   42   HD23  LEU   6          HD23      LEU   6 -20.710   1.212  -2.496
   43    H    SER   7           H        SER   7 -21.358  -1.425   2.433
   44    HA   SER   7           HA       SER   7 -20.322   1.315   2.809
   45    HB2  SER   7           HB2      SER   7 -21.067  -1.004   4.592
   46    HB3  SER   7           HB3      SER   7 -20.298   0.442   5.238
   47    HG   SER   7           HG       SER   7 -22.300   1.123   5.293
   48    H    THR   8           H        THR   8 -18.986  -1.753   2.133
   49    HA   THR   8           HA       THR   8 -16.392  -1.104   3.465
   50    HB   THR   8           HB       THR   8 -15.952  -3.540   2.730
   51    HG1  THR   8           HG1      THR   8 -17.429  -4.343   1.502
   52   HG21  THR   8          HG21      THR   8 -17.260  -4.438   4.596
   53   HG22  THR   8          HG22      THR   8 -18.276  -2.997   4.598
   54   HG23  THR   8          HG23      THR   8 -16.572  -2.874   5.036
   55    H    GLY   9           H        GLY   9 -17.160   0.422   1.127
   56    HA2  GLY   9           HA2      GLY   9 -15.484  -0.735  -1.047
   57    HA3  GLY   9           HA3      GLY   9 -16.614   0.607  -1.236
   58    H    LEU  10           H        LEU  10 -15.887   2.279   0.833
   59    HA   LEU  10           HA       LEU  10 -13.454   3.503  -0.198
   60    HB2  LEU  10           HB2      LEU  10 -15.576   4.043   1.825
   61    HB3  LEU  10           HB3      LEU  10 -14.040   4.877   2.057
   62    HG   LEU  10           HG       LEU  10 -15.395   4.854  -0.638
   63   HD11  LEU  10          HD11      LEU  10 -16.400   7.043  -0.022
   64   HD12  LEU  10          HD12      LEU  10 -15.845   6.813   1.636
   65   HD13  LEU  10          HD13      LEU  10 -17.049   5.723   0.951
   66   HD21  LEU  10          HD21      LEU  10 -14.108   6.984  -0.853
   67   HD22  LEU  10          HD22      LEU  10 -13.063   5.595  -0.551
   68   HD23  LEU  10          HD23      LEU  10 -13.443   6.715   0.758
   69    H    LEU  11           H        LEU  11 -14.301   1.721   2.786
   70    HA   LEU  11           HA       LEU  11 -11.891   2.116   4.240
   71    HB2  LEU  11           HB2      LEU  11 -14.130   1.036   4.905
   72    HB3  LEU  11           HB3      LEU  11 -13.518  -0.438   4.156
   73    HG   LEU  11           HG       LEU  11 -11.449  -0.158   5.644
   74   HD11  LEU  11          HD11      LEU  11 -13.321   1.896   6.840
   75   HD12  LEU  11          HD12      LEU  11 -11.634   2.103   6.367
   76   HD13  LEU  11          HD13      LEU  11 -12.040   1.138   7.787
   77   HD21  LEU  11          HD21      LEU  11 -12.471  -1.371   7.413
   78   HD22  LEU  11          HD22      LEU  11 -13.473  -1.718   6.004
   79   HD23  LEU  11          HD23      LEU  11 -14.012  -0.541   7.201
   80    H    HIS  12           H        HIS  12 -12.750  -0.543   1.982
   81    HA   HIS  12           HA       HIS  12 -10.221  -1.895   2.082
   82    HB2  HIS  12           HB2      HIS  12 -12.552  -1.736   0.173
   83    HB3  HIS  12           HB3      HIS  12 -11.125  -2.679  -0.255
   84    HD1  HIS  12           HD1      HIS  12 -10.873  -4.951   0.826
   85    HD2  HIS  12           HD2      HIS  12 -13.832  -2.656   2.658
   86    HE1  HIS  12           HE1      HIS  12 -12.045  -6.474   2.477
   87    H    LEU  13           H        LEU  13 -11.469   0.710  -0.011
   88    HA   LEU  13           HA       LEU  13  -9.256   0.858  -1.828
   89    HB2  LEU  13           HB2      LEU  13 -11.605   1.906  -1.925
   90    HB3  LEU  13           HB3      LEU  13 -10.972   3.157  -0.854
   91    HG   LEU  13           HG       LEU  13  -9.033   3.280  -2.643
   92   HD11  LEU  13          HD11      LEU  13 -11.360   2.119  -4.205
   93   HD12  LEU  13          HD12      LEU  13  -9.778   1.375  -3.980
   94   HD13  LEU  13          HD13      LEU  13  -9.930   2.851  -4.932
   95   HD21  LEU  13          HD21      LEU  13 -10.611   4.859  -4.001
   96   HD22  LEU  13          HD22      LEU  13 -10.314   5.222  -2.302
   97   HD23  LEU  13          HD23      LEU  13 -11.814   4.431  -2.785
   98    H    HIS  14           H        HIS  14  -9.889   2.443   1.312
   99    HA   HIS  14           HA       HIS  14  -7.656   4.209   1.385
  100    HB2  HIS  14           HB2      HIS  14  -9.466   4.351   2.982
  101    HB3  HIS  14           HB3      HIS  14  -9.199   2.692   3.516
  102    HD1  HIS  14           HD1      HIS  14  -7.663   6.139   3.703
  103    HD2  HIS  14           HD2      HIS  14  -7.126   2.372   5.405
  104    HE1  HIS  14           HE1      HIS  14  -6.013   6.439   5.600
  105    H    GLN  15           H        GLN  15  -7.946   0.911   2.784
  106    HA   GLN  15           HA       GLN  15  -5.294   0.573   3.680
  107    HB2  GLN  15           HB2      GLN  15  -7.525  -0.890   3.724
  108    HB3  GLN  15           HB3      GLN  15  -6.760  -1.677   2.343
  109    HG2  GLN  15           HG2      GLN  15  -6.047  -2.904   4.266
  110    HG3  GLN  15           HG3      GLN  15  -4.673  -1.905   3.796
  111   HE21  GLN  15          HE21      GLN  15  -3.737  -0.821   5.536
  112   HE22  GLN  15          HE22      GLN  15  -4.561  -0.340   6.941
  113    H    ASN  16           H        ASN  16  -6.651   0.093   0.418
  114    HA   ASN  16           HA       ASN  16  -4.286  -1.019  -0.797
  115    HB2  ASN  16           HB2      ASN  16  -6.791  -0.888  -1.537
  116    HB3  ASN  16           HB3      ASN  16  -6.346   0.684  -2.200
  117   HD21  ASN  16          HD21      ASN  16  -4.484   0.671  -3.809
  118   HD22  ASN  16          HD22      ASN  16  -4.253  -0.714  -4.763
  119    H    ILE  17           H        ILE  17  -5.449   2.332  -0.385
  120    HA   ILE  17           HA       ILE  17  -3.239   3.478  -1.951
  121    HB   ILE  17           HB       ILE  17  -5.423   4.621  -0.175
  122   HG12  ILE  17          HG12      ILE  17  -5.121   4.766  -3.187
  123   HG13  ILE  17          HG13      ILE  17  -6.002   3.463  -2.388
  124   HG21  ILE  17          HG21      ILE  17  -4.829   6.799  -1.299
  125   HG22  ILE  17          HG22      ILE  17  -3.382   6.016  -1.934
  126   HG23  ILE  17          HG23      ILE  17  -3.590   6.208  -0.193
  127   HD11  ILE  17          HD11      ILE  17  -7.252   5.674  -3.182
  128   HD12  ILE  17          HD12      ILE  17  -6.668   6.282  -1.633
  129   HD13  ILE  17          HD13      ILE  17  -7.710   4.860  -1.687
  130    H    VAL  18           H        VAL  18  -3.699   2.479   1.338
  131    HA   VAL  18           HA       VAL  18  -1.554   4.253   2.372
  132    HB   VAL  18           HB       VAL  18  -3.415   2.204   3.626
  133   HG11  VAL  18          HG11      VAL  18  -1.491   4.128   4.970
  134   HG12  VAL  18          HG12      VAL  18  -1.279   2.380   4.874
  135   HG13  VAL  18          HG13      VAL  18  -2.624   3.056   5.791
  136   HG21  VAL  18          HG21      VAL  18  -3.697   4.978   2.896
  137   HG22  VAL  18          HG22      VAL  18  -3.768   4.830   4.652
  138   HG23  VAL  18          HG23      VAL  18  -4.886   3.911   3.644
  139    H    ASP  19           H        ASP  19  -2.296   0.762   2.257
  140    HA   ASP  19           HA       ASP  19   0.231  -0.220   3.122
  141    HB2  ASP  19           HB2      ASP  19  -2.106  -1.222   1.542
  142    HB3  ASP  19           HB3      ASP  19  -0.650  -2.208   1.569
  143    H    VAL  20           H        VAL  20  -0.629   1.244   0.077
  144    HA   VAL  20           HA       VAL  20   1.145  -0.026  -1.723
  145    HB   VAL  20           HB       VAL  20  -0.624   1.634  -2.281
  146   HG11  VAL  20          HG11      VAL  20  -0.460   3.908  -1.742
  147   HG12  VAL  20          HG12      VAL  20   1.279   3.819  -1.464
  148   HG13  VAL  20          HG13      VAL  20   0.162   3.140  -0.281
  149   HG21  VAL  20          HG21      VAL  20   0.599   2.771  -4.038
  150   HG22  VAL  20          HG22      VAL  20   1.302   1.166  -3.835
  151   HG23  VAL  20          HG23      VAL  20   2.119   2.579  -3.165
  152    H    GLN  21           H        GLN  21   1.845   2.294   0.825
  153    HA   GLN  21           HA       GLN  21   4.635   2.645  -0.163
  154    HB2  GLN  21           HB2      GLN  21   2.693   4.084   1.560
  155    HB3  GLN  21           HB3      GLN  21   4.382   4.210   2.049
  156    HG2  GLN  21           HG2      GLN  21   3.968   4.535  -0.846
  157    HG3  GLN  21           HG3      GLN  21   3.181   5.777   0.127
  158   HE21  GLN  21          HE21      GLN  21   6.375   4.115  -0.170
  159   HE22  GLN  21          HE22      GLN  21   7.284   5.477   0.276
  160    H    TYR  22           H        TYR  22   2.869   0.845   2.224
  161    HA   TYR  22           HA       TYR  22   5.399   0.349   3.760
  162    HB2  TYR  22           HB2      TYR  22   2.587  -0.307   4.654
  163    HB3  TYR  22           HB3      TYR  22   4.010  -0.001   5.650
  164    HD1  TYR  22           HD1      TYR  22   5.171   2.424   4.875
  165    HD2  TYR  22           HD2      TYR  22   1.001   1.397   4.772
  166    HE1  TYR  22           HE1      TYR  22   4.577   4.828   4.932
  167    HE2  TYR  22           HE2      TYR  22   0.410   3.803   4.833
  168    HH   TYR  22           HH       TYR  22   1.865   6.068   4.031
  169    H    MET  23           H        MET  23   2.756  -1.215   1.998
  170    HA   MET  23           HA       MET  23   3.719  -3.931   2.655
  171    HB2  MET  23           HB2      MET  23   1.307  -2.686   1.866
  172    HB3  MET  23           HB3      MET  23   1.761  -3.733   0.524
  173    HG2  MET  23           HG2      MET  23   2.148  -5.001   3.140
  174    HG3  MET  23           HG3      MET  23   0.470  -4.557   2.830
  175    HE1  MET  23           HE1      MET  23   0.046  -8.107   2.026
  176    HE2  MET  23           HE2      MET  23  -1.018  -6.722   1.797
  177    HE3  MET  23           HE3      MET  23   0.020  -6.800   3.217
  178    H    TYR  24           H        TYR  24   5.195  -1.759   0.831
  179    HA   TYR  24           HA       TYR  24   5.457  -3.376  -1.658
  180    HB2  TYR  24           HB2      TYR  24   5.170  -0.732  -1.253
  181    HB3  TYR  24           HB3      TYR  24   6.928  -0.821  -1.169
  182    HD1  TYR  24           HD1      TYR  24   4.116  -2.180  -3.264
  183    HD2  TYR  24           HD2      TYR  24   8.112  -0.607  -3.158
  184    HE1  TYR  24           HE1      TYR  24   4.231  -2.308  -5.736
  185    HE2  TYR  24           HE2      TYR  24   8.226  -0.736  -5.632
  186    HH   TYR  24           HH       TYR  24   6.693  -2.446  -7.456
  187    H    GLY  25           H        GLY  25   6.630  -4.244   0.995
  188    HA2  GLY  25           HA2      GLY  25   9.544  -3.971   0.470
  189    HA3  GLY  25           HA3      GLY  25   8.829  -4.575   1.962
  190    H    LEU  26           H        LEU  26   7.449  -5.819  -0.958
  191    HA   LEU  26           HA       LEU  26   7.417  -8.000  -1.847
  192    HB2  LEU  26           HB2      LEU  26  10.234  -7.147  -1.429
  193    HB3  LEU  26           HB3      LEU  26   9.995  -8.864  -1.748
  194    HG   LEU  26           HG       LEU  26   8.497  -8.102  -3.711
  195   HD11  LEU  26          HD11      LEU  26   9.586  -5.542  -2.702
  196   HD12  LEU  26          HD12      LEU  26   8.131  -5.852  -3.650
  197   HD13  LEU  26          HD13      LEU  26   9.700  -5.762  -4.448
  198   HD21  LEU  26          HD21      LEU  26  10.747  -9.106  -3.974
  199   HD22  LEU  26          HD22      LEU  26  11.475  -7.512  -3.776
  200   HD23  LEU  26          HD23      LEU  26  10.463  -7.850  -5.180
  201    H    SER  27           H        SER  27   6.844  -7.806   1.040
  202    HA   SER  27           HA       SER  27   8.231  -9.769   2.586
  203    HB2  SER  27           HB2      SER  27   5.656  -8.296   2.655
  204    HB3  SER  27           HB3      SER  27   5.706  -9.778   3.606
  205    HG   SER  27           HG       SER  27   7.289  -8.953   4.829
  206    HA   PRO  28           HA       PRO  28   4.913 -12.937   1.192
  207    HB2  PRO  28           HB2      PRO  28   3.274 -12.277  -0.899
  208    HB3  PRO  28           HB3      PRO  28   2.860 -11.952   0.797
  209    HG2  PRO  28           HG2      PRO  28   3.934 -10.107  -1.277
  210    HG3  PRO  28           HG3      PRO  28   2.727  -9.811  -0.016
  211    HD2  PRO  28           HD2      PRO  28   5.319  -8.997   0.167
  212    HD3  PRO  28           HD3      PRO  28   4.307  -9.370   1.578
  213    H    ALA  29           H        ALA  29   6.406 -10.871  -1.224
  214    HA   ALA  29           HA       ALA  29   6.638 -12.698  -3.402
  215    HB1  ALA  29           HB1      ALA  29   7.094 -10.224  -3.377
  216    HB2  ALA  29           HB2      ALA  29   8.382 -11.160  -4.136
  217    HB3  ALA  29           HB3      ALA  29   8.585 -10.553  -2.492
  218    H    ILE  30           H        ILE  30   8.643 -12.248  -0.486
  219    HA   ILE  30           HA       ILE  30  10.618 -14.240  -1.374
  220    HB   ILE  30           HB       ILE  30  10.698 -12.033   0.203
  221   HG12  ILE  30          HG12      ILE  30  12.633 -13.243  -0.744
  222   HG13  ILE  30          HG13      ILE  30  12.913 -12.807   0.940
  223   HG21  ILE  30          HG21      ILE  30   9.351 -13.108   1.987
  224   HG22  ILE  30          HG22      ILE  30  10.970 -12.689   2.544
  225   HG23  ILE  30          HG23      ILE  30  10.583 -14.362   2.142
  226   HD11  ILE  30          HD11      ILE  30  12.351 -15.513  -0.245
  227   HD12  ILE  30          HD12      ILE  30  11.933 -15.193   1.438
  228   HD13  ILE  30          HD13      ILE  30  13.605 -15.040   0.900
  229    H    THR  31           H        THR  31   7.795 -14.099   0.725
  230    HA   THR  31           HA       THR  31   8.210 -16.641   2.060
  231    HB   THR  31           HB       THR  31   5.762 -14.913   1.535
  232    HG1  THR  31           HG1      THR  31   6.971 -13.798   2.895
  233   HG21  THR  31          HG21      THR  31   4.745 -16.175   3.428
  234   HG22  THR  31          HG22      THR  31   6.132 -17.265   3.413
  235   HG23  THR  31          HG23      THR  31   5.048 -17.196   2.023
  236    H    LYS  32           H        LYS  32   6.301 -15.621  -0.796
  237    HA   LYS  32           HA       LYS  32   5.517 -18.415  -1.373
  238    HB2  LYS  32           HB2      LYS  32   4.405 -15.906  -1.756
  239    HB3  LYS  32           HB3      LYS  32   4.975 -16.325  -3.372
  240    HG2  LYS  32           HG2      LYS  32   3.839 -18.590  -3.036
  241    HG3  LYS  32           HG3      LYS  32   3.064 -17.882  -1.618
  242    HD2  LYS  32           HD2      LYS  32   2.195 -16.040  -3.092
  243    HD3  LYS  32           HD3      LYS  32   2.838 -16.915  -4.483
  244    HE2  LYS  32           HE2      LYS  32   1.452 -18.916  -3.751
  245    HE3  LYS  32           HE3      LYS  32   0.672 -17.846  -2.570
  246    HZ1  LYS  32           HZ1      LYS  32  -0.531 -17.880  -4.692
  247    HZ2  LYS  32           HZ2      LYS  32   0.859 -17.323  -5.495
  248    HZ3  LYS  32           HZ3      LYS  32   0.081 -16.336  -4.350
  249    H    TYR  33           H        TYR  33   8.321 -18.031  -1.427
  250    HA   TYR  33           HA       TYR  33   8.931 -18.733  -4.239
  251    HB2  TYR  33           HB2      TYR  33   9.110 -16.192  -3.783
  252    HB3  TYR  33           HB3      TYR  33  10.504 -16.595  -2.782
  253    HD1  TYR  33           HD1      TYR  33  12.484 -17.751  -3.808
  254    HD2  TYR  33           HD2      TYR  33   9.230 -16.239  -6.169
  255    HE1  TYR  33           HE1      TYR  33  13.900 -17.876  -5.840
  256    HE2  TYR  33           HE2      TYR  33  10.646 -16.365  -8.201
  257    HH   TYR  33           HH       TYR  33  13.614 -16.361  -8.373
  258    H    VAL  34           H        VAL  34  10.452 -17.972  -1.078
  259    HA   VAL  34           HA       VAL  34  12.335 -20.251  -1.418
  260    HB   VAL  34           HB       VAL  34  12.056 -17.948   0.543
  261   HG11  VAL  34          HG11      VAL  34  14.057 -20.226   0.482
  262   HG12  VAL  34          HG12      VAL  34  12.966 -19.802   1.801
  263   HG13  VAL  34          HG13      VAL  34  14.307 -18.734   1.387
  264   HG21  VAL  34          HG21      VAL  34  14.261 -17.314  -0.493
  265   HG22  VAL  34          HG22      VAL  34  12.917 -17.297  -1.635
  266   HG23  VAL  34          HG23      VAL  34  14.055 -18.644  -1.633
  267    H    VAL  35           H        VAL  35   9.616 -19.182   0.613
  268    HA   VAL  35           HA       VAL  35   9.711 -21.811   2.056
  269    HB   VAL  35           HB       VAL  35   8.341 -19.208   2.827
  270   HG11  VAL  35          HG11      VAL  35   8.467 -20.318   5.121
  271   HG12  VAL  35          HG12      VAL  35   8.910 -21.803   4.280
  272   HG13  VAL  35          HG13      VAL  35   7.341 -21.056   3.982
  273   HG21  VAL  35          HG21      VAL  35  10.755 -18.846   2.746
  274   HG22  VAL  35          HG22      VAL  35  11.040 -20.341   3.638
  275   HG23  VAL  35          HG23      VAL  35  10.256 -18.974   4.432
  276    H    ARG  36           H        ARG  36   8.648 -21.995  -0.446
  277    HA   ARG  36           HA       ARG  36   6.754 -22.806  -1.576
  278    HB2  ARG  36           HB2      ARG  36   6.299 -23.183   1.256
  279    HB3  ARG  36           HB3      ARG  36   4.773 -22.815   0.453
  280    HG2  ARG  36           HG2      ARG  36   4.964 -25.161   0.256
  281    HG3  ARG  36           HG3      ARG  36   5.508 -24.561  -1.311
  282    HD2  ARG  36           HD2      ARG  36   7.455 -25.678  -0.988
  283    HD3  ARG  36           HD3      ARG  36   7.803 -24.586   0.367
  284    HE   ARG  36           HE       ARG  36   6.170 -27.080   0.702
  285   HH11  ARG  36          HH11      ARG  36   6.276 -25.118   2.967
  286   HH12  ARG  36          HH12      ARG  36   7.572 -25.744   3.931
  287   HH21  ARG  36          HH21      ARG  36   8.828 -27.765   1.395
  288   HH22  ARG  36          HH22      ARG  36   9.023 -27.251   3.037
  Start of MODEL   16
    1    HA   SER   1           HA       SER   1 -27.296   0.753 -10.003
    2    HB2  SER   1           HB2      SER   1 -30.333   0.804  -9.955
    3    HB3  SER   1           HB3      SER   1 -29.277   2.200  -9.764
    4    HG   SER   1           HG       SER   1 -29.885   2.098 -11.901
    5    H    ASP   2           H        ASP   2 -26.499   0.714  -7.938
    6    HA   ASP   2           HA       ASP   2 -28.334  -0.106  -5.713
    7    HB2  ASP   2           HB2      ASP   2 -25.676  -1.117  -6.593
    8    HB3  ASP   2           HB3      ASP   2 -25.906  -0.951  -4.853
    9    H    LEU   3           H        LEU   3 -26.804   0.413  -3.566
   10    HA   LEU   3           HA       LEU   3 -25.309   2.911  -3.739
   11    HB2  LEU   3           HB2      LEU   3 -28.021   3.194  -3.851
   12    HB3  LEU   3           HB3      LEU   3 -27.768   3.257  -2.110
   13    HG   LEU   3           HG       LEU   3 -27.653   5.514  -3.015
   14   HD11  LEU   3          HD11      LEU   3 -26.013   4.682  -1.204
   15   HD12  LEU   3          HD12      LEU   3 -25.613   6.192  -2.024
   16   HD13  LEU   3          HD13      LEU   3 -24.795   4.698  -2.481
   17   HD21  LEU   3          HD21      LEU   3 -26.958   4.740  -5.331
   18   HD22  LEU   3          HD22      LEU   3 -25.317   4.574  -4.704
   19   HD23  LEU   3          HD23      LEU   3 -26.095   6.157  -4.732
   20    HA   PRO   4           HA       PRO   4 -25.644   1.615   0.862
   21    HB2  PRO   4           HB2      PRO   4 -27.264  -0.487   1.533
   22    HB3  PRO   4           HB3      PRO   4 -27.818   1.199   1.521
   23    HG2  PRO   4           HG2      PRO   4 -28.204  -0.934  -0.523
   24    HG3  PRO   4           HG3      PRO   4 -29.341   0.295   0.054
   25    HD2  PRO   4           HD2      PRO   4 -28.011   0.508  -2.294
   26    HD3  PRO   4           HD3      PRO   4 -28.498   1.916  -1.330
   27    H    ALA   5           H        ALA   5 -25.714  -0.764  -1.683
   28    HA   ALA   5           HA       ALA   5 -24.306  -2.897  -0.327
   29    HB1  ALA   5           HB1      ALA   5 -24.291  -3.877  -2.484
   30    HB2  ALA   5           HB2      ALA   5 -24.247  -2.308  -3.290
   31    HB3  ALA   5           HB3      ALA   5 -25.729  -2.855  -2.503
   32    H    LEU   6           H        LEU   6 -23.268   0.120  -1.765
   33    HA   LEU   6           HA       LEU   6 -20.436  -0.773  -1.946
   34    HB2  LEU   6           HB2      LEU   6 -21.825   0.648  -3.645
   35    HB3  LEU   6           HB3      LEU   6 -21.533   1.976  -2.522
   36    HG   LEU   6           HG       LEU   6 -19.032   1.197  -2.662
   37   HD11  LEU   6          HD11      LEU   6 -18.498   0.259  -4.914
   38   HD12  LEU   6          HD12      LEU   6 -20.225   0.050  -5.207
   39   HD13  LEU   6          HD13      LEU   6 -19.431  -0.858  -3.920
   40   HD21  LEU   6          HD21      LEU   6 -18.911   2.521  -4.941
   41   HD22  LEU   6          HD22      LEU   6 -19.462   3.341  -3.481
   42   HD23  LEU   6          HD23      LEU   6 -20.636   2.763  -4.664
   43    H    SER   7           H        SER   7 -21.510  -0.672   0.715
   44    HA   SER   7           HA       SER   7 -20.706   1.872   1.950
   45    HB2  SER   7           HB2      SER   7 -21.325   0.571   4.037
   46    HB3  SER   7           HB3      SER   7 -22.607   0.679   2.835
   47    HG   SER   7           HG       SER   7 -22.577  -1.415   2.811
   48    H    THR   8           H        THR   8 -19.306  -1.300   1.404
   49    HA   THR   8           HA       THR   8 -16.983  -0.647   3.165
   50    HB   THR   8           HB       THR   8 -17.392  -3.249   1.710
   51    HG1  THR   8           HG1      THR   8 -18.808  -2.360   4.004
   52   HG21  THR   8          HG21      THR   8 -16.396  -2.528   4.480
   53   HG22  THR   8          HG22      THR   8 -15.380  -2.899   3.088
   54   HG23  THR   8          HG23      THR   8 -16.413  -4.147   3.784
   55    H    GLY   9           H        GLY   9 -17.143   0.864   0.766
   56    HA2  GLY   9           HA2      GLY   9 -15.251  -0.457  -1.113
   57    HA3  GLY   9           HA3      GLY   9 -16.168   1.012  -1.449
   58    H    LEU  10           H        LEU  10 -15.636   2.726   0.490
   59    HA   LEU  10           HA       LEU  10 -12.979   3.660   0.017
   60    HB2  LEU  10           HB2      LEU  10 -15.339   4.335   1.637
   61    HB3  LEU  10           HB3      LEU  10 -13.821   4.837   2.381
   62    HG   LEU  10           HG       LEU  10 -14.322   5.394  -0.534
   63   HD11  LEU  10          HD11      LEU  10 -16.282   6.256   0.745
   64   HD12  LEU  10          HD12      LEU  10 -15.303   7.554   0.063
   65   HD13  LEU  10          HD13      LEU  10 -15.178   7.164   1.778
   66   HD21  LEU  10          HD21      LEU  10 -12.847   7.362   0.075
   67   HD22  LEU  10          HD22      LEU  10 -12.074   5.788   0.262
   68   HD23  LEU  10          HD23      LEU  10 -12.672   6.651   1.679
   69    H    LEU  11           H        LEU  11 -14.338   1.695   2.663
   70    HA   LEU  11           HA       LEU  11 -12.157   1.782   4.487
   71    HB2  LEU  11           HB2      LEU  11 -14.434   0.825   4.870
   72    HB3  LEU  11           HB3      LEU  11 -14.023  -0.520   3.806
   73    HG   LEU  11           HG       LEU  11 -12.002  -0.078   5.879
   74   HD11  LEU  11          HD11      LEU  11 -14.068   0.635   7.110
   75   HD12  LEU  11          HD12      LEU  11 -13.338  -0.830   7.768
   76   HD13  LEU  11          HD13      LEU  11 -14.776  -0.940   6.753
   77   HD21  LEU  11          HD21      LEU  11 -12.157  -2.087   4.447
   78   HD22  LEU  11          HD22      LEU  11 -13.747  -2.445   5.121
   79   HD23  LEU  11          HD23      LEU  11 -12.317  -2.514   6.150
   80    H    HIS  12           H        HIS  12 -12.795  -0.510   1.806
   81    HA   HIS  12           HA       HIS  12 -10.261  -1.917   2.134
   82    HB2  HIS  12           HB2      HIS  12 -12.424  -1.812   0.010
   83    HB3  HIS  12           HB3      HIS  12 -11.019  -2.868  -0.122
   84    HD1  HIS  12           HD1      HIS  12 -10.835  -3.687   2.902
   85    HD2  HIS  12           HD2      HIS  12 -14.334  -3.762   0.639
   86    HE1  HIS  12           HE1      HIS  12 -12.387  -5.332   4.040
   87    H    LEU  13           H        LEU  13 -11.512   0.570  -0.113
   88    HA   LEU  13           HA       LEU  13  -9.264   0.759  -1.847
   89    HB2  LEU  13           HB2      LEU  13 -11.585   1.787  -2.041
   90    HB3  LEU  13           HB3      LEU  13 -11.049   3.019  -0.898
   91    HG   LEU  13           HG       LEU  13  -9.037   3.316  -2.543
   92   HD11  LEU  13          HD11      LEU  13  -9.465   2.716  -4.828
   93   HD12  LEU  13          HD12      LEU  13 -11.114   2.216  -4.454
   94   HD13  LEU  13          HD13      LEU  13  -9.750   1.264  -3.869
   95   HD21  LEU  13          HD21      LEU  13 -11.762   4.207  -3.517
   96   HD22  LEU  13          HD22      LEU  13 -10.228   5.064  -3.659
   97   HD23  LEU  13          HD23      LEU  13 -11.001   4.895  -2.083
   98    H    HIS  14           H        HIS  14  -9.944   2.453   1.232
   99    HA   HIS  14           HA       HIS  14  -7.677   4.179   1.280
  100    HB2  HIS  14           HB2      HIS  14  -9.443   4.532   2.831
  101    HB3  HIS  14           HB3      HIS  14  -9.431   2.850   3.355
  102    HD1  HIS  14           HD1      HIS  14  -8.602   2.780   5.703
  103    HD2  HIS  14           HD2      HIS  14  -6.458   5.530   3.415
  104    HE1  HIS  14           HE1      HIS  14  -6.776   3.694   7.202
  105    H    GLN  15           H        GLN  15  -8.076   0.933   2.770
  106    HA   GLN  15           HA       GLN  15  -5.436   0.630   3.775
  107    HB2  GLN  15           HB2      GLN  15  -7.589  -0.758   4.106
  108    HB3  GLN  15           HB3      GLN  15  -7.142  -1.582   2.612
  109    HG2  GLN  15           HG2      GLN  15  -6.172  -2.932   4.280
  110    HG3  GLN  15           HG3      GLN  15  -4.828  -1.922   3.747
  111   HE21  GLN  15          HE21      GLN  15  -3.741  -0.818   5.392
  112   HE22  GLN  15          HE22      GLN  15  -4.373  -0.516   6.939
  113    H    ASN  16           H        ASN  16  -6.761  -0.031   0.537
  114    HA   ASN  16           HA       ASN  16  -4.461  -1.375  -0.546
  115    HB2  ASN  16           HB2      ASN  16  -6.935  -1.121  -1.349
  116    HB3  ASN  16           HB3      ASN  16  -6.366   0.361  -2.113
  117   HD21  ASN  16          HD21      ASN  16  -4.323   0.039  -3.555
  118   HD22  ASN  16          HD22      ASN  16  -4.241  -1.401  -4.449
  119    H    ILE  17           H        ILE  17  -5.417   2.078  -0.522
  120    HA   ILE  17           HA       ILE  17  -3.127   2.940  -2.108
  121    HB   ILE  17           HB       ILE  17  -5.172   4.358  -0.366
  122   HG12  ILE  17          HG12      ILE  17  -4.928   4.389  -3.379
  123   HG13  ILE  17          HG13      ILE  17  -5.818   3.114  -2.547
  124   HG21  ILE  17          HG21      ILE  17  -4.305   6.299  -2.011
  125   HG22  ILE  17          HG22      ILE  17  -2.811   5.371  -1.886
  126   HG23  ILE  17          HG23      ILE  17  -3.573   6.015  -0.432
  127   HD11  ILE  17          HD11      ILE  17  -7.077   5.011  -1.345
  128   HD12  ILE  17          HD12      ILE  17  -7.456   4.756  -3.048
  129   HD13  ILE  17          HD13      ILE  17  -6.392   6.079  -2.571
  130    H    VAL  18           H        VAL  18  -3.932   3.018   1.382
  131    HA   VAL  18           HA       VAL  18  -1.522   4.356   2.215
  132    HB   VAL  18           HB       VAL  18  -3.618   2.632   3.545
  133   HG11  VAL  18          HG11      VAL  18  -1.083   3.772   4.680
  134   HG12  VAL  18          HG12      VAL  18  -1.871   2.235   5.034
  135   HG13  VAL  18          HG13      VAL  18  -2.535   3.735   5.682
  136   HG21  VAL  18          HG21      VAL  18  -4.481   4.759   2.973
  137   HG22  VAL  18          HG22      VAL  18  -2.973   5.576   3.383
  138   HG23  VAL  18          HG23      VAL  18  -4.005   4.936   4.662
  139    H    ASP  19           H        ASP  19  -2.356   0.926   1.815
  140    HA   ASP  19           HA       ASP  19   0.016  -0.155   3.050
  141    HB2  ASP  19           HB2      ASP  19  -2.158  -1.332   2.533
  142    HB3  ASP  19           HB3      ASP  19  -1.695  -1.324   0.831
  143    H    VAL  20           H        VAL  20  -0.509   1.378  -0.031
  144    HA   VAL  20           HA       VAL  20   2.021   0.251  -1.135
  145    HB   VAL  20           HB       VAL  20  -0.178   1.971  -2.337
  146   HG11  VAL  20          HG11      VAL  20   2.085   0.502  -3.719
  147   HG12  VAL  20          HG12      VAL  20   2.097   2.233  -3.383
  148   HG13  VAL  20          HG13      VAL  20   0.889   1.555  -4.474
  149   HG21  VAL  20          HG21      VAL  20  -1.052  -0.000  -3.291
  150   HG22  VAL  20          HG22      VAL  20  -0.623  -0.507  -1.657
  151   HG23  VAL  20          HG23      VAL  20   0.435  -0.905  -3.011
  152    H    GLN  21           H        GLN  21   0.474   3.267  -0.142
  153    HA   GLN  21           HA       GLN  21   2.558   5.075  -0.964
  154    HB2  GLN  21           HB2      GLN  21   0.259   5.754  -0.472
  155    HB3  GLN  21           HB3      GLN  21   0.424   5.206   1.195
  156    HG2  GLN  21           HG2      GLN  21   2.473   7.148   0.272
  157    HG3  GLN  21           HG3      GLN  21   0.833   7.780   0.433
  158   HE21  GLN  21          HE21      GLN  21  -0.267   7.031   2.642
  159   HE22  GLN  21          HE22      GLN  21   0.731   7.112   4.012
  160    H    TYR  22           H        TYR  22   1.944   3.338   2.113
  161    HA   TYR  22           HA       TYR  22   4.019   4.593   3.636
  162    HB2  TYR  22           HB2      TYR  22   3.267   3.148   5.252
  163    HB3  TYR  22           HB3      TYR  22   1.979   2.840   4.097
  164    HD1  TYR  22           HD1      TYR  22   5.317   1.617   5.251
  165    HD2  TYR  22           HD2      TYR  22   1.706   0.708   3.115
  166    HE1  TYR  22           HE1      TYR  22   5.992  -0.764   5.119
  167    HE2  TYR  22           HE2      TYR  22   2.378  -1.672   2.985
  168    HH   TYR  22           HH       TYR  22   3.894  -3.232   4.340
  169    H    MET  23           H        MET  23   4.092   1.861   1.372
  170    HA   MET  23           HA       MET  23   6.897   1.207   2.026
  171    HB2  MET  23           HB2      MET  23   4.700  -0.177   1.101
  172    HB3  MET  23           HB3      MET  23   5.631   0.059  -0.379
  173    HG2  MET  23           HG2      MET  23   7.625  -0.672   1.300
  174    HG3  MET  23           HG3      MET  23   6.281  -1.552   2.029
  175    HE1  MET  23           HE1      MET  23   8.611  -3.826  -0.375
  176    HE2  MET  23           HE2      MET  23   8.033  -3.716   1.286
  177    HE3  MET  23           HE3      MET  23   9.005  -2.410   0.609
  178    H    TYR  24           H        TYR  24   5.072   2.673  -0.683
  179    HA   TYR  24           HA       TYR  24   7.599   3.208  -2.152
  180    HB2  TYR  24           HB2      TYR  24   4.640   3.363  -2.689
  181    HB3  TYR  24           HB3      TYR  24   5.765   4.200  -3.756
  182    HD1  TYR  24           HD1      TYR  24   4.925   0.870  -2.308
  183    HD2  TYR  24           HD2      TYR  24   7.067   3.012  -5.354
  184    HE1  TYR  24           HE1      TYR  24   5.434  -1.269  -3.454
  185    HE2  TYR  24           HE2      TYR  24   7.576   0.874  -6.500
  186    HH   TYR  24           HH       TYR  24   7.704  -1.800  -5.427
  187    H    GLY  25           H        GLY  25   6.674   4.649   0.451
  188    HA2  GLY  25           HA2      GLY  25   7.434   7.337  -0.452
  189    HA3  GLY  25           HA3      GLY  25   5.815   7.217   0.240
  190    H    LEU  26           H        LEU  26   9.168   6.198   0.995
  191    HA   LEU  26           HA       LEU  26   8.614   6.154   3.875
  192    HB2  LEU  26           HB2      LEU  26  10.288   4.799   2.284
  193    HB3  LEU  26           HB3      LEU  26  11.372   6.118   2.724
  194    HG   LEU  26           HG       LEU  26  10.508   5.599   5.169
  195   HD11  LEU  26          HD11      LEU  26  10.130   2.949   3.735
  196   HD12  LEU  26          HD12      LEU  26   8.838   3.927   4.432
  197   HD13  LEU  26          HD13      LEU  26  10.053   3.195   5.481
  198   HD21  LEU  26          HD21      LEU  26  12.476   3.822   3.686
  199   HD22  LEU  26          HD22      LEU  26  12.405   4.023   5.436
  200   HD23  LEU  26          HD23      LEU  26  12.845   5.388   4.410
  201    H    SER  27           H        SER  27  10.250   8.299   1.581
  202    HA   SER  27           HA       SER  27  11.553  10.056   3.383
  203    HB2  SER  27           HB2      SER  27  10.278  10.431   0.663
  204    HB3  SER  27           HB3      SER  27  11.220  11.697   1.447
  205    HG   SER  27           HG       SER  27  12.819  10.666   0.523
  206    HA   PRO  28           HA       PRO  28   7.534  12.702   3.507
  207    HB2  PRO  28           HB2      PRO  28   5.199  11.514   2.702
  208    HB3  PRO  28           HB3      PRO  28   6.237  12.452   1.610
  209    HG2  PRO  28           HG2      PRO  28   6.027   9.498   1.949
  210    HG3  PRO  28           HG3      PRO  28   6.199  10.455   0.468
  211    HD2  PRO  28           HD2      PRO  28   8.271   9.145   1.615
  212    HD3  PRO  28           HD3      PRO  28   8.474  10.654   0.698
  213    H    ALA  29           H        ALA  29   7.489   9.268   4.182
  214    HA   ALA  29           HA       ALA  29   5.549   9.429   6.371
  215    HB1  ALA  29           HB1      ALA  29   7.530   7.317   5.457
  216    HB2  ALA  29           HB2      ALA  29   5.825   7.414   5.013
  217    HB3  ALA  29           HB3      ALA  29   6.284   7.053   6.677
  218    H    ILE  30           H        ILE  30   9.117   9.138   6.112
  219    HA   ILE  30           HA       ILE  30   9.550   9.058   8.973
  220    HB   ILE  30           HB       ILE  30  11.056   8.192   7.132
  221   HG12  ILE  30          HG12      ILE  30  12.588  10.141   8.838
  222   HG13  ILE  30          HG13      ILE  30  11.699   8.821   9.598
  223   HG21  ILE  30          HG21      ILE  30  11.723  11.141   6.865
  224   HG22  ILE  30          HG22      ILE  30  10.944  10.141   5.640
  225   HG23  ILE  30          HG23      ILE  30  12.614   9.823   6.105
  226   HD11  ILE  30          HD11      ILE  30  12.964   7.469   7.606
  227   HD12  ILE  30          HD12      ILE  30  13.627   7.657   9.229
  228   HD13  ILE  30          HD13      ILE  30  14.148   8.734   7.933
  229    H    THR  31           H        THR  31   9.276  11.687   6.641
  230    HA   THR  31           HA       THR  31  10.458  13.767   8.248
  231    HB   THR  31           HB       THR  31   8.875  15.175   6.704
  232    HG1  THR  31           HG1      THR  31   7.405  13.693   6.086
  233   HG21  THR  31          HG21      THR  31  10.322  14.397   4.671
  234   HG22  THR  31          HG22      THR  31  11.116  13.361   5.856
  235   HG23  THR  31          HG23      THR  31  11.125  15.111   6.069
  236    H    LYS  32           H        LYS  32   7.158  12.453   8.033
  237    HA   LYS  32           HA       LYS  32   6.126  14.401   9.997
  238    HB2  LYS  32           HB2      LYS  32   4.850  13.524   7.999
  239    HB3  LYS  32           HB3      LYS  32   4.835  11.941   8.775
  240    HG2  LYS  32           HG2      LYS  32   2.761  12.917   9.390
  241    HG3  LYS  32           HG3      LYS  32   3.788  13.139  10.806
  242    HD2  LYS  32           HD2      LYS  32   4.274  15.437  10.150
  243    HD3  LYS  32           HD3      LYS  32   3.376  15.230   8.647
  244    HE2  LYS  32           HE2      LYS  32   1.578  16.030   9.800
  245    HE3  LYS  32           HE3      LYS  32   1.544  14.450  10.606
  246    HZ1  LYS  32           HZ1      LYS  32   1.739  16.376  12.159
  247    HZ2  LYS  32           HZ2      LYS  32   3.261  16.714  11.485
  248    HZ3  LYS  32           HZ3      LYS  32   2.997  15.244  12.302
  249    H    TYR  33           H        TYR  33   7.360  11.124   9.914
  250    HA   TYR  33           HA       TYR  33   6.256  10.198  12.414
  251    HB2  TYR  33           HB2      TYR  33   7.224   8.795  10.576
  252    HB3  TYR  33           HB3      TYR  33   8.824   9.409  10.995
  253    HD1  TYR  33           HD1      TYR  33   5.906   7.504  12.292
  254    HD2  TYR  33           HD2      TYR  33  10.029   8.559  12.870
  255    HE1  TYR  33           HE1      TYR  33   6.083   5.816  14.100
  256    HE2  TYR  33           HE2      TYR  33  10.208   6.868  14.675
  257    HH   TYR  33           HH       TYR  33   8.034   4.441  15.149
  258    H    VAL  34           H        VAL  34   9.339  11.815  11.569
  259    HA   VAL  34           HA       VAL  34  10.472  11.696  14.218
  260    HB   VAL  34           HB       VAL  34  11.659  12.095  12.029
  261   HG11  VAL  34          HG11      VAL  34  10.798  14.973  12.306
  262   HG12  VAL  34          HG12      VAL  34   9.878  13.838  11.321
  263   HG13  VAL  34          HG13      VAL  34  11.561  14.181  10.927
  264   HG21  VAL  34          HG21      VAL  34  12.096  14.275  14.092
  265   HG22  VAL  34          HG22      VAL  34  13.291  13.641  12.961
  266   HG23  VAL  34          HG23      VAL  34  12.676  12.618  14.260
  267    H    VAL  35           H        VAL  35   8.272  13.982  12.637
  268    HA   VAL  35           HA       VAL  35   8.383  15.821  14.972
  269    HB   VAL  35           HB       VAL  35   6.996  15.930  12.269
  270   HG11  VAL  35          HG11      VAL  35   6.957  18.464  12.977
  271   HG12  VAL  35          HG12      VAL  35   7.054  17.811  14.612
  272   HG13  VAL  35          HG13      VAL  35   5.701  17.376  13.568
  273   HG21  VAL  35          HG21      VAL  35   9.691  16.554  13.199
  274   HG22  VAL  35          HG22      VAL  35   8.906  17.966  12.491
  275   HG23  VAL  35          HG23      VAL  35   9.068  16.483  11.551
  276    H    ARG  36           H        ARG  36   6.661  13.070  14.071
  277    HA   ARG  36           HA       ARG  36   4.644  12.102  14.783
  278    HB2  ARG  36           HB2      ARG  36   5.267  14.112  16.969
  279    HB3  ARG  36           HB3      ARG  36   3.977  12.919  17.108
  280    HG2  ARG  36           HG2      ARG  36   6.693  11.954  16.304
  281    HG3  ARG  36           HG3      ARG  36   6.439  12.396  17.991
  282    HD2  ARG  36           HD2      ARG  36   4.468  10.861  18.072
  283    HD3  ARG  36           HD3      ARG  36   4.826  10.361  16.407
  284    HE   ARG  36           HE       ARG  36   7.047   9.563  17.232
  285   HH11  ARG  36          HH11      ARG  36   7.229  10.921  19.840
  286   HH12  ARG  36          HH12      ARG  36   6.748   9.692  20.962
  287   HH21  ARG  36          HH21      ARG  36   5.269   7.691  18.534
  288   HH22  ARG  36          HH22      ARG  36   5.634   7.856  20.219
  Start of MODEL   17
    1    HA   SER   1           HA       SER   1 -23.314  11.353   3.162
    2    HB2  SER   1           HB2      SER   1 -21.725  13.816   2.372
    3    HB3  SER   1           HB3      SER   1 -22.056  12.404   1.373
    4    HG   SER   1           HG       SER   1 -23.451  14.250   0.998
    5    H    ASP   2           H        ASP   2 -22.354  10.850   5.540
    6    HA   ASP   2           HA       ASP   2 -19.383  10.700   5.213
    7    HB2  ASP   2           HB2      ASP   2 -20.939  11.513   7.695
    8    HB3  ASP   2           HB3      ASP   2 -19.188  11.334   7.605
    9    H    LEU   3           H        LEU   3 -18.719   9.279   7.422
   10    HA   LEU   3           HA       LEU   3 -18.674   7.088   8.293
   11    HB2  LEU   3           HB2      LEU   3 -20.903   8.285   9.063
   12    HB3  LEU   3           HB3      LEU   3 -21.659   7.074   8.030
   13    HG   LEU   3           HG       LEU   3 -19.622   5.836   9.665
   14   HD11  LEU   3          HD11      LEU   3 -20.798   6.151  11.857
   15   HD12  LEU   3          HD12      LEU   3 -21.771   7.418  11.108
   16   HD13  LEU   3          HD13      LEU   3 -20.027   7.624  11.266
   17   HD21  LEU   3          HD21      LEU   3 -22.637   5.580   9.447
   18   HD22  LEU   3          HD22      LEU   3 -21.624   4.478  10.380
   19   HD23  LEU   3          HD23      LEU   3 -21.427   4.591   8.631
   20    HA   PRO   4           HA       PRO   4 -19.684   5.246   4.138
   21    HB2  PRO   4           HB2      PRO   4 -17.156   5.138   3.102
   22    HB3  PRO   4           HB3      PRO   4 -18.222   6.542   2.909
   23    HG2  PRO   4           HG2      PRO   4 -15.864   6.198   4.632
   24    HG3  PRO   4           HG3      PRO   4 -16.571   7.672   3.962
   25    HD2  PRO   4           HD2      PRO   4 -16.842   6.702   6.602
   26    HD3  PRO   4           HD3      PRO   4 -17.711   8.067   5.871
   27    H    ALA   5           H        ALA   5 -19.806   3.702   6.255
   28    HA   ALA   5           HA       ALA   5 -17.715   1.572   5.920
   29    HB1  ALA   5           HB1      ALA   5 -19.343   2.266   8.382
   30    HB2  ALA   5           HB2      ALA   5 -17.720   2.885   8.076
   31    HB3  ALA   5           HB3      ALA   5 -17.977   1.154   8.297
   32    H    LEU   6           H        LEU   6 -19.748   1.357   4.180
   33    HA   LEU   6           HA       LEU   6 -22.081  -0.050   5.242
   34    HB2  LEU   6           HB2      LEU   6 -21.181   1.158   2.800
   35    HB3  LEU   6           HB3      LEU   6 -21.681  -0.495   2.442
   36    HG   LEU   6           HG       LEU   6 -23.755   0.112   3.947
   37   HD11  LEU   6          HD11      LEU   6 -24.371   2.479   3.808
   38   HD12  LEU   6          HD12      LEU   6 -22.873   2.839   2.949
   39   HD13  LEU   6          HD13      LEU   6 -22.821   2.316   4.633
   40   HD21  LEU   6          HD21      LEU   6 -23.441   1.284   1.163
   41   HD22  LEU   6          HD22      LEU   6 -24.957   0.824   1.940
   42   HD23  LEU   6          HD23      LEU   6 -23.778  -0.414   1.503
   43    H    SER   7           H        SER   7 -19.398  -1.105   3.086
   44    HA   SER   7           HA       SER   7 -19.489  -3.781   4.406
   45    HB2  SER   7           HB2      SER   7 -19.673  -3.163   1.444
   46    HB3  SER   7           HB3      SER   7 -19.409  -4.777   2.092
   47    HG   SER   7           HG       SER   7 -21.395  -4.560   3.207
   48    H    THR   8           H        THR   8 -17.757  -3.002   1.442
   49    HA   THR   8           HA       THR   8 -15.209  -2.571   2.911
   50    HB   THR   8           HB       THR   8 -15.458  -4.740   0.812
   51    HG1  THR   8           HG1      THR   8 -15.745  -6.200   2.486
   52   HG21  THR   8          HG21      THR   8 -13.532  -4.461   3.126
   53   HG22  THR   8          HG22      THR   8 -13.221  -3.772   1.534
   54   HG23  THR   8          HG23      THR   8 -13.386  -5.517   1.721
   55    H    GLY   9           H        GLY   9 -16.380  -0.575   1.490
   56    HA2  GLY   9           HA2      GLY   9 -15.199  -0.635  -1.250
   57    HA3  GLY   9           HA3      GLY   9 -16.455   0.481  -0.714
   58    H    LEU  10           H        LEU  10 -15.841   2.241   0.707
   59    HA   LEU  10           HA       LEU  10 -13.413   3.562   0.036
   60    HB2  LEU  10           HB2      LEU  10 -15.654   3.849   1.950
   61    HB3  LEU  10           HB3      LEU  10 -14.165   4.659   2.434
   62    HG   LEU  10           HG       LEU  10 -14.189   5.453  -0.111
   63   HD11  LEU  10          HD11      LEU  10 -17.081   4.847   0.555
   64   HD12  LEU  10          HD12      LEU  10 -16.152   4.267  -0.828
   65   HD13  LEU  10          HD13      LEU  10 -16.599   5.969  -0.717
   66   HD21  LEU  10          HD21      LEU  10 -14.385   6.771   2.121
   67   HD22  LEU  10          HD22      LEU  10 -16.116   6.787   1.789
   68   HD23  LEU  10          HD23      LEU  10 -14.995   7.535   0.653
   69    H    LEU  11           H        LEU  11 -14.222   1.520   2.852
   70    HA   LEU  11           HA       LEU  11 -11.858   1.909   4.387
   71    HB2  LEU  11           HB2      LEU  11 -14.187   0.440   4.533
   72    HB3  LEU  11           HB3      LEU  11 -12.980  -0.826   4.304
   73    HG   LEU  11           HG       LEU  11 -12.465   1.350   6.310
   74   HD11  LEU  11          HD11      LEU  11 -14.025  -1.173   6.924
   75   HD12  LEU  11          HD12      LEU  11 -14.785   0.402   6.691
   76   HD13  LEU  11          HD13      LEU  11 -13.658   0.154   8.025
   77   HD21  LEU  11          HD21      LEU  11 -11.849  -1.567   6.635
   78   HD22  LEU  11          HD22      LEU  11 -10.934  -0.164   7.185
   79   HD23  LEU  11          HD23      LEU  11 -10.896  -0.629   5.485
   80    H    HIS  12           H        HIS  12 -12.574  -0.561   1.884
   81    HA   HIS  12           HA       HIS  12  -9.966  -1.794   1.921
   82    HB2  HIS  12           HB2      HIS  12 -12.458  -2.217   0.757
   83    HB3  HIS  12           HB3      HIS  12 -11.435  -1.834  -0.626
   84    HD1  HIS  12           HD1      HIS  12 -10.902  -4.092  -1.602
   85    HD2  HIS  12           HD2      HIS  12 -10.384  -4.022   2.534
   86    HE1  HIS  12           HE1      HIS  12  -9.887  -6.324  -0.969
   87    H    LEU  13           H        LEU  13 -11.423   0.756  -0.124
   88    HA   LEU  13           HA       LEU  13  -9.266   1.166  -1.932
   89    HB2  LEU  13           HB2      LEU  13 -11.609   2.094  -2.019
   90    HB3  LEU  13           HB3      LEU  13 -11.159   3.223  -0.742
   91    HG   LEU  13           HG       LEU  13  -9.224   3.222  -2.932
   92   HD11  LEU  13          HD11      LEU  13 -10.679   4.314  -4.587
   93   HD12  LEU  13          HD12      LEU  13 -12.077   4.066  -3.539
   94   HD13  LEU  13          HD13      LEU  13 -11.251   2.680  -4.253
   95   HD21  LEU  13          HD21      LEU  13 -10.996   5.483  -1.991
   96   HD22  LEU  13          HD22      LEU  13  -9.350   5.569  -2.621
   97   HD23  LEU  13          HD23      LEU  13  -9.645   4.906  -1.013
   98    H    HIS  14           H        HIS  14  -9.872   2.568   1.304
   99    HA   HIS  14           HA       HIS  14  -7.703   4.416   1.384
  100    HB2  HIS  14           HB2      HIS  14  -9.525   4.371   3.012
  101    HB3  HIS  14           HB3      HIS  14  -9.059   2.751   3.534
  102    HD1  HIS  14           HD1      HIS  14  -7.699   6.303   3.487
  103    HD2  HIS  14           HD2      HIS  14  -7.077   2.702   5.492
  104    HE1  HIS  14           HE1      HIS  14  -6.049   6.793   5.346
  105    H    GLN  15           H        GLN  15  -7.850   0.981   2.396
  106    HA   GLN  15           HA       GLN  15  -5.103   0.786   3.244
  107    HB2  GLN  15           HB2      GLN  15  -7.435  -0.814   3.110
  108    HB3  GLN  15           HB3      GLN  15  -6.207  -1.682   2.191
  109    HG2  GLN  15           HG2      GLN  15  -6.090  -2.345   4.543
  110    HG3  GLN  15           HG3      GLN  15  -4.638  -1.444   4.109
  111   HE21  GLN  15          HE21      GLN  15  -7.959  -0.318   5.025
  112   HE22  GLN  15          HE22      GLN  15  -7.420   0.679   6.286
  113    H    ASN  16           H        ASN  16  -6.725   0.361   0.113
  114    HA   ASN  16           HA       ASN  16  -4.523  -0.809  -1.313
  115    HB2  ASN  16           HB2      ASN  16  -7.093  -0.425  -1.838
  116    HB3  ASN  16           HB3      ASN  16  -6.505   1.064  -2.576
  117   HD21  ASN  16          HD21      ASN  16  -5.337  -2.368  -2.507
  118   HD22  ASN  16          HD22      ASN  16  -5.096  -2.462  -4.183
  119    H    ILE  17           H        ILE  17  -4.995   2.389  -0.095
  120    HA   ILE  17           HA       ILE  17  -2.946   3.520  -1.958
  121    HB   ILE  17           HB       ILE  17  -5.006   4.755  -0.093
  122   HG12  ILE  17          HG12      ILE  17  -5.961   3.758  -2.131
  123   HG13  ILE  17          HG13      ILE  17  -6.048   5.516  -2.213
  124   HG21  ILE  17          HG21      ILE  17  -2.964   6.047  -1.924
  125   HG22  ILE  17          HG22      ILE  17  -3.092   6.230  -0.174
  126   HG23  ILE  17          HG23      ILE  17  -4.337   6.905  -1.224
  127   HD11  ILE  17          HD11      ILE  17  -4.263   3.635  -3.728
  128   HD12  ILE  17          HD12      ILE  17  -3.715   5.283  -3.419
  129   HD13  ILE  17          HD13      ILE  17  -5.203   5.003  -4.324
  130    H    VAL  18           H        VAL  18  -3.787   3.106   1.488
  131    HA   VAL  18           HA       VAL  18  -1.295   4.356   2.417
  132    HB   VAL  18           HB       VAL  18  -3.591   2.882   3.741
  133   HG11  VAL  18          HG11      VAL  18  -1.138   4.196   4.934
  134   HG12  VAL  18          HG12      VAL  18  -1.716   2.549   5.192
  135   HG13  VAL  18          HG13      VAL  18  -2.611   3.913   5.862
  136   HG21  VAL  18          HG21      VAL  18  -4.533   4.910   3.295
  137   HG22  VAL  18          HG22      VAL  18  -2.972   5.688   3.035
  138   HG23  VAL  18          HG23      VAL  18  -3.578   5.453   4.674
  139    H    ASP  19           H        ASP  19  -2.641   1.059   2.268
  140    HA   ASP  19           HA       ASP  19  -0.283  -0.172   3.466
  141    HB2  ASP  19           HB2      ASP  19  -2.958  -0.848   2.830
  142    HB3  ASP  19           HB3      ASP  19  -1.944  -1.973   1.929
  143    H    VAL  20           H        VAL  20  -0.745   1.146   0.392
  144    HA   VAL  20           HA       VAL  20   1.084  -0.847  -0.881
  145    HB   VAL  20           HB       VAL  20  -0.750   1.268  -2.057
  146   HG11  VAL  20          HG11      VAL  20  -0.258   0.118  -4.205
  147   HG12  VAL  20          HG12      VAL  20   0.914  -0.905  -3.373
  148   HG13  VAL  20          HG13      VAL  20   1.191   0.832  -3.499
  149   HG21  VAL  20          HG21      VAL  20  -1.918  -0.886  -2.884
  150   HG22  VAL  20          HG22      VAL  20  -2.119  -0.468  -1.183
  151   HG23  VAL  20          HG23      VAL  20  -0.971  -1.721  -1.652
  152    H    GLN  21           H        GLN  21   0.740   2.534   0.026
  153    HA   GLN  21           HA       GLN  21   3.109   3.432  -1.444
  154    HB2  GLN  21           HB2      GLN  21   1.080   4.539   0.452
  155    HB3  GLN  21           HB3      GLN  21   2.610   5.403   0.310
  156    HG2  GLN  21           HG2      GLN  21   2.317   5.498  -2.149
  157    HG3  GLN  21           HG3      GLN  21   0.764   4.677  -1.985
  158   HE21  GLN  21          HE21      GLN  21  -0.823   5.860  -0.394
  159   HE22  GLN  21          HE22      GLN  21  -0.834   7.557  -0.471
  160    H    TYR  22           H        TYR  22   2.350   2.487   1.910
  161    HA   TYR  22           HA       TYR  22   4.856   3.244   3.082
  162    HB2  TYR  22           HB2      TYR  22   3.891   2.341   4.968
  163    HB3  TYR  22           HB3      TYR  22   2.446   2.378   3.967
  164    HD1  TYR  22           HD1      TYR  22   5.139   0.227   5.315
  165    HD2  TYR  22           HD2      TYR  22   1.469   0.351   3.095
  166    HE1  TYR  22           HE1      TYR  22   4.936  -2.236   5.513
  167    HE2  TYR  22           HE2      TYR  22   1.265  -2.112   3.292
  168    HH   TYR  22           HH       TYR  22   2.196  -3.897   5.059
  169    H    MET  23           H        MET  23   3.844   0.341   1.317
  170    HA   MET  23           HA       MET  23   6.314  -1.131   1.954
  171    HB2  MET  23           HB2      MET  23   3.684  -1.671   1.041
  172    HB3  MET  23           HB3      MET  23   4.770  -2.183  -0.251
  173    HG2  MET  23           HG2      MET  23   5.779  -2.954   2.376
  174    HG3  MET  23           HG3      MET  23   4.177  -3.622   2.067
  175    HE1  MET  23           HE1      MET  23   7.686  -3.066   0.995
  176    HE2  MET  23           HE2      MET  23   8.160  -4.528   0.134
  177    HE3  MET  23           HE3      MET  23   7.769  -4.613   1.848
  178    H    TYR  24           H        TYR  24   5.362   1.213  -0.403
  179    HA   TYR  24           HA       TYR  24   7.400   0.291  -2.371
  180    HB2  TYR  24           HB2      TYR  24   5.001   2.075  -2.322
  181    HB3  TYR  24           HB3      TYR  24   6.258   2.445  -3.500
  182    HD1  TYR  24           HD1      TYR  24   4.611  -0.656  -2.138
  183    HD2  TYR  24           HD2      TYR  24   5.929   1.515  -5.604
  184    HE1  TYR  24           HE1      TYR  24   3.788  -2.483  -3.596
  185    HE2  TYR  24           HE2      TYR  24   5.105  -0.313  -7.060
  186    HH   TYR  24           HH       TYR  24   3.074  -2.276  -6.574
  187    H    GLY  25           H        GLY  25   8.446   1.257   0.103
  188    HA2  GLY  25           HA2      GLY  25  10.125   3.442  -0.878
  189    HA3  GLY  25           HA3      GLY  25   9.073   3.909   0.458
  190    H    LEU  26           H        LEU  26  10.934   0.917  -0.214
  191    HA   LEU  26           HA       LEU  26  12.093   1.155   2.542
  192    HB2  LEU  26           HB2      LEU  26  10.955  -1.004   0.894
  193    HB3  LEU  26           HB3      LEU  26  12.466  -1.444   1.690
  194    HG   LEU  26           HG       LEU  26  11.344  -0.329   3.798
  195   HD11  LEU  26          HD11      LEU  26   9.366   0.558   2.755
  196   HD12  LEU  26          HD12      LEU  26   8.851  -0.808   3.745
  197   HD13  LEU  26          HD13      LEU  26   9.000  -0.992   1.997
  198   HD21  LEU  26          HD21      LEU  26  10.416  -3.018   2.737
  199   HD22  LEU  26          HD22      LEU  26  10.448  -2.524   4.430
  200   HD23  LEU  26          HD23      LEU  26  11.958  -2.729   3.543
  201    H    SER  27           H        SER  27  12.921   1.376  -0.758
  202    HA   SER  27           HA       SER  27  15.503   0.170  -0.848
  203    HB2  SER  27           HB2      SER  27  14.166   2.459  -2.298
  204    HB3  SER  27           HB3      SER  27  15.796   1.932  -2.711
  205    HG   SER  27           HG       SER  27  13.696   0.935  -3.696
  206    HA   PRO  28           HA       PRO  28  17.304   4.437   0.424
  207    HB2  PRO  28           HB2      PRO  28  15.616   6.268   1.560
  208    HB3  PRO  28           HB3      PRO  28  15.942   6.200  -0.184
  209    HG2  PRO  28           HG2      PRO  28  13.611   5.156   1.347
  210    HG3  PRO  28           HG3      PRO  28  13.658   5.954  -0.233
  211    HD2  PRO  28           HD2      PRO  28  13.399   3.267   0.073
  212    HD3  PRO  28           HD3      PRO  28  14.167   4.018  -1.344
  213    H    ALA  29           H        ALA  29  14.890   2.763   2.269
  214    HA   ALA  29           HA       ALA  29  15.824   3.627   4.906
  215    HB1  ALA  29           HB1      ALA  29  13.503   2.960   4.474
  216    HB2  ALA  29           HB2      ALA  29  14.228   1.845   5.633
  217    HB3  ALA  29           HB3      ALA  29  14.037   1.365   3.947
  218    H    ILE  30           H        ILE  30  16.223   0.715   2.857
  219    HA   ILE  30           HA       ILE  30  17.786  -0.769   4.781
  220    HB   ILE  30           HB       ILE  30  17.471  -0.918   1.768
  221   HG12  ILE  30          HG12      ILE  30  15.398  -1.312   3.021
  222   HG13  ILE  30          HG13      ILE  30  15.979  -2.829   2.336
  223   HG21  ILE  30          HG21      ILE  30  18.225  -3.380   2.300
  224   HG22  ILE  30          HG22      ILE  30  18.984  -2.641   3.711
  225   HG23  ILE  30          HG23      ILE  30  19.445  -2.123   2.090
  226   HD11  ILE  30          HD11      ILE  30  17.215  -3.047   4.666
  227   HD12  ILE  30          HD12      ILE  30  15.514  -3.487   4.519
  228   HD13  ILE  30          HD13      ILE  30  15.965  -1.922   5.196
  229    H    THR  31           H        THR  31  18.693   1.282   2.003
  230    HA   THR  31           HA       THR  31  21.523   0.854   2.171
  231    HB   THR  31           HB       THR  31  20.172   1.866   0.278
  232    HG1  THR  31           HG1      THR  31  22.204   2.235  -0.135
  233   HG21  THR  31          HG21      THR  31  19.536   4.162   0.343
  234   HG22  THR  31          HG22      THR  31  20.418   4.439   1.845
  235   HG23  THR  31          HG23      THR  31  18.948   3.467   1.852
  236    H    LYS  32           H        LYS  32  19.372   3.074   3.917
  237    HA   LYS  32           HA       LYS  32  21.500   4.682   5.077
  238    HB2  LYS  32           HB2      LYS  32  18.952   5.144   4.737
  239    HB3  LYS  32           HB3      LYS  32  18.754   4.255   6.249
  240    HG2  LYS  32           HG2      LYS  32  20.590   5.844   7.172
  241    HG3  LYS  32           HG3      LYS  32  20.218   6.847   5.769
  242    HD2  LYS  32           HD2      LYS  32  17.754   6.642   6.500
  243    HD3  LYS  32           HD3      LYS  32  18.391   6.057   8.038
  244    HE2  LYS  32           HE2      LYS  32  19.681   8.125   8.332
  245    HE3  LYS  32           HE3      LYS  32  19.127   8.713   6.753
  246    HZ1  LYS  32           HZ1      LYS  32  16.830   8.472   7.537
  247    HZ2  LYS  32           HZ2      LYS  32  17.702   9.575   8.490
  248    HZ3  LYS  32           HZ3      LYS  32  17.395   8.007   9.066
  249    H    TYR  33           H        TYR  33  19.875   1.692   5.933
  250    HA   TYR  33           HA       TYR  33  20.958   1.596   8.665
  251    HB2  TYR  33           HB2      TYR  33  18.739   0.643   7.705
  252    HB3  TYR  33           HB3      TYR  33  19.739  -0.660   7.061
  253    HD1  TYR  33           HD1      TYR  33  18.546   0.993  10.147
  254    HD2  TYR  33           HD2      TYR  33  20.755  -2.306   8.509
  255    HE1  TYR  33           HE1      TYR  33  18.535  -0.115  12.366
  256    HE2  TYR  33           HE2      TYR  33  20.744  -3.415  10.728
  257    HH   TYR  33           HH       TYR  33  20.477  -2.281  13.346
  258    H    VAL  34           H        VAL  34  21.527  -0.094   5.560
  259    HA   VAL  34           HA       VAL  34  23.794  -1.624   6.614
  260    HB   VAL  34           HB       VAL  34  22.062  -2.204   4.766
  261   HG11  VAL  34          HG11      VAL  34  22.235  -1.274   2.681
  262   HG12  VAL  34          HG12      VAL  34  23.980  -1.049   2.809
  263   HG13  VAL  34          HG13      VAL  34  22.885   0.086   3.596
  264   HG21  VAL  34          HG21      VAL  34  23.579  -3.722   3.764
  265   HG22  VAL  34          HG22      VAL  34  24.261  -3.416   5.361
  266   HG23  VAL  34          HG23      VAL  34  24.939  -2.615   3.943
  267    H    VAL  35           H        VAL  35  25.960  -1.455   5.377
  268    HA   VAL  35           HA       VAL  35  27.874  -0.208   4.805
  269    HB   VAL  35           HB       VAL  35  25.781   1.730   3.753
  270   HG11  VAL  35          HG11      VAL  35  28.700   1.270   3.075
  271   HG12  VAL  35          HG12      VAL  35  27.992   2.724   3.778
  272   HG13  VAL  35          HG13      VAL  35  27.612   2.274   2.117
  273   HG21  VAL  35          HG21      VAL  35  25.435   0.358   1.964
  274   HG22  VAL  35          HG22      VAL  35  26.018  -0.910   3.040
  275   HG23  VAL  35          HG23      VAL  35  27.124  -0.143   1.901
  276    H    ARG  36           H        ARG  36  28.032   0.065   7.229
  277    HA   ARG  36           HA       ARG  36  27.436   2.841   8.169
  278    HB2  ARG  36           HB2      ARG  36  26.607   0.784   9.388
  279    HB3  ARG  36           HB3      ARG  36  28.291   0.375   9.719
  280    HG2  ARG  36           HG2      ARG  36  28.541   2.652  10.792
  281    HG3  ARG  36           HG3      ARG  36  26.795   2.846  10.634
  282    HD2  ARG  36           HD2      ARG  36  26.854   1.914  12.757
  283    HD3  ARG  36           HD3      ARG  36  26.845   0.412  11.813
  284    HE   ARG  36           HE       ARG  36  29.511   0.973  11.885
  285   HH11  ARG  36          HH11      ARG  36  28.599  -1.222  13.595
  286   HH12  ARG  36          HH12      ARG  36  28.993  -0.681  15.193
  287   HH21  ARG  36          HH21      ARG  36  29.361   2.647  14.252
  288   HH22  ARG  36          HH22      ARG  36  29.426   1.520  15.567
  Start of MODEL   18
    1    HA   SER   1           HA       SER   1 -30.132   0.271  -3.845
    2    HB2  SER   1           HB2      SER   1 -31.772   0.986  -1.390
    3    HB3  SER   1           HB3      SER   1 -31.727   1.886  -2.903
    4    HG   SER   1           HG       SER   1 -33.522   0.466  -2.803
    5    H    ASP   2           H        ASP   2 -28.368   1.596  -3.864
    6    HA   ASP   2           HA       ASP   2 -26.587   2.947  -3.148
    7    HB2  ASP   2           HB2      ASP   2 -28.429   3.208  -0.746
    8    HB3  ASP   2           HB3      ASP   2 -27.032   4.235  -1.055
    9    H    LEU   3           H        LEU   3 -25.011   3.186  -1.153
   10    HA   LEU   3           HA       LEU   3 -23.360   2.104   0.144
   11    HB2  LEU   3           HB2      LEU   3 -25.611   2.030   1.446
   12    HB3  LEU   3           HB3      LEU   3 -25.618   0.316   1.033
   13    HG   LEU   3           HG       LEU   3 -23.006   0.873   1.953
   14   HD11  LEU   3          HD11      LEU   3 -23.515   1.748   4.246
   15   HD12  LEU   3          HD12      LEU   3 -25.159   2.094   3.707
   16   HD13  LEU   3          HD13      LEU   3 -23.794   2.938   2.974
   17   HD21  LEU   3          HD21      LEU   3 -23.804  -0.561   3.899
   18   HD22  LEU   3          HD22      LEU   3 -24.081  -1.248   2.298
   19   HD23  LEU   3          HD23      LEU   3 -25.413  -0.500   3.179
   20    HA   PRO   4           HA       PRO   4 -23.207  -1.627  -2.585
   21    HB2  PRO   4           HB2      PRO   4 -21.642  -0.626  -4.601
   22    HB3  PRO   4           HB3      PRO   4 -23.407  -0.479  -4.583
   23    HG2  PRO   4           HG2      PRO   4 -21.383   1.578  -4.209
   24    HG3  PRO   4           HG3      PRO   4 -23.111   1.749  -4.539
   25    HD2  PRO   4           HD2      PRO   4 -21.711   1.975  -2.012
   26    HD3  PRO   4           HD3      PRO   4 -23.410   2.347  -2.381
   27    H    ALA   5           H        ALA   5 -20.703  -2.081  -3.886
   28    HA   ALA   5           HA       ALA   5 -18.547  -2.902  -3.398
   29    HB1  ALA   5           HB1      ALA   5 -17.131  -1.231  -2.313
   30    HB2  ALA   5           HB2      ALA   5 -18.551  -0.419  -1.654
   31    HB3  ALA   5           HB3      ALA   5 -18.264  -0.420  -3.395
   32    H    LEU   6           H        LEU   6 -20.699  -3.955  -1.732
   33    HA   LEU   6           HA       LEU   6 -21.007  -5.213   0.238
   34    HB2  LEU   6           HB2      LEU   6 -18.349  -5.499  -0.766
   35    HB3  LEU   6           HB3      LEU   6 -18.246  -5.476   0.993
   36    HG   LEU   6           HG       LEU   6 -18.577  -7.774   0.156
   37   HD11  LEU   6          HD11      LEU   6 -19.817  -6.645   2.266
   38   HD12  LEU   6          HD12      LEU   6 -20.026  -8.343   1.840
   39   HD13  LEU   6          HD13      LEU   6 -21.234  -7.156   1.348
   40   HD21  LEU   6          HD21      LEU   6 -20.439  -8.416  -1.147
   41   HD22  LEU   6          HD22      LEU   6 -19.937  -6.889  -1.872
   42   HD23  LEU   6          HD23      LEU   6 -21.321  -6.934  -0.779
   43    H    SER   7           H        SER   7 -20.947  -2.279   0.515
   44    HA   SER   7           HA       SER   7 -20.862  -0.634   2.199
   45    HB2  SER   7           HB2      SER   7 -22.226  -2.583   3.156
   46    HB3  SER   7           HB3      SER   7 -20.776  -3.029   4.049
   47    HG   SER   7           HG       SER   7 -20.814  -0.994   5.024
   48    H    THR   8           H        THR   8 -18.244  -1.563   1.149
   49    HA   THR   8           HA       THR   8 -16.550  -0.473   3.288
   50    HB   THR   8           HB       THR   8 -16.888  -2.886   3.867
   51    HG1  THR   8           HG1      THR   8 -14.783  -3.175   4.325
   52   HG21  THR   8          HG21      THR   8 -15.959  -4.622   2.451
   53   HG22  THR   8          HG22      THR   8 -15.368  -3.423   1.300
   54   HG23  THR   8          HG23      THR   8 -17.102  -3.677   1.498
   55    H    GLY   9           H        GLY   9 -17.204   0.176   0.450
   56    HA2  GLY   9           HA2      GLY   9 -14.996  -0.544  -1.258
   57    HA3  GLY   9           HA3      GLY   9 -16.100   0.805  -1.528
   58    H    LEU  10           H        LEU  10 -15.693   2.465   0.569
   59    HA   LEU  10           HA       LEU  10 -13.174   3.734  -0.015
   60    HB2  LEU  10           HB2      LEU  10 -15.569   4.417   1.140
   61    HB3  LEU  10           HB3      LEU  10 -14.518   4.342   2.555
   62    HG   LEU  10           HG       LEU  10 -13.660   5.816   0.068
   63   HD11  LEU  10          HD11      LEU  10 -15.231   6.959   2.398
   64   HD12  LEU  10          HD12      LEU  10 -15.867   6.712   0.771
   65   HD13  LEU  10          HD13      LEU  10 -14.569   7.874   1.044
   66   HD21  LEU  10          HD21      LEU  10 -12.427   7.130   1.890
   67   HD22  LEU  10          HD22      LEU  10 -11.892   5.469   1.641
   68   HD23  LEU  10          HD23      LEU  10 -12.935   5.863   3.008
   69    H    LEU  11           H        LEU  11 -14.286   1.690   2.697
   70    HA   LEU  11           HA       LEU  11 -11.966   1.897   4.353
   71    HB2  LEU  11           HB2      LEU  11 -14.300   0.898   4.791
   72    HB3  LEU  11           HB3      LEU  11 -13.708  -0.554   3.981
   73    HG   LEU  11           HG       LEU  11 -11.882   0.511   6.039
   74   HD11  LEU  11          HD11      LEU  11 -13.185  -0.099   7.946
   75   HD12  LEU  11          HD12      LEU  11 -14.442  -0.823   6.944
   76   HD13  LEU  11          HD13      LEU  11 -14.231   0.928   6.966
   77   HD21  LEU  11          HD21      LEU  11 -11.648  -1.672   4.824
   78   HD22  LEU  11          HD22      LEU  11 -13.125  -2.226   5.614
   79   HD23  LEU  11          HD23      LEU  11 -11.695  -1.857   6.576
   80    H    HIS  12           H        HIS  12 -12.797  -0.432   1.761
   81    HA   HIS  12           HA       HIS  12 -10.355  -1.968   1.939
   82    HB2  HIS  12           HB2      HIS  12 -12.627  -1.592   0.012
   83    HB3  HIS  12           HB3      HIS  12 -11.195  -2.459  -0.540
   84    HD1  HIS  12           HD1      HIS  12 -12.233  -2.731   3.053
   85    HD2  HIS  12           HD2      HIS  12 -12.594  -4.957  -0.455
   86    HE1  HIS  12           HE1      HIS  12 -13.041  -5.030   3.742
   87    H    LEU  13           H        LEU  13 -11.396   0.726  -0.181
   88    HA   LEU  13           HA       LEU  13  -9.009   0.878  -1.763
   89    HB2  LEU  13           HB2      LEU  13 -11.396   1.967  -1.968
   90    HB3  LEU  13           HB3      LEU  13 -10.684   3.265  -1.010
   91    HG   LEU  13           HG       LEU  13  -8.739   2.791  -2.919
   92   HD11  LEU  13          HD11      LEU  13 -10.510   1.312  -4.045
   93   HD12  LEU  13          HD12      LEU  13  -9.781   2.566  -5.049
   94   HD13  LEU  13          HD13      LEU  13 -11.392   2.805  -4.372
   95   HD21  LEU  13          HD21      LEU  13  -9.372   4.950  -3.782
   96   HD22  LEU  13          HD22      LEU  13  -9.718   4.966  -2.052
   97   HD23  LEU  13          HD23      LEU  13 -11.030   4.755  -3.212
   98    H    HIS  14           H        HIS  14  -9.922   2.373   1.338
   99    HA   HIS  14           HA       HIS  14  -7.777   4.207   1.644
  100    HB2  HIS  14           HB2      HIS  14  -9.656   4.230   3.135
  101    HB3  HIS  14           HB3      HIS  14  -9.430   2.534   3.558
  102    HD1  HIS  14           HD1      HIS  14  -8.342   2.219   5.765
  103    HD2  HIS  14           HD2      HIS  14  -7.115   5.776   3.974
  104    HE1  HIS  14           HE1      HIS  14  -6.772   3.342   7.405
  105    H    GLN  15           H        GLN  15  -7.974   0.869   2.988
  106    HA   GLN  15           HA       GLN  15  -5.252   0.709   3.838
  107    HB2  GLN  15           HB2      GLN  15  -7.571  -0.888   3.784
  108    HB3  GLN  15           HB3      GLN  15  -6.359  -1.819   2.904
  109    HG2  GLN  15           HG2      GLN  15  -5.836  -2.485   5.048
  110    HG3  GLN  15           HG3      GLN  15  -4.825  -1.044   4.954
  111   HE21  GLN  15          HE21      GLN  15  -5.700   0.970   5.977
  112   HE22  GLN  15          HE22      GLN  15  -6.862   0.847   7.208
  113    H    ASN  16           H        ASN  16  -6.786  -0.100   0.727
  114    HA   ASN  16           HA       ASN  16  -4.576  -1.335  -0.572
  115    HB2  ASN  16           HB2      ASN  16  -6.996  -1.187  -1.291
  116    HB3  ASN  16           HB3      ASN  16  -6.690   0.481  -1.773
  117   HD21  ASN  16          HD21      ASN  16  -5.297   0.847  -3.649
  118   HD22  ASN  16          HD22      ASN  16  -4.899  -0.416  -4.709
  119    H    ILE  17           H        ILE  17  -5.499   2.131  -0.415
  120    HA   ILE  17           HA       ILE  17  -3.154   2.960  -1.982
  121    HB   ILE  17           HB       ILE  17  -5.369   4.358  -0.454
  122   HG12  ILE  17          HG12      ILE  17  -5.955   3.234  -2.595
  123   HG13  ILE  17          HG13      ILE  17  -6.122   4.986  -2.708
  124   HG21  ILE  17          HG21      ILE  17  -4.487   6.434  -1.691
  125   HG22  ILE  17          HG22      ILE  17  -2.991   5.526  -1.914
  126   HG23  ILE  17          HG23      ILE  17  -3.561   5.898  -0.288
  127   HD11  ILE  17          HD11      ILE  17  -3.784   5.049  -3.685
  128   HD12  ILE  17          HD12      ILE  17  -4.985   4.255  -4.702
  129   HD13  ILE  17          HD13      ILE  17  -3.844   3.289  -3.766
  130    H    VAL  18           H        VAL  18  -4.110   2.914   1.441
  131    HA   VAL  18           HA       VAL  18  -1.804   4.407   2.387
  132    HB   VAL  18           HB       VAL  18  -3.909   2.654   3.674
  133   HG11  VAL  18          HG11      VAL  18  -1.741   4.344   4.948
  134   HG12  VAL  18          HG12      VAL  18  -2.022   2.618   5.174
  135   HG13  VAL  18          HG13      VAL  18  -3.173   3.790   5.813
  136   HG21  VAL  18          HG21      VAL  18  -4.795   4.850   4.422
  137   HG22  VAL  18          HG22      VAL  18  -4.718   4.747   2.664
  138   HG23  VAL  18          HG23      VAL  18  -3.496   5.660   3.548
  139    H    ASP  19           H        ASP  19  -2.109   1.188   1.292
  140    HA   ASP  19           HA       ASP  19   0.305   0.374   2.885
  141    HB2  ASP  19           HB2      ASP  19  -2.182  -0.742   2.885
  142    HB3  ASP  19           HB3      ASP  19  -1.410  -1.684   1.611
  143    H    VAL  20           H        VAL  20   0.140   1.784   0.186
  144    HA   VAL  20           HA       VAL  20   1.707  -0.246  -1.372
  145    HB   VAL  20           HB       VAL  20  -0.467   1.669  -2.247
  146   HG11  VAL  20          HG11      VAL  20   0.079   0.855  -4.580
  147   HG12  VAL  20          HG12      VAL  20   1.572   0.182  -3.927
  148   HG13  VAL  20          HG13      VAL  20   1.296   1.923  -3.882
  149   HG21  VAL  20          HG21      VAL  20  -0.088  -1.296  -2.741
  150   HG22  VAL  20          HG22      VAL  20  -1.530  -0.338  -3.074
  151   HG23  VAL  20          HG23      VAL  20  -1.038  -0.641  -1.408
  152    H    GLN  21           H        GLN  21   0.904   3.230  -1.339
  153    HA   GLN  21           HA       GLN  21   3.350   4.122  -2.555
  154    HB2  GLN  21           HB2      GLN  21   1.110   5.319  -0.935
  155    HB3  GLN  21           HB3      GLN  21   2.514   6.308  -1.342
  156    HG2  GLN  21           HG2      GLN  21   1.629   6.669  -3.378
  157    HG3  GLN  21           HG3      GLN  21   1.785   4.946  -3.719
  158   HE21  GLN  21          HE21      GLN  21  -0.131   3.596  -3.470
  159   HE22  GLN  21          HE22      GLN  21  -1.674   4.272  -3.266
  160    H    TYR  22           H        TYR  22   2.769   2.892   0.588
  161    HA   TYR  22           HA       TYR  22   5.062   4.373   1.791
  162    HB2  TYR  22           HB2      TYR  22   3.016   2.515   3.053
  163    HB3  TYR  22           HB3      TYR  22   4.078   3.647   3.891
  164    HD1  TYR  22           HD1      TYR  22   1.126   3.334   1.688
  165    HD2  TYR  22           HD2      TYR  22   3.610   6.034   3.919
  166    HE1  TYR  22           HE1      TYR  22  -0.555   5.124   1.384
  167    HE2  TYR  22           HE2      TYR  22   1.922   7.824   3.621
  168    HH   TYR  22           HH       TYR  22  -0.181   8.031   1.487
  169    H    MET  23           H        MET  23   4.530   1.500   0.123
  170    HA   MET  23           HA       MET  23   6.851   0.185   1.489
  171    HB2  MET  23           HB2      MET  23   4.079  -0.694   1.033
  172    HB3  MET  23           HB3      MET  23   5.282  -1.869   0.497
  173    HG2  MET  23           HG2      MET  23   5.982  -0.712   3.083
  174    HG3  MET  23           HG3      MET  23   4.403  -1.496   3.121
  175    HE1  MET  23           HE1      MET  23   4.117  -4.172   3.246
  176    HE2  MET  23           HE2      MET  23   4.962  -5.030   1.961
  177    HE3  MET  23           HE3      MET  23   4.057  -3.567   1.585
  178    H    TYR  24           H        TYR  24   6.531   1.855  -1.071
  179    HA   TYR  24           HA       TYR  24   7.515  -0.214  -3.013
  180    HB2  TYR  24           HB2      TYR  24   5.427   1.779  -3.119
  181    HB3  TYR  24           HB3      TYR  24   6.634   2.127  -4.356
  182    HD1  TYR  24           HD1      TYR  24   7.445   0.095  -5.793
  183    HD2  TYR  24           HD2      TYR  24   3.802   0.134  -3.516
  184    HE1  TYR  24           HE1      TYR  24   6.552  -1.751  -7.187
  185    HE2  TYR  24           HE2      TYR  24   2.910  -1.711  -4.911
  186    HH   TYR  24           HH       TYR  24   3.805  -2.494  -7.713
  187    H    GLY  25           H        GLY  25   8.854   1.864  -0.993
  188    HA2  GLY  25           HA2      GLY  25  10.715   3.039  -3.023
  189    HA3  GLY  25           HA3      GLY  25  10.349   3.818  -1.485
  190    H    LEU  26           H        LEU  26  10.985   0.353  -1.978
  191    HA   LEU  26           HA       LEU  26  13.389   0.645  -0.203
  192    HB2  LEU  26           HB2      LEU  26  11.205  -1.402  -0.529
  193    HB3  LEU  26           HB3      LEU  26  12.761  -1.893   0.142
  194    HG   LEU  26           HG       LEU  26  11.696   0.598   1.300
  195   HD11  LEU  26          HD11      LEU  26  10.069  -0.696   2.746
  196   HD12  LEU  26          HD12      LEU  26  10.229  -2.035   1.609
  197   HD13  LEU  26          HD13      LEU  26   9.560  -0.495   1.070
  198   HD21  LEU  26          HD21      LEU  26  13.667  -0.572   2.186
  199   HD22  LEU  26          HD22      LEU  26  12.708  -2.030   2.439
  200   HD23  LEU  26          HD23      LEU  26  12.374  -0.580   3.386
  201    H    SER  27           H        SER  27  13.090   0.714  -3.288
  202    HA   SER  27           HA       SER  27  15.458  -0.884  -3.874
  203    HB2  SER  27           HB2      SER  27  13.666  -1.909  -5.784
  204    HB3  SER  27           HB3      SER  27  14.363  -2.783  -4.428
  205    HG   SER  27           HG       SER  27  12.495  -2.707  -3.451
  206    HA   PRO  28           HA       PRO  28  14.211   1.465  -7.828
  207    HB2  PRO  28           HB2      PRO  28  11.758   2.670  -7.975
  208    HB3  PRO  28           HB3      PRO  28  12.047   0.998  -8.495
  209    HG2  PRO  28           HG2      PRO  28  10.850   2.012  -5.967
  210    HG3  PRO  28           HG3      PRO  28  10.402   0.605  -6.944
  211    HD2  PRO  28           HD2      PRO  28  11.853   0.435  -4.646
  212    HD3  PRO  28           HD3      PRO  28  11.979  -0.736  -5.976
  213    H    ALA  29           H        ALA  29  13.358   2.635  -4.683
  214    HA   ALA  29           HA       ALA  29  13.880   5.469  -5.436
  215    HB1  ALA  29           HB1      ALA  29  13.072   5.805  -3.048
  216    HB2  ALA  29           HB2      ALA  29  12.796   4.065  -2.978
  217    HB3  ALA  29           HB3      ALA  29  11.896   5.056  -4.127
  218    H    ILE  30           H        ILE  30  15.525   2.754  -4.097
  219    HA   ILE  30           HA       ILE  30  17.589   4.553  -2.874
  220    HB   ILE  30           HB       ILE  30  16.787   1.694  -2.240
  221   HG12  ILE  30          HG12      ILE  30  16.563   4.125  -0.454
  222   HG13  ILE  30          HG13      ILE  30  15.258   3.659  -1.544
  223   HG21  ILE  30          HG21      ILE  30  19.197   2.087  -1.877
  224   HG22  ILE  30          HG22      ILE  30  18.353   1.912  -0.340
  225   HG23  ILE  30          HG23      ILE  30  18.822   3.513  -0.910
  226   HD11  ILE  30          HD11      ILE  30  14.838   2.662   0.631
  227   HD12  ILE  30          HD12      ILE  30  16.458   1.966   0.665
  228   HD13  ILE  30          HD13      ILE  30  15.270   1.381  -0.500
  229    H    THR  31           H        THR  31  17.165   1.420  -4.535
  230    HA   THR  31           HA       THR  31  19.960   1.098  -5.207
  231    HB   THR  31           HB       THR  31  17.646  -0.117  -6.719
  232    HG1  THR  31           HG1      THR  31  18.561  -0.920  -4.154
  233   HG21  THR  31          HG21      THR  31  19.097  -2.047  -6.813
  234   HG22  THR  31          HG22      THR  31  20.225  -1.314  -5.674
  235   HG23  THR  31          HG23      THR  31  20.041  -0.637  -7.292
  236    H    LYS  32           H        LYS  32  17.213   2.653  -6.842
  237    HA   LYS  32           HA       LYS  32  18.752   3.026  -9.340
  238    HB2  LYS  32           HB2      LYS  32  16.014   3.899  -8.372
  239    HB3  LYS  32           HB3      LYS  32  16.623   4.214  -9.996
  240    HG2  LYS  32           HG2      LYS  32  16.776   1.402  -9.010
  241    HG3  LYS  32           HG3      LYS  32  15.179   2.026  -9.420
  242    HD2  LYS  32           HD2      LYS  32  15.728   2.349 -11.663
  243    HD3  LYS  32           HD3      LYS  32  17.455   2.466 -11.327
  244    HE2  LYS  32           HE2      LYS  32  17.043   0.315 -12.400
  245    HE3  LYS  32           HE3      LYS  32  17.403   0.004 -10.690
  246    HZ1  LYS  32           HZ1      LYS  32  15.108  -0.151 -10.184
  247    HZ2  LYS  32           HZ2      LYS  32  15.346  -1.115 -11.561
  248    HZ3  LYS  32           HZ3      LYS  32  14.645   0.424 -11.713
  249    H    TYR  33           H        TYR  33  19.006   4.486  -6.413
  250    HA   TYR  33           HA       TYR  33  19.202   7.268  -7.479
  251    HB2  TYR  33           HB2      TYR  33  18.592   5.956  -4.905
  252    HB3  TYR  33           HB3      TYR  33  19.650   7.358  -4.761
  253    HD1  TYR  33           HD1      TYR  33  16.485   6.262  -6.452
  254    HD2  TYR  33           HD2      TYR  33  18.720   9.504  -4.732
  255    HE1  TYR  33           HE1      TYR  33  14.542   7.771  -6.770
  256    HE2  TYR  33           HE2      TYR  33  16.779  11.012  -5.050
  257    HH   TYR  33           HH       TYR  33  14.480  10.653  -7.015
  258    H    VAL  34           H        VAL  34  21.082   4.776  -5.728
  259    HA   VAL  34           HA       VAL  34  23.545   6.415  -5.891
  260    HB   VAL  34           HB       VAL  34  23.128   3.577  -4.886
  261   HG11  VAL  34          HG11      VAL  34  25.047   4.475  -3.334
  262   HG12  VAL  34          HG12      VAL  34  25.279   5.662  -4.618
  263   HG13  VAL  34          HG13      VAL  34  25.436   3.941  -4.969
  264   HG21  VAL  34          HG21      VAL  34  22.968   4.742  -2.619
  265   HG22  VAL  34          HG22      VAL  34  21.563   4.933  -3.667
  266   HG23  VAL  34          HG23      VAL  34  22.728   6.247  -3.506
  267    H    VAL  35           H        VAL  35  22.747   5.997  -8.445
  268    HA   VAL  35           HA       VAL  35  24.844   4.237  -9.540
  269    HB   VAL  35           HB       VAL  35  22.768   2.864  -8.989
  270   HG11  VAL  35          HG11      VAL  35  20.750   3.222 -10.048
  271   HG12  VAL  35          HG12      VAL  35  21.500   3.976 -11.455
  272   HG13  VAL  35          HG13      VAL  35  21.323   4.887  -9.955
  273   HG21  VAL  35          HG21      VAL  35  24.521   2.299 -10.753
  274   HG22  VAL  35          HG22      VAL  35  23.398   2.951 -11.947
  275   HG23  VAL  35          HG23      VAL  35  22.941   1.549 -10.980
  276    H    ARG  36           H        ARG  36  24.256   7.118  -9.618
  277    HA   ARG  36           HA       ARG  36  23.728   7.470 -12.554
  278    HB2  ARG  36           HB2      ARG  36  22.527   8.599 -10.194
  279    HB3  ARG  36           HB3      ARG  36  23.327   9.887 -11.095
  280    HG2  ARG  36           HG2      ARG  36  21.341   9.889 -12.244
  281    HG3  ARG  36           HG3      ARG  36  22.145   8.607 -13.150
  282    HD2  ARG  36           HD2      ARG  36  20.978   6.895 -11.993
  283    HD3  ARG  36           HD3      ARG  36  20.492   7.996 -10.688
  284    HE   ARG  36           HE       ARG  36  19.488   8.304 -13.499
  285   HH11  ARG  36          HH11      ARG  36  18.092   6.810 -11.090
  286   HH12  ARG  36          HH12      ARG  36  16.897   7.995 -10.683
  287   HH21  ARG  36          HH21      ARG  36  18.396  10.528 -12.532
  288   HH22  ARG  36          HH22      ARG  36  17.070  10.109 -11.501
  Start of MODEL   19
    1    HA   SER   1           HA       SER   1 -28.924  -0.584  11.223
    2    HB2  SER   1           HB2      SER   1 -27.726  -2.144  13.062
    3    HB3  SER   1           HB3      SER   1 -27.817  -3.312  11.746
    4    HG   SER   1           HG       SER   1 -26.446  -2.144  10.605
    5    H    ASP   2           H        ASP   2 -29.674  -0.779   9.154
    6    HA   ASP   2           HA       ASP   2 -30.725  -3.447   8.257
    7    HB2  ASP   2           HB2      ASP   2 -31.495  -0.577   7.711
    8    HB3  ASP   2           HB3      ASP   2 -32.002  -1.874   6.629
    9    H    LEU   3           H        LEU   3 -27.960  -2.959   8.073
   10    HA   LEU   3           HA       LEU   3 -27.574  -3.009   5.135
   11    HB2  LEU   3           HB2      LEU   3 -27.462  -0.621   6.164
   12    HB3  LEU   3           HB3      LEU   3 -25.924  -1.150   6.842
   13    HG   LEU   3           HG       LEU   3 -25.769  -1.977   4.195
   14   HD11  LEU   3          HD11      LEU   3 -27.738  -0.708   3.559
   15   HD12  LEU   3          HD12      LEU   3 -26.316   0.124   2.930
   16   HD13  LEU   3          HD13      LEU   3 -27.124   0.729   4.376
   17   HD21  LEU   3          HD21      LEU   3 -24.016  -0.369   4.041
   18   HD22  LEU   3          HD22      LEU   3 -24.089  -0.804   5.749
   19   HD23  LEU   3          HD23      LEU   3 -24.802   0.710   5.192
   20    HA   PRO   4           HA       PRO   4 -24.698  -5.671   7.630
   21    HB2  PRO   4           HB2      PRO   4 -25.895  -8.098   7.232
   22    HB3  PRO   4           HB3      PRO   4 -26.327  -7.012   8.565
   23    HG2  PRO   4           HG2      PRO   4 -27.825  -7.667   6.138
   24    HG3  PRO   4           HG3      PRO   4 -28.392  -6.992   7.668
   25    HD2  PRO   4           HD2      PRO   4 -27.876  -5.612   5.213
   26    HD3  PRO   4           HD3      PRO   4 -28.449  -4.934   6.752
   27    H    ALA   5           H        ALA   5 -23.555  -4.886   5.550
   28    HA   ALA   5           HA       ALA   5 -23.380  -7.087   3.513
   29    HB1  ALA   5           HB1      ALA   5 -24.170  -5.073   2.507
   30    HB2  ALA   5           HB2      ALA   5 -22.454  -5.136   2.106
   31    HB3  ALA   5           HB3      ALA   5 -23.017  -4.084   3.405
   32    H    LEU   6           H        LEU   6 -21.351  -4.491   4.962
   33    HA   LEU   6           HA       LEU   6 -19.060  -4.454   5.518
   34    HB2  LEU   6           HB2      LEU   6 -20.302  -6.910   6.407
   35    HB3  LEU   6           HB3      LEU   6 -18.606  -7.203   6.024
   36    HG   LEU   6           HG       LEU   6 -18.128  -5.055   7.386
   37   HD11  LEU   6          HD11      LEU   6 -20.490  -4.305   7.481
   38   HD12  LEU   6          HD12      LEU   6 -19.818  -4.530   9.095
   39   HD13  LEU   6          HD13      LEU   6 -20.901  -5.744   8.414
   40   HD21  LEU   6          HD21      LEU   6 -18.303  -6.371   9.552
   41   HD22  LEU   6          HD22      LEU   6 -17.468  -7.205   8.242
   42   HD23  LEU   6          HD23      LEU   6 -19.134  -7.626   8.634
   43    H    SER   7           H        SER   7 -19.558  -4.628   2.725
   44    HA   SER   7           HA       SER   7 -17.907  -6.735   1.537
   45    HB2  SER   7           HB2      SER   7 -18.976  -4.175   0.318
   46    HB3  SER   7           HB3      SER   7 -18.531  -5.650  -0.534
   47    HG   SER   7           HG       SER   7 -20.281  -6.666   0.305
   48    H    THR   8           H        THR   8 -17.200  -3.761   3.044
   49    HA   THR   8           HA       THR   8 -15.224  -2.497   3.218
   50    HB   THR   8           HB       THR   8 -13.923  -4.798   1.737
   51    HG1  THR   8           HG1      THR   8 -14.740  -4.651   4.453
   52   HG21  THR   8          HG21      THR   8 -12.722  -2.617   2.541
   53   HG22  THR   8          HG22      THR   8 -11.974  -4.180   2.868
   54   HG23  THR   8          HG23      THR   8 -12.861  -3.343   4.142
   55    H    GLY   9           H        GLY   9 -16.273  -1.036   1.593
   56    HA2  GLY   9           HA2      GLY   9 -15.088  -1.229  -1.140
   57    HA3  GLY   9           HA3      GLY   9 -16.498  -0.258  -0.715
   58    H    LEU  10           H        LEU  10 -16.105   1.633   0.725
   59    HA   LEU  10           HA       LEU  10 -13.962   3.298  -0.182
   60    HB2  LEU  10           HB2      LEU  10 -16.312   3.559   1.243
   61    HB3  LEU  10           HB3      LEU  10 -15.101   3.869   2.486
   62    HG   LEU  10           HG       LEU  10 -15.787   5.953   1.331
   63   HD11  LEU  10          HD11      LEU  10 -12.979   5.360   0.430
   64   HD12  LEU  10          HD12      LEU  10 -13.364   5.403   2.151
   65   HD13  LEU  10          HD13      LEU  10 -13.626   6.833   1.152
   66   HD21  LEU  10          HD21      LEU  10 -16.108   4.602  -0.896
   67   HD22  LEU  10          HD22      LEU  10 -14.399   4.961  -1.149
   68   HD23  LEU  10          HD23      LEU  10 -15.561   6.275  -0.976
   69    H    LEU  11           H        LEU  11 -14.330   1.355   2.798
   70    HA   LEU  11           HA       LEU  11 -11.944   2.159   4.135
   71    HB2  LEU  11           HB2      LEU  11 -14.052   0.537   4.654
   72    HB3  LEU  11           HB3      LEU  11 -12.844  -0.686   4.269
   73    HG   LEU  11           HG       LEU  11 -12.902  -0.150   6.699
   74   HD11  LEU  11          HD11      LEU  11 -10.769  -0.775   5.366
   75   HD12  LEU  11          HD12      LEU  11 -10.563  -0.103   6.983
   76   HD13  LEU  11          HD13      LEU  11 -10.321   0.918   5.565
   77   HD21  LEU  11          HD21      LEU  11 -11.730   2.545   6.021
   78   HD22  LEU  11          HD22      LEU  11 -12.435   1.996   7.541
   79   HD23  LEU  11          HD23      LEU  11 -13.477   2.337   6.160
   80    H    HIS  12           H        HIS  12 -12.509  -0.427   1.731
   81    HA   HIS  12           HA       HIS  12  -9.842  -1.508   1.739
   82    HB2  HIS  12           HB2      HIS  12 -12.224  -2.215   0.695
   83    HB3  HIS  12           HB3      HIS  12 -11.505  -1.492  -0.743
   84    HD1  HIS  12           HD1      HIS  12  -8.848  -2.393  -1.097
   85    HD2  HIS  12           HD2      HIS  12 -11.520  -4.865   0.935
   86    HE1  HIS  12           HE1      HIS  12  -7.867  -4.727  -1.177
   87    H    LEU  13           H        LEU  13 -11.391   1.112  -0.116
   88    HA   LEU  13           HA       LEU  13  -9.274   1.616  -1.979
   89    HB2  LEU  13           HB2      LEU  13 -11.793   2.529  -1.539
   90    HB3  LEU  13           HB3      LEU  13 -10.876   3.880  -0.878
   91    HG   LEU  13           HG       LEU  13 -11.356   4.236  -3.268
   92   HD11  LEU  13          HD11      LEU  13  -8.423   3.560  -3.063
   93   HD12  LEU  13          HD12      LEU  13  -9.118   4.897  -2.147
   94   HD13  LEU  13          HD13      LEU  13  -9.186   4.907  -3.909
   95   HD21  LEU  13          HD21      LEU  13 -10.608   2.741  -4.970
   96   HD22  LEU  13          HD22      LEU  13 -11.383   1.720  -3.757
   97   HD23  LEU  13          HD23      LEU  13  -9.623   1.821  -3.832
   98    H    HIS  14           H        HIS  14  -9.928   2.903   1.288
   99    HA   HIS  14           HA       HIS  14  -7.672   4.702   1.406
  100    HB2  HIS  14           HB2      HIS  14  -9.457   5.048   2.932
  101    HB3  HIS  14           HB3      HIS  14  -9.521   3.345   3.377
  102    HD1  HIS  14           HD1      HIS  14  -8.880   3.286   5.801
  103    HD2  HIS  14           HD2      HIS  14  -6.345   5.754   3.594
  104    HE1  HIS  14           HE1      HIS  14  -7.047   4.030   7.381
  105    H    GLN  15           H        GLN  15  -8.177   1.375   2.648
  106    HA   GLN  15           HA       GLN  15  -5.574   0.982   3.754
  107    HB2  GLN  15           HB2      GLN  15  -7.627  -0.890   2.532
  108    HB3  GLN  15           HB3      GLN  15  -6.200  -1.460   3.396
  109    HG2  GLN  15           HG2      GLN  15  -8.388   0.311   4.532
  110    HG3  GLN  15           HG3      GLN  15  -8.117  -1.385   4.922
  111   HE21  GLN  15          HE21      GLN  15  -5.578  -1.725   5.590
  112   HE22  GLN  15          HE22      GLN  15  -5.025  -0.604   6.737
  113    H    ASN  16           H        ASN  16  -6.803   0.616   0.443
  114    HA   ASN  16           HA       ASN  16  -4.569  -0.748  -0.709
  115    HB2  ASN  16           HB2      ASN  16  -6.858  -0.350  -1.691
  116    HB3  ASN  16           HB3      ASN  16  -6.398   1.332  -1.957
  117   HD21  ASN  16          HD21      ASN  16  -4.902   1.796  -3.693
  118   HD22  ASN  16          HD22      ASN  16  -4.396   0.607  -4.793
  119    H    ILE  17           H        ILE  17  -5.293   2.772  -0.564
  120    HA   ILE  17           HA       ILE  17  -2.758   3.563  -1.733
  121    HB   ILE  17           HB       ILE  17  -4.898   4.985  -0.111
  122   HG12  ILE  17          HG12      ILE  17  -4.280   5.363  -3.037
  123   HG13  ILE  17          HG13      ILE  17  -5.260   3.992  -2.517
  124   HG21  ILE  17          HG21      ILE  17  -2.939   6.318   0.182
  125   HG22  ILE  17          HG22      ILE  17  -3.814   7.068  -1.153
  126   HG23  ILE  17          HG23      ILE  17  -2.414   6.046  -1.479
  127   HD11  ILE  17          HD11      ILE  17  -5.900   6.779  -1.570
  128   HD12  ILE  17          HD12      ILE  17  -6.960   5.373  -1.658
  129   HD13  ILE  17          HD13      ILE  17  -6.477   6.207  -3.135
  130    H    VAL  18           H        VAL  18  -3.706   2.649   1.501
  131    HA   VAL  18           HA       VAL  18  -1.333   3.965   2.714
  132    HB   VAL  18           HB       VAL  18  -3.793   2.528   3.733
  133   HG11  VAL  18          HG11      VAL  18  -1.398   3.547   5.285
  134   HG12  VAL  18          HG12      VAL  18  -2.071   1.916   5.296
  135   HG13  VAL  18          HG13      VAL  18  -2.971   3.245   6.025
  136   HG21  VAL  18          HG21      VAL  18  -4.227   4.771   4.739
  137   HG22  VAL  18          HG22      VAL  18  -4.122   4.832   2.981
  138   HG23  VAL  18          HG23      VAL  18  -2.763   5.374   3.965
  139    H    ASP  19           H        ASP  19  -2.119   0.948   1.328
  140    HA   ASP  19           HA       ASP  19   0.105  -0.369   2.858
  141    HB2  ASP  19           HB2      ASP  19  -2.559  -1.055   2.801
  142    HB3  ASP  19           HB3      ASP  19  -1.897  -2.086   1.534
  143    H    VAL  20           H        VAL  20   0.145   1.194   0.248
  144    HA   VAL  20           HA       VAL  20   1.236  -0.994  -1.496
  145    HB   VAL  20           HB       VAL  20  -0.371   1.497  -2.123
  146   HG11  VAL  20          HG11      VAL  20   0.002   0.870  -4.541
  147   HG12  VAL  20          HG12      VAL  20   1.259  -0.242  -4.001
  148   HG13  VAL  20          HG13      VAL  20   1.441   1.492  -3.733
  149   HG21  VAL  20          HG21      VAL  20  -1.444  -0.760  -1.558
  150   HG22  VAL  20          HG22      VAL  20  -0.752  -1.350  -3.069
  151   HG23  VAL  20          HG23      VAL  20  -1.923  -0.032  -3.092
  152    H    GLN  21           H        GLN  21   1.339   2.537  -1.050
  153    HA   GLN  21           HA       GLN  21   3.984   2.876  -2.149
  154    HB2  GLN  21           HB2      GLN  21   2.017   4.466  -0.512
  155    HB3  GLN  21           HB3      GLN  21   3.649   5.097  -0.750
  156    HG2  GLN  21           HG2      GLN  21   2.598   6.003  -2.609
  157    HG3  GLN  21           HG3      GLN  21   3.163   4.478  -3.288
  158   HE21  GLN  21          HE21      GLN  21   1.456   3.978  -4.741
  159   HE22  GLN  21          HE22      GLN  21  -0.166   3.813  -4.267
  160    H    TYR  22           H        TYR  22   2.876   1.738   0.927
  161    HA   TYR  22           HA       TYR  22   5.492   2.343   2.242
  162    HB2  TYR  22           HB2      TYR  22   2.952   1.226   3.468
  163    HB3  TYR  22           HB3      TYR  22   4.276   2.046   4.293
  164    HD1  TYR  22           HD1      TYR  22   4.566   4.491   4.099
  165    HD2  TYR  22           HD2      TYR  22   1.281   2.466   2.218
  166    HE1  TYR  22           HE1      TYR  22   3.421   6.663   3.748
  167    HE2  TYR  22           HE2      TYR  22   0.140   4.634   1.867
  168    HH   TYR  22           HH       TYR  22   0.588   7.213   3.396
  169    H    MET  23           H        MET  23   3.216  -0.340   1.572
  170    HA   MET  23           HA       MET  23   4.935  -2.393   2.704
  171    HB2  MET  23           HB2      MET  23   2.297  -2.121   1.828
  172    HB3  MET  23           HB3      MET  23   3.010  -3.243   0.670
  173    HG2  MET  23           HG2      MET  23   3.696  -3.730   3.514
  174    HG3  MET  23           HG3      MET  23   2.014  -4.016   3.075
  175    HE1  MET  23           HE1      MET  23   5.146  -6.076   3.566
  176    HE2  MET  23           HE2      MET  23   5.577  -4.613   2.686
  177    HE3  MET  23           HE3      MET  23   5.791  -6.185   1.922
  178    H    TYR  24           H        TYR  24   4.505  -0.995  -0.532
  179    HA   TYR  24           HA       TYR  24   6.409  -2.970  -1.697
  180    HB2  TYR  24           HB2      TYR  24   4.117  -1.527  -2.562
  181    HB3  TYR  24           HB3      TYR  24   5.477  -0.920  -3.504
  182    HD1  TYR  24           HD1      TYR  24   6.835  -2.451  -4.897
  183    HD2  TYR  24           HD2      TYR  24   3.345  -3.809  -2.792
  184    HE1  TYR  24           HE1      TYR  24   6.798  -4.505  -6.284
  185    HE2  TYR  24           HE2      TYR  24   3.309  -5.864  -4.180
  186    HH   TYR  24           HH       TYR  24   5.674  -7.075  -5.732
  187    H    GLY  25           H        GLY  25   7.503  -1.105   0.221
  188    HA2  GLY  25           HA2      GLY  25   8.777   1.085  -1.250
  189    HA3  GLY  25           HA3      GLY  25   9.075   0.656   0.433
  190    H    LEU  26           H        LEU  26   9.660  -2.168  -0.166
  191    HA   LEU  26           HA       LEU  26  11.519  -3.519  -0.684
  192    HB2  LEU  26           HB2      LEU  26  11.047  -1.674  -2.918
  193    HB3  LEU  26           HB3      LEU  26  12.715  -2.238  -2.845
  194    HG   LEU  26           HG       LEU  26  10.695  -4.342  -2.389
  195   HD11  LEU  26          HD11      LEU  26  11.003  -3.070  -5.127
  196   HD12  LEU  26          HD12      LEU  26   9.561  -2.959  -4.115
  197   HD13  LEU  26          HD13      LEU  26  10.072  -4.521  -4.753
  198   HD21  LEU  26          HD21      LEU  26  12.222  -5.623  -3.741
  199   HD22  LEU  26          HD22      LEU  26  13.204  -4.619  -2.675
  200   HD23  LEU  26          HD23      LEU  26  12.988  -4.162  -4.364
  201    H    SER  27           H        SER  27  11.874  -1.449   1.305
  202    HA   SER  27           HA       SER  27  14.772  -1.389   1.458
  203    HB2  SER  27           HB2      SER  27  13.288   0.838   0.235
  204    HB3  SER  27           HB3      SER  27  14.352   1.349   1.543
  205    HG   SER  27           HG       SER  27  15.026  -0.184  -0.754
  206    HA   PRO  28           HA       PRO  28  13.031   0.915   5.272
  207    HB2  PRO  28           HB2      PRO  28  10.394   1.657   5.289
  208    HB3  PRO  28           HB3      PRO  28  11.693   2.705   4.683
  209    HG2  PRO  28           HG2      PRO  28   9.788   0.985   3.167
  210    HG3  PRO  28           HG3      PRO  28  10.374   2.616   2.799
  211    HD2  PRO  28           HD2      PRO  28  11.341   0.402   1.576
  212    HD3  PRO  28           HD3      PRO  28  12.328   1.851   1.869
  213    H    ALA  29           H        ALA  29  10.892  -1.291   3.573
  214    HA   ALA  29           HA       ALA  29   9.472  -2.422   5.781
  215    HB1  ALA  29           HB1      ALA  29   8.924  -2.735   3.390
  216    HB2  ALA  29           HB2      ALA  29   9.131  -4.294   4.187
  217    HB3  ALA  29           HB3      ALA  29  10.416  -3.649   3.166
  218    H    ILE  30           H        ILE  30  12.671  -3.173   4.392
  219    HA   ILE  30           HA       ILE  30  13.116  -5.471   6.149
  220    HB   ILE  30           HB       ILE  30  14.852  -3.831   4.276
  221   HG12  ILE  30          HG12      ILE  30  13.988  -6.703   3.948
  222   HG13  ILE  30          HG13      ILE  30  12.916  -5.387   3.472
  223   HG21  ILE  30          HG21      ILE  30  16.426  -5.827   4.478
  224   HG22  ILE  30          HG22      ILE  30  15.499  -6.304   5.901
  225   HG23  ILE  30          HG23      ILE  30  16.364  -4.766   5.886
  226   HD11  ILE  30          HD11      ILE  30  15.246  -6.427   2.097
  227   HD12  ILE  30          HD12      ILE  30  15.432  -4.703   2.418
  228   HD13  ILE  30          HD13      ILE  30  14.032  -5.286   1.519
  229    H    THR  31           H        THR  31  14.133  -2.065   6.053
  230    HA   THR  31           HA       THR  31  15.943  -2.154   8.286
  231    HB   THR  31           HB       THR  31  14.230   0.083   7.146
  232    HG1  THR  31           HG1      THR  31  16.951  -0.562   6.676
  233   HG21  THR  31          HG21      THR  31  16.283   1.419   8.101
  234   HG22  THR  31          HG22      THR  31  16.452   0.023   9.164
  235   HG23  THR  31          HG23      THR  31  14.961   0.964   9.177
  236    H    LYS  32           H        LYS  32  12.459  -1.331   8.067
  237    HA   LYS  32           HA       LYS  32  12.097  -0.777  10.869
  238    HB2  LYS  32           HB2      LYS  32  10.382  -1.396   8.488
  239    HB3  LYS  32           HB3      LYS  32   9.638  -1.385  10.087
  240    HG2  LYS  32           HG2      LYS  32  11.358   0.900   9.107
  241    HG3  LYS  32           HG3      LYS  32   9.620   0.840   8.809
  242    HD2  LYS  32           HD2      LYS  32  10.545   0.355  11.607
  243    HD3  LYS  32           HD3      LYS  32  10.638   2.007  11.000
  244    HE2  LYS  32           HE2      LYS  32   8.092   0.625  10.384
  245    HE3  LYS  32           HE3      LYS  32   8.377   0.937  12.107
  246    HZ1  LYS  32           HZ1      LYS  32   7.358   2.857  11.009
  247    HZ2  LYS  32           HZ2      LYS  32   8.666   2.944   9.928
  248    HZ3  LYS  32           HZ3      LYS  32   8.909   3.229  11.586
  249    H    TYR  33           H        TYR  33  12.329  -3.753   9.086
  250    HA   TYR  33           HA       TYR  33  10.887  -5.451  10.946
  251    HB2  TYR  33           HB2      TYR  33  12.107  -5.615   8.412
  252    HB3  TYR  33           HB3      TYR  33  12.995  -6.754   9.423
  253    HD1  TYR  33           HD1      TYR  33  11.849  -8.646  10.506
  254    HD2  TYR  33           HD2      TYR  33   9.749  -5.939   7.913
  255    HE1  TYR  33           HE1      TYR  33   9.968 -10.253  10.350
  256    HE2  TYR  33           HE2      TYR  33   7.868  -7.547   7.759
  257    HH   TYR  33           HH       TYR  33   7.097  -9.656   9.618
  258    H    VAL  34           H        VAL  34  14.155  -4.146  10.844
  259    HA   VAL  34           HA       VAL  34  14.956  -5.951  13.099
  260    HB   VAL  34           HB       VAL  34  16.488  -4.372  11.010
  261   HG11  VAL  34          HG11      VAL  34  18.518  -5.471  12.099
  262   HG12  VAL  34          HG12      VAL  34  17.478  -5.817  13.481
  263   HG13  VAL  34          HG13      VAL  34  17.791  -4.147  13.009
  264   HG21  VAL  34          HG21      VAL  34  15.587  -6.518  10.254
  265   HG22  VAL  34          HG22      VAL  34  16.264  -7.328  11.667
  266   HG23  VAL  34          HG23      VAL  34  17.335  -6.651  10.439
  267    H    VAL  35           H        VAL  35  15.801  -2.615  12.042
  268    HA   VAL  35           HA       VAL  35  16.095  -0.637  13.293
  269    HB   VAL  35           HB       VAL  35  13.922  -1.943  14.970
  270   HG11  VAL  35          HG11      VAL  35  14.766   0.936  14.534
  271   HG12  VAL  35          HG12      VAL  35  14.793   0.034  16.051
  272   HG13  VAL  35          HG13      VAL  35  13.252   0.469  15.310
  273   HG21  VAL  35          HG21      VAL  35  13.211  -1.979  12.663
  274   HG22  VAL  35          HG22      VAL  35  13.795  -0.335  12.400
  275   HG23  VAL  35          HG23      VAL  35  12.396  -0.619  13.435
  276    H    ARG  36           H        ARG  36  18.237  -1.739  13.902
  277    HA   ARG  36           HA       ARG  36  19.898  -2.152  15.521
  278    HB2  ARG  36           HB2      ARG  36  18.359  -0.100  16.384
  279    HB3  ARG  36           HB3      ARG  36  18.076  -1.240  17.699
  280    HG2  ARG  36           HG2      ARG  36  20.756  -1.494  17.470
  281    HG3  ARG  36           HG3      ARG  36  20.576   0.173  16.923
  282    HD2  ARG  36           HD2      ARG  36  20.632   0.658  19.165
  283    HD3  ARG  36           HD3      ARG  36  18.932   0.145  19.133
  284    HE   ARG  36           HE       ARG  36  21.138  -1.821  19.639
  285   HH11  ARG  36          HH11      ARG  36  20.243  -0.621  22.145
  286   HH12  ARG  36          HH12      ARG  36  18.906  -1.615  22.620
  287   HH21  ARG  36          HH21      ARG  36  18.482  -3.004  19.457
  288   HH22  ARG  36          HH22      ARG  36  17.904  -2.970  21.092
  Start of MODEL   20
    1    HA   SER   1           HA       SER   1 -19.347  -5.530  -4.647
    2    HB2  SER   1           HB2      SER   1 -16.502  -6.592  -4.606
    3    HB3  SER   1           HB3      SER   1 -17.724  -6.848  -3.363
    4    HG   SER   1           HG       SER   1 -17.582  -8.612  -4.825
    5    H    ASP   2           H        ASP   2 -19.368  -3.834  -3.222
    6    HA   ASP   2           HA       ASP   2 -18.749  -1.820  -2.164
    7    HB2  ASP   2           HB2      ASP   2 -16.082  -3.263  -2.323
    8    HB3  ASP   2           HB3      ASP   2 -16.436  -1.911  -1.254
    9    H    LEU   3           H        LEU   3 -18.770  -1.767  -5.090
   10    HA   LEU   3           HA       LEU   3 -16.415  -0.313  -6.025
   11    HB2  LEU   3           HB2      LEU   3 -19.061  -1.217  -7.074
   12    HB3  LEU   3           HB3      LEU   3 -18.263   0.101  -7.934
   13    HG   LEU   3           HG       LEU   3 -16.737  -2.390  -7.195
   14   HD11  LEU   3          HD11      LEU   3 -18.876  -2.939  -8.486
   15   HD12  LEU   3          HD12      LEU   3 -17.366  -3.449  -9.242
   16   HD13  LEU   3          HD13      LEU   3 -18.195  -2.004  -9.818
   17   HD21  LEU   3          HD21      LEU   3 -15.420  -1.704  -9.187
   18   HD22  LEU   3          HD22      LEU   3 -15.481  -0.424  -7.975
   19   HD23  LEU   3          HD23      LEU   3 -16.499  -0.329  -9.412
   20    HA   PRO   4           HA       PRO   4 -19.231   3.480  -5.677
   21    HB2  PRO   4           HB2      PRO   4 -21.778   3.241  -4.723
   22    HB3  PRO   4           HB3      PRO   4 -21.358   2.990  -6.427
   23    HG2  PRO   4           HG2      PRO   4 -22.040   1.020  -4.352
   24    HG3  PRO   4           HG3      PRO   4 -22.217   0.921  -6.107
   25    HD2  PRO   4           HD2      PRO   4 -20.199  -0.267  -4.529
   26    HD3  PRO   4           HD3      PRO   4 -20.266  -0.184  -6.302
   27    H    ALA   5           H        ALA   5 -18.171   1.626  -3.312
   28    HA   ALA   5           HA       ALA   5 -17.730   1.895  -1.015
   29    HB1  ALA   5           HB1      ALA   5 -17.287   4.214  -2.246
   30    HB2  ALA   5           HB2      ALA   5 -17.192   4.090  -0.489
   31    HB3  ALA   5           HB3      ALA   5 -18.646   4.736  -1.249
   32    H    LEU   6           H        LEU   6 -20.466   1.083  -1.786
   33    HA   LEU   6           HA       LEU   6 -22.405   2.504  -0.154
   34    HB2  LEU   6           HB2      LEU   6 -22.234  -0.026  -1.746
   35    HB3  LEU   6           HB3      LEU   6 -23.559   0.129  -0.594
   36    HG   LEU   6           HG       LEU   6 -22.913   2.266  -2.640
   37   HD11  LEU   6          HD11      LEU   6 -23.577  -0.096  -3.538
   38   HD12  LEU   6          HD12      LEU   6 -24.452   1.313  -4.140
   39   HD13  LEU   6          HD13      LEU   6 -25.174   0.290  -2.897
   40   HD21  LEU   6          HD21      LEU   6 -24.267   2.836  -0.578
   41   HD22  LEU   6          HD22      LEU   6 -25.468   1.663  -1.118
   42   HD23  LEU   6          HD23      LEU   6 -25.124   3.087  -2.099
   43    H    SER   7           H        SER   7 -20.265  -0.277   0.392
   44    HA   SER   7           HA       SER   7 -21.257  -0.395   3.220
   45    HB2  SER   7           HB2      SER   7 -20.400  -2.544   1.275
   46    HB3  SER   7           HB3      SER   7 -20.533  -2.846   3.004
   47    HG   SER   7           HG       SER   7 -22.677  -2.546   2.903
   48    H    THR   8           H        THR   8 -18.466  -1.929   1.628
   49    HA   THR   8           HA       THR   8 -16.664  -0.380   3.461
   50    HB   THR   8           HB       THR   8 -15.420  -2.821   3.029
   51    HG1  THR   8           HG1      THR   8 -17.102  -3.883   2.175
   52   HG21  THR   8          HG21      THR   8 -15.432  -1.885   5.189
   53   HG22  THR   8          HG22      THR   8 -16.407  -3.344   5.361
   54   HG23  THR   8          HG23      THR   8 -17.191  -1.770   5.225
   55    H    GLY   9           H        GLY   9 -17.308   0.231   0.654
   56    HA2  GLY   9           HA2      GLY   9 -15.161  -0.712  -1.049
   57    HA3  GLY   9           HA3      GLY   9 -16.233   0.644  -1.401
   58    H    LEU  10           H        LEU  10 -15.790   2.522   0.371
   59    HA   LEU  10           HA       LEU  10 -13.223   3.626  -0.233
   60    HB2  LEU  10           HB2      LEU  10 -15.645   4.370   1.026
   61    HB3  LEU  10           HB3      LEU  10 -14.385   4.649   2.226
   62    HG   LEU  10           HG       LEU  10 -14.711   6.653   0.841
   63   HD11  LEU  10          HD11      LEU  10 -12.439   7.089   0.442
   64   HD12  LEU  10          HD12      LEU  10 -12.117   5.438  -0.087
   65   HD13  LEU  10          HD13      LEU  10 -12.377   5.780   1.622
   66   HD21  LEU  10          HD21      LEU  10 -13.728   5.068  -1.535
   67   HD22  LEU  10          HD22      LEU  10 -14.500   6.654  -1.516
   68   HD23  LEU  10          HD23      LEU  10 -15.451   5.206  -1.181
   69    H    LEU  11           H        LEU  11 -14.398   1.843   2.638
   70    HA   LEU  11           HA       LEU  11 -12.120   2.188   4.315
   71    HB2  LEU  11           HB2      LEU  11 -14.466   1.139   4.723
   72    HB3  LEU  11           HB3      LEU  11 -13.749  -0.353   4.113
   73    HG   LEU  11           HG       LEU  11 -12.156   1.090   6.159
   74   HD11  LEU  11          HD11      LEU  11 -13.511   0.529   8.015
   75   HD12  LEU  11          HD12      LEU  11 -14.552  -0.517   7.049
   76   HD13  LEU  11          HD13      LEU  11 -14.640   1.235   6.859
   77   HD21  LEU  11          HD21      LEU  11 -11.623  -1.143   6.847
   78   HD22  LEU  11          HD22      LEU  11 -11.658  -1.174   5.085
   79   HD23  LEU  11          HD23      LEU  11 -13.023  -1.809   6.005
   80    H    HIS  12           H        HIS  12 -12.855  -0.411   1.950
   81    HA   HIS  12           HA       HIS  12 -10.328  -1.789   2.265
   82    HB2  HIS  12           HB2      HIS  12 -12.538  -1.727   0.199
   83    HB3  HIS  12           HB3      HIS  12 -11.116  -2.746  -0.012
   84    HD1  HIS  12           HD1      HIS  12 -12.830  -4.807   0.215
   85    HD2  HIS  12           HD2      HIS  12 -12.318  -2.516   3.663
   86    HE1  HIS  12           HE1      HIS  12 -13.751  -6.180   2.133
   87    H    LEU  13           H        LEU  13 -11.560   0.581  -0.116
   88    HA   LEU  13           HA       LEU  13  -9.311   0.705  -1.843
   89    HB2  LEU  13           HB2      LEU  13 -11.688   2.282  -1.158
   90    HB3  LEU  13           HB3      LEU  13 -10.349   3.288  -1.702
   91    HG   LEU  13           HG       LEU  13 -11.140   0.802  -3.217
   92   HD11  LEU  13          HD11      LEU  13 -12.314   2.613  -4.726
   93   HD12  LEU  13          HD12      LEU  13 -12.421   3.519  -3.217
   94   HD13  LEU  13          HD13      LEU  13 -13.177   1.930  -3.347
   95   HD21  LEU  13          HD21      LEU  13  -9.013   1.704  -3.863
   96   HD22  LEU  13          HD22      LEU  13  -9.632   3.356  -3.839
   97   HD23  LEU  13          HD23      LEU  13 -10.160   2.234  -5.094
   98    H    HIS  14           H        HIS  14  -9.976   2.486   1.188
   99    HA   HIS  14           HA       HIS  14  -7.651   4.167   1.149
  100    HB2  HIS  14           HB2      HIS  14  -9.420   4.711   2.638
  101    HB3  HIS  14           HB3      HIS  14  -9.509   3.067   3.267
  102    HD1  HIS  14           HD1      HIS  14  -8.735   3.122   5.641
  103    HD2  HIS  14           HD2      HIS  14  -6.364   5.543   3.211
  104    HE1  HIS  14           HE1      HIS  14  -6.872   4.015   7.108
  105    H    GLN  15           H        GLN  15  -8.234   0.978   2.687
  106    HA   GLN  15           HA       GLN  15  -5.737   0.594   3.938
  107    HB2  GLN  15           HB2      GLN  15  -7.722  -0.841   4.195
  108    HB3  GLN  15           HB3      GLN  15  -7.557  -1.389   2.528
  109    HG2  GLN  15           HG2      GLN  15  -6.590  -3.071   3.992
  110    HG3  GLN  15           HG3      GLN  15  -5.285  -2.286   3.104
  111   HE21  GLN  15          HE21      GLN  15  -3.853  -0.833   4.302
  112   HE22  GLN  15          HE22      GLN  15  -3.841  -0.809   6.000
  113    H    ASN  16           H        ASN  16  -6.652  -0.101   0.540
  114    HA   ASN  16           HA       ASN  16  -4.133  -1.286  -0.215
  115    HB2  ASN  16           HB2      ASN  16  -6.118  -1.641  -1.532
  116    HB3  ASN  16           HB3      ASN  16  -6.368   0.093  -1.728
  117   HD21  ASN  16          HD21      ASN  16  -3.481  -2.051  -2.217
  118   HD22  ASN  16          HD22      ASN  16  -3.166  -1.495  -3.790
  119    H    ILE  17           H        ILE  17  -5.408   2.051  -0.614
  120    HA   ILE  17           HA       ILE  17  -3.143   3.187  -1.910
  121    HB   ILE  17           HB       ILE  17  -5.245   4.285  -0.015
  122   HG12  ILE  17          HG12      ILE  17  -4.916   4.681  -3.002
  123   HG13  ILE  17          HG13      ILE  17  -5.853   3.353  -2.321
  124   HG21  ILE  17          HG21      ILE  17  -4.568   6.534  -0.965
  125   HG22  ILE  17          HG22      ILE  17  -3.129   5.752  -1.619
  126   HG23  ILE  17          HG23      ILE  17  -3.382   5.816   0.125
  127   HD11  ILE  17          HD11      ILE  17  -6.349   6.315  -1.902
  128   HD12  ILE  17          HD12      ILE  17  -7.221   5.032  -1.060
  129   HD13  ILE  17          HD13      ILE  17  -7.365   5.193  -2.810
  130    H    VAL  18           H        VAL  18  -3.828   2.705   1.550
  131    HA   VAL  18           HA       VAL  18  -1.460   4.082   2.512
  132    HB   VAL  18           HB       VAL  18  -3.226   1.959   3.786
  133   HG11  VAL  18          HG11      VAL  18  -2.504   3.047   5.909
  134   HG12  VAL  18          HG12      VAL  18  -1.383   4.046   4.984
  135   HG13  VAL  18          HG13      VAL  18  -1.164   2.297   5.043
  136   HG21  VAL  18          HG21      VAL  18  -3.644   4.724   4.609
  137   HG22  VAL  18          HG22      VAL  18  -4.820   3.533   4.054
  138   HG23  VAL  18          HG23      VAL  18  -3.935   4.509   2.883
  139    H    ASP  19           H        ASP  19  -2.251   0.736   1.680
  140    HA   ASP  19           HA       ASP  19   0.173  -0.476   2.679
  141    HB2  ASP  19           HB2      ASP  19  -2.235  -1.177   1.197
  142    HB3  ASP  19           HB3      ASP  19  -0.822  -2.001   0.536
  143    H    VAL  20           H        VAL  20  -0.450   1.473  -0.116
  144    HA   VAL  20           HA       VAL  20   1.983   0.440  -1.497
  145    HB   VAL  20           HB       VAL  20  -0.183   2.375  -2.389
  146   HG11  VAL  20          HG11      VAL  20   1.891   0.877  -4.016
  147   HG12  VAL  20          HG12      VAL  20   2.047   2.567  -3.536
  148   HG13  VAL  20          HG13      VAL  20   0.740   2.072  -4.612
  149   HG21  VAL  20          HG21      VAL  20  -1.442   0.590  -2.982
  150   HG22  VAL  20          HG22      VAL  20  -0.360  -0.396  -2.000
  151   HG23  VAL  20          HG23      VAL  20  -0.063  -0.215  -3.728
  152    H    GLN  21           H        GLN  21   0.524   3.406  -0.200
  153    HA   GLN  21           HA       GLN  21   2.644   5.218  -0.857
  154    HB2  GLN  21           HB2      GLN  21   0.135   5.367   0.187
  155    HB3  GLN  21           HB3      GLN  21   1.093   5.621   1.645
  156    HG2  GLN  21           HG2      GLN  21   1.656   7.708   1.005
  157    HG3  GLN  21           HG3      GLN  21   2.165   7.145  -0.587
  158   HE21  GLN  21          HE21      GLN  21  -0.890   7.788   1.243
  159   HE22  GLN  21          HE22      GLN  21  -1.742   8.363  -0.108
  160    H    TYR  22           H        TYR  22   2.084   3.174   2.031
  161    HA   TYR  22           HA       TYR  22   4.235   4.216   3.613
  162    HB2  TYR  22           HB2      TYR  22   3.476   2.646   5.095
  163    HB3  TYR  22           HB3      TYR  22   2.158   2.473   3.944
  164    HD1  TYR  22           HD1      TYR  22   5.389   1.033   5.072
  165    HD2  TYR  22           HD2      TYR  22   1.918   0.502   2.605
  166    HE1  TYR  22           HE1      TYR  22   6.007  -1.341   4.712
  167    HE2  TYR  22           HE2      TYR  22   2.532  -1.872   2.247
  168    HH   TYR  22           HH       TYR  22   3.971  -3.629   3.657
  169    H    MET  23           H        MET  23   4.189   1.840   0.998
  170    HA   MET  23           HA       MET  23   7.072   1.208   1.481
  171    HB2  MET  23           HB2      MET  23   4.734  -0.224   0.641
  172    HB3  MET  23           HB3      MET  23   5.906  -0.266  -0.676
  173    HG2  MET  23           HG2      MET  23   6.873  -0.783   2.113
  174    HG3  MET  23           HG3      MET  23   6.002  -2.064   1.270
  175    HE1  MET  23           HE1      MET  23   8.896  -2.646   2.185
  176    HE2  MET  23           HE2      MET  23   9.461  -3.464   0.731
  177    HE3  MET  23           HE3      MET  23   7.801  -3.693   1.274
  178    H    TYR  24           H        TYR  24   5.736   3.709   0.056
  179    HA   TYR  24           HA       TYR  24   7.317   3.487  -2.490
  180    HB2  TYR  24           HB2      TYR  24   4.612   4.419  -1.793
  181    HB3  TYR  24           HB3      TYR  24   5.503   5.550  -2.809
  182    HD1  TYR  24           HD1      TYR  24   5.197   1.803  -2.581
  183    HD2  TYR  24           HD2      TYR  24   5.080   5.298  -5.074
  184    HE1  TYR  24           HE1      TYR  24   4.765   0.376  -4.560
  185    HE2  TYR  24           HE2      TYR  24   4.647   3.871  -7.053
  186    HH   TYR  24           HH       TYR  24   3.489   1.106  -7.109
  187    H    GLY  25           H        GLY  25   8.104   4.481   0.328
  188    HA2  GLY  25           HA2      GLY  25   9.427   6.205   1.201
  189    HA3  GLY  25           HA3      GLY  25   9.753   6.665  -0.469
  190    H    LEU  26           H        LEU  26   6.581   6.614   1.169
  191    HA   LEU  26           HA       LEU  26   6.447   9.586   0.751
  192    HB2  LEU  26           HB2      LEU  26   4.480   7.341   0.314
  193    HB3  LEU  26           HB3      LEU  26   3.925   9.004   0.501
  194    HG   LEU  26           HG       LEU  26   6.107   8.329  -1.467
  195   HD11  LEU  26          HD11      LEU  26   3.112   8.219  -1.943
  196   HD12  LEU  26          HD12      LEU  26   4.222   6.849  -2.007
  197   HD13  LEU  26          HD13      LEU  26   4.343   8.139  -3.204
  198   HD21  LEU  26          HD21      LEU  26   5.425  10.714  -0.713
  199   HD22  LEU  26          HD22      LEU  26   3.953  10.439  -1.645
  200   HD23  LEU  26          HD23      LEU  26   5.524  10.405  -2.446
  201    H    SER  27           H        SER  27   6.707   7.361   3.181
  202    HA   SER  27           HA       SER  27   4.582   8.146   4.975
  203    HB2  SER  27           HB2      SER  27   7.174   6.652   5.116
  204    HB3  SER  27           HB3      SER  27   6.422   7.154   6.628
  205    HG   SER  27           HG       SER  27   5.380   5.326   6.276
  206    HA   PRO  28           HA       PRO  28   7.789  11.041   7.014
  207    HB2  PRO  28           HB2      PRO  28  10.228  11.383   5.820
  208    HB3  PRO  28           HB3      PRO  28   9.913  10.127   7.034
  209    HG2  PRO  28           HG2      PRO  28  10.044   9.902   4.069
  210    HG3  PRO  28           HG3      PRO  28  10.628   8.787   5.313
  211    HD2  PRO  28           HD2      PRO  28   8.315   8.408   3.925
  212    HD3  PRO  28           HD3      PRO  28   8.582   7.795   5.572
  213    H    ALA  29           H        ALA  29   7.668  10.871   3.514
  214    HA   ALA  29           HA       ALA  29   8.195  13.615   2.872
  215    HB1  ALA  29           HB1      ALA  29   6.309  11.738   1.427
  216    HB2  ALA  29           HB2      ALA  29   8.060  11.525   1.382
  217    HB3  ALA  29           HB3      ALA  29   7.333  12.994   0.730
  218    H    ILE  30           H        ILE  30   5.206  11.922   3.829
  219    HA   ILE  30           HA       ILE  30   3.497  14.251   3.351
  220    HB   ILE  30           HB       ILE  30   3.149  11.567   4.718
  221   HG12  ILE  30          HG12      ILE  30   3.435  11.507   2.267
  222   HG13  ILE  30          HG13      ILE  30   1.787  11.067   2.711
  223   HG21  ILE  30          HG21      ILE  30   0.622  12.274   4.331
  224   HG22  ILE  30          HG22      ILE  30   1.286  13.902   4.467
  225   HG23  ILE  30          HG23      ILE  30   1.475  12.759   5.796
  226   HD11  ILE  30          HD11      ILE  30   1.238  13.576   2.368
  227   HD12  ILE  30          HD12      ILE  30   1.503  12.593   0.929
  228   HD13  ILE  30          HD13      ILE  30   2.782  13.656   1.519
  229    H    THR  31           H        THR  31   5.026  12.721   6.170
  230    HA   THR  31           HA       THR  31   3.796  14.308   8.211
  231    HB   THR  31           HB       THR  31   6.607  13.157   8.160
  232    HG1  THR  31           HG1      THR  31   4.093  11.934   8.637
  233   HG21  THR  31          HG21      THR  31   5.348  14.628  10.109
  234   HG22  THR  31          HG22      THR  31   6.635  13.460  10.407
  235   HG23  THR  31          HG23      THR  31   4.950  12.977  10.586
  236    H    LYS  32           H        LYS  32   6.712  14.856   6.219
  237    HA   LYS  32           HA       LYS  32   7.546  17.273   7.573
  238    HB2  LYS  32           HB2      LYS  32   8.399  15.554   5.462
  239    HB3  LYS  32           HB3      LYS  32   8.341  17.192   4.810
  240    HG2  LYS  32           HG2      LYS  32   9.627  16.633   7.481
  241    HG3  LYS  32           HG3      LYS  32  10.529  16.431   5.979
  242    HD2  LYS  32           HD2      LYS  32  10.373  18.712   5.427
  243    HD3  LYS  32           HD3      LYS  32   9.013  18.978   6.519
  244    HE2  LYS  32           HE2      LYS  32  10.668  18.354   8.422
  245    HE3  LYS  32           HE3      LYS  32  11.935  18.642   7.214
  246    HZ1  LYS  32           HZ1      LYS  32  10.920  20.807   6.745
  247    HZ2  LYS  32           HZ2      LYS  32  11.415  20.693   8.367
  248    HZ3  LYS  32           HZ3      LYS  32   9.770  20.540   7.965
  249    H    TYR  33           H        TYR  33   5.438  16.604   4.815
  250    HA   TYR  33           HA       TYR  33   5.077  19.401   4.065
  251    HB2  TYR  33           HB2      TYR  33   4.876  17.453   2.527
  252    HB3  TYR  33           HB3      TYR  33   3.472  16.897   3.438
  253    HD1  TYR  33           HD1      TYR  33   4.784  19.672   1.337
  254    HD2  TYR  33           HD2      TYR  33   1.317  17.871   3.122
  255    HE1  TYR  33           HE1      TYR  33   3.321  21.170   0.008
  256    HE2  TYR  33           HE2      TYR  33  -0.145  19.369   1.793
  257    HH   TYR  33           HH       TYR  33   0.486  20.764  -0.756
  258    H    VAL  34           H        VAL  34   3.192  17.002   5.932
  259    HA   VAL  34           HA       VAL  34   1.185  19.097   6.630
  260    HB   VAL  34           HB       VAL  34   1.295  16.105   7.163
  261   HG11  VAL  34          HG11      VAL  34  -1.191  17.799   7.125
  262   HG12  VAL  34          HG12      VAL  34  -0.206  17.722   8.585
  263   HG13  VAL  34          HG13      VAL  34  -0.916  16.251   7.922
  264   HG21  VAL  34          HG21      VAL  34   1.198  16.450   4.782
  265   HG22  VAL  34          HG22      VAL  34   0.007  17.738   4.957
  266   HG23  VAL  34          HG23      VAL  34  -0.442  16.068   5.305
  267    H    VAL  35           H        VAL  35   2.847  20.210   8.016
  268    HA   VAL  35           HA       VAL  35   2.937  18.975  10.740
  269    HB   VAL  35           HB       VAL  35   5.039  18.685   9.292
  270   HG11  VAL  35          HG11      VAL  35   6.488  20.584   9.003
  271   HG12  VAL  35          HG12      VAL  35   5.421  21.615   9.956
  272   HG13  VAL  35          HG13      VAL  35   4.907  21.038   8.371
  273   HG21  VAL  35          HG21      VAL  35   5.447  20.248  11.854
  274   HG22  VAL  35          HG22      VAL  35   6.500  19.008  11.173
  275   HG23  VAL  35          HG23      VAL  35   4.923  18.564  11.826
  276    H    ARG  36           H        ARG  36   1.533  21.364   9.218
  277    HA   ARG  36           HA       ARG  36   2.333  23.534  11.127
  278    HB2  ARG  36           HB2      ARG  36   1.208  23.441   8.330
  279    HB3  ARG  36           HB3      ARG  36   1.030  24.896   9.309
  280    HG2  ARG  36           HG2      ARG  36   3.355  25.247   9.437
  281    HG3  ARG  36           HG3      ARG  36   3.723  23.579   8.995
  282    HD2  ARG  36           HD2      ARG  36   4.187  24.850   7.023
  283    HD3  ARG  36           HD3      ARG  36   2.590  24.135   6.724
  284    HE   ARG  36           HE       ARG  36   2.773  26.856   7.949
  285   HH11  ARG  36          HH11      ARG  36   3.159  27.053   5.036
  286   HH12  ARG  36          HH12      ARG  36   1.541  27.167   4.430
  287   HH21  ARG  36          HH21      ARG  36   0.084  25.984   7.357
  288   HH22  ARG  36          HH22      ARG  36  -0.208  26.558   5.750
  Start of MODEL   21
    1    HA   SER   1           HA       SER   1 -27.657   4.395  -3.897
    2    HB2  SER   1           HB2      SER   1 -29.832   3.037  -3.419
    3    HB3  SER   1           HB3      SER   1 -29.985   4.760  -3.748
    4    HG   SER   1           HG       SER   1 -31.400   3.222  -4.945
    5    H    ASP   2           H        ASP   2 -26.787   2.488  -3.019
    6    HA   ASP   2           HA       ASP   2 -26.930  -0.017  -4.631
    7    HB2  ASP   2           HB2      ASP   2 -24.484  -0.191  -4.598
    8    HB3  ASP   2           HB3      ASP   2 -24.949   1.344  -5.326
    9    H    LEU   3           H        LEU   3 -26.511  -1.920  -3.362
   10    HA   LEU   3           HA       LEU   3 -26.062  -1.547  -0.436
   11    HB2  LEU   3           HB2      LEU   3 -28.553  -1.598  -1.345
   12    HB3  LEU   3           HB3      LEU   3 -28.268  -3.337  -1.389
   13    HG   LEU   3           HG       LEU   3 -27.287  -2.209   1.096
   14   HD11  LEU   3          HD11      LEU   3 -29.503  -1.609   2.042
   15   HD12  LEU   3          HD12      LEU   3 -30.217  -1.773   0.437
   16   HD13  LEU   3          HD13      LEU   3 -29.025  -0.511   0.746
   17   HD21  LEU   3          HD21      LEU   3 -27.751  -4.575   0.802
   18   HD22  LEU   3          HD22      LEU   3 -29.425  -4.234   0.361
   19   HD23  LEU   3          HD23      LEU   3 -28.870  -3.941   2.010
   20    HA   PRO   4           HA       PRO   4 -24.072  -5.355  -2.157
   21    HB2  PRO   4           HB2      PRO   4 -21.485  -4.457  -2.297
   22    HB3  PRO   4           HB3      PRO   4 -22.650  -4.249  -3.613
   23    HG2  PRO   4           HG2      PRO   4 -21.536  -2.260  -1.794
   24    HG3  PRO   4           HG3      PRO   4 -22.358  -2.037  -3.343
   25    HD2  PRO   4           HD2      PRO   4 -23.423  -1.730  -0.683
   26    HD3  PRO   4           HD3      PRO   4 -24.218  -1.401  -2.238
   27    H    ALA   5           H        ALA   5 -21.358  -5.743  -1.062
   28    HA   ALA   5           HA       ALA   5 -21.956  -6.710   1.559
   29    HB1  ALA   5           HB1      ALA   5 -19.270  -5.954   0.363
   30    HB2  ALA   5           HB2      ALA   5 -20.132  -7.448  -0.003
   31    HB3  ALA   5           HB3      ALA   5 -19.558  -7.141   1.635
   32    H    LEU   6           H        LEU   6 -20.635  -3.607   0.448
   33    HA   LEU   6           HA       LEU   6 -20.222  -1.590   1.592
   34    HB2  LEU   6           HB2      LEU   6 -22.621  -2.366   2.287
   35    HB3  LEU   6           HB3      LEU   6 -21.871  -2.732   3.841
   36    HG   LEU   6           HG       LEU   6 -20.868  -0.246   3.406
   37   HD11  LEU   6          HD11      LEU   6 -22.107   0.104   1.337
   38   HD12  LEU   6          HD12      LEU   6 -22.776   1.151   2.588
   39   HD13  LEU   6          HD13      LEU   6 -23.621  -0.328   2.132
   40   HD21  LEU   6          HD21      LEU   6 -23.606  -0.809   4.588
   41   HD22  LEU   6          HD22      LEU   6 -22.533   0.526   5.007
   42   HD23  LEU   6          HD23      LEU   6 -22.082  -1.128   5.416
   43    H    SER   7           H        SER   7 -18.477  -4.037   2.140
   44    HA   SER   7           HA       SER   7 -17.492  -3.295   4.870
   45    HB2  SER   7           HB2      SER   7 -17.534  -5.808   3.224
   46    HB3  SER   7           HB3      SER   7 -16.325  -5.621   4.491
   47    HG   SER   7           HG       SER   7 -19.153  -5.540   4.722
   48    H    THR   8           H        THR   8 -16.373  -4.181   1.597
   49    HA   THR   8           HA       THR   8 -13.784  -2.783   2.179
   50    HB   THR   8           HB       THR   8 -12.915  -4.270   0.362
   51    HG1  THR   8           HG1      THR   8 -14.545  -4.817  -0.891
   52   HG21  THR   8          HG21      THR   8 -13.203  -4.908   2.910
   53   HG22  THR   8          HG22      THR   8 -12.684  -6.122   1.741
   54   HG23  THR   8          HG23      THR   8 -14.365  -6.069   2.269
   55    H    GLY   9           H        GLY   9 -15.947  -1.149   1.477
   56    HA2  GLY   9           HA2      GLY   9 -15.723  -0.658  -1.446
   57    HA3  GLY   9           HA3      GLY   9 -16.896   0.098  -0.363
   58    H    LEU  10           H        LEU  10 -15.952   1.617   1.297
   59    HA   LEU  10           HA       LEU  10 -13.976   3.393   0.001
   60    HB2  LEU  10           HB2      LEU  10 -16.211   3.998   1.187
   61    HB3  LEU  10           HB3      LEU  10 -15.315   3.755   2.686
   62    HG   LEU  10           HG       LEU  10 -13.557   5.359   1.673
   63   HD11  LEU  10          HD11      LEU  10 -14.601   6.998   0.062
   64   HD12  LEU  10          HD12      LEU  10 -15.950   5.876  -0.116
   65   HD13  LEU  10          HD13      LEU  10 -14.330   5.394  -0.619
   66   HD21  LEU  10          HD21      LEU  10 -14.853   7.336   2.435
   67   HD22  LEU  10          HD22      LEU  10 -15.036   5.974   3.540
   68   HD23  LEU  10          HD23      LEU  10 -16.327   6.368   2.404
   69    H    LEU  11           H        LEU  11 -14.289   1.421   2.957
   70    HA   LEU  11           HA       LEU  11 -11.883   2.188   4.273
   71    HB2  LEU  11           HB2      LEU  11 -13.954   0.645   4.890
   72    HB3  LEU  11           HB3      LEU  11 -12.901  -0.640   4.299
   73    HG   LEU  11           HG       LEU  11 -11.635   1.304   6.148
   74   HD11  LEU  11          HD11      LEU  11 -13.699   1.130   7.337
   75   HD12  LEU  11          HD12      LEU  11 -12.605  -0.016   8.111
   76   HD13  LEU  11          HD13      LEU  11 -13.837  -0.593   6.989
   77   HD21  LEU  11          HD21      LEU  11 -10.653  -0.849   5.119
   78   HD22  LEU  11          HD22      LEU  11 -11.686  -1.718   6.254
   79   HD23  LEU  11          HD23      LEU  11 -10.439  -0.624   6.855
   80    H    HIS  12           H        HIS  12 -12.468  -0.526   1.997
   81    HA   HIS  12           HA       HIS  12  -9.790  -1.520   1.930
   82    HB2  HIS  12           HB2      HIS  12 -12.157  -2.334   0.986
   83    HB3  HIS  12           HB3      HIS  12 -11.542  -1.601  -0.496
   84    HD1  HIS  12           HD1      HIS  12  -9.424  -2.663  -1.571
   85    HD2  HIS  12           HD2      HIS  12 -10.763  -4.667   1.830
   86    HE1  HIS  12           HE1      HIS  12  -8.194  -4.876  -1.512
   87    H    LEU  13           H        LEU  13 -11.424   0.960  -0.072
   88    HA   LEU  13           HA       LEU  13  -9.372   1.422  -1.981
   89    HB2  LEU  13           HB2      LEU  13 -11.809   2.357  -1.670
   90    HB3  LEU  13           HB3      LEU  13 -11.012   3.634  -0.751
   91    HG   LEU  13           HG       LEU  13  -9.412   3.741  -2.842
   92   HD11  LEU  13          HD11      LEU  13 -11.946   2.537  -3.999
   93   HD12  LEU  13          HD12      LEU  13 -10.363   1.759  -3.954
   94   HD13  LEU  13          HD13      LEU  13 -10.610   3.201  -4.938
   95   HD21  LEU  13          HD21      LEU  13 -12.266   4.775  -2.944
   96   HD22  LEU  13          HD22      LEU  13 -10.899   5.432  -3.844
   97   HD23  LEU  13          HD23      LEU  13 -10.934   5.548  -2.084
   98    H    HIS  14           H        HIS  14  -9.848   2.819   1.272
   99    HA   HIS  14           HA       HIS  14  -7.553   4.567   1.231
  100    HB2  HIS  14           HB2      HIS  14  -9.380   4.888   2.786
  101    HB3  HIS  14           HB3      HIS  14  -9.208   3.249   3.411
  102    HD1  HIS  14           HD1      HIS  14  -7.295   6.536   3.294
  103    HD2  HIS  14           HD2      HIS  14  -7.408   3.013   5.518
  104    HE1  HIS  14           HE1      HIS  14  -5.728   6.875   5.256
  105    H    GLN  15           H        GLN  15  -8.073   1.262   2.517
  106    HA   GLN  15           HA       GLN  15  -5.431   0.837   3.540
  107    HB2  GLN  15           HB2      GLN  15  -7.583  -1.008   2.457
  108    HB3  GLN  15           HB3      GLN  15  -6.139  -1.591   3.282
  109    HG2  GLN  15           HG2      GLN  15  -7.617   0.553   4.696
  110    HG3  GLN  15           HG3      GLN  15  -8.469  -0.985   4.563
  111   HE21  GLN  15          HE21      GLN  15  -5.282   0.365   5.581
  112   HE22  GLN  15          HE22      GLN  15  -4.986  -0.835   6.745
  113    H    ASN  16           H        ASN  16  -6.838   0.378   0.309
  114    HA   ASN  16           HA       ASN  16  -4.712  -1.064  -0.927
  115    HB2  ASN  16           HB2      ASN  16  -7.031  -0.623  -1.795
  116    HB3  ASN  16           HB3      ASN  16  -6.549   1.042  -2.116
  117   HD21  ASN  16          HD21      ASN  16  -5.029   1.429  -3.884
  118   HD22  ASN  16          HD22      ASN  16  -4.662   0.219  -5.016
  119    H    ILE  17           H        ILE  17  -5.186   2.443  -0.447
  120    HA   ILE  17           HA       ILE  17  -2.706   3.104  -1.904
  121    HB   ILE  17           HB       ILE  17  -4.813   4.655  -0.365
  122   HG12  ILE  17          HG12      ILE  17  -4.149   4.970  -3.278
  123   HG13  ILE  17          HG13      ILE  17  -5.095   3.572  -2.767
  124   HG21  ILE  17          HG21      ILE  17  -2.719   5.871  -0.108
  125   HG22  ILE  17          HG22      ILE  17  -3.706   6.697  -1.314
  126   HG23  ILE  17          HG23      ILE  17  -2.358   5.681  -1.825
  127   HD11  ILE  17          HD11      ILE  17  -6.930   4.868  -2.692
  128   HD12  ILE  17          HD12      ILE  17  -5.971   6.282  -3.125
  129   HD13  ILE  17          HD13      ILE  17  -6.173   5.840  -1.431
  130    H    VAL  18           H        VAL  18  -3.841   2.961   1.474
  131    HA   VAL  18           HA       VAL  18  -1.451   4.104   2.638
  132    HB   VAL  18           HB       VAL  18  -3.727   2.386   3.661
  133   HG11  VAL  18          HG11      VAL  18  -1.482   3.712   5.214
  134   HG12  VAL  18          HG12      VAL  18  -1.810   1.981   5.114
  135   HG13  VAL  18          HG13      VAL  18  -2.944   3.047   5.943
  136   HG21  VAL  18          HG21      VAL  18  -4.810   4.349   3.902
  137   HG22  VAL  18          HG22      VAL  18  -3.513   5.105   2.979
  138   HG23  VAL  18          HG23      VAL  18  -3.436   5.068   4.741
  139    H    ASP  19           H        ASP  19  -2.447   0.806   1.822
  140    HA   ASP  19           HA       ASP  19  -0.045  -0.354   3.091
  141    HB2  ASP  19           HB2      ASP  19  -2.565  -1.225   2.808
  142    HB3  ASP  19           HB3      ASP  19  -1.887  -1.913   1.332
  143    H    VAL  20           H        VAL  20  -0.181   1.407   0.411
  144    HA   VAL  20           HA       VAL  20   1.514  -0.475  -1.189
  145    HB   VAL  20           HB       VAL  20  -0.835   0.460  -1.971
  146   HG11  VAL  20          HG11      VAL  20   0.901   2.644  -3.088
  147   HG12  VAL  20          HG12      VAL  20   0.132   2.856  -1.516
  148   HG13  VAL  20          HG13      VAL  20  -0.857   2.579  -2.948
  149   HG21  VAL  20          HG21      VAL  20  -0.070   0.293  -4.289
  150   HG22  VAL  20          HG22      VAL  20   0.744  -0.926  -3.309
  151   HG23  VAL  20          HG23      VAL  20   1.601   0.543  -3.780
  152    H    GLN  21           H        GLN  21   1.341   2.620   0.384
  153    HA   GLN  21           HA       GLN  21   3.836   3.573  -0.939
  154    HB2  GLN  21           HB2      GLN  21   1.532   4.843  -0.386
  155    HB3  GLN  21           HB3      GLN  21   2.360   5.127   1.146
  156    HG2  GLN  21           HG2      GLN  21   4.236   5.599  -0.959
  157    HG3  GLN  21           HG3      GLN  21   2.754   6.474  -1.348
  158   HE21  GLN  21          HE21      GLN  21   2.167   8.274  -0.001
  159   HE22  GLN  21          HE22      GLN  21   3.153   8.833   1.261
  160    H    TYR  22           H        TYR  22   2.577   2.436   2.168
  161    HA   TYR  22           HA       TYR  22   4.740   3.292   3.844
  162    HB2  TYR  22           HB2      TYR  22   3.604   2.061   5.454
  163    HB3  TYR  22           HB3      TYR  22   2.325   2.240   4.258
  164    HD1  TYR  22           HD1      TYR  22   1.839   0.359   2.664
  165    HD2  TYR  22           HD2      TYR  22   4.548  -0.077   5.967
  166    HE1  TYR  22           HE1      TYR  22   1.677  -2.107   2.472
  167    HE2  TYR  22           HE2      TYR  22   4.388  -2.541   5.769
  168    HH   TYR  22           HH       TYR  22   3.647  -4.161   3.439
  169    H    MET  23           H        MET  23   4.503   0.665   1.537
  170    HA   MET  23           HA       MET  23   6.883  -0.723   2.639
  171    HB2  MET  23           HB2      MET  23   4.616  -1.642   1.564
  172    HB3  MET  23           HB3      MET  23   5.532  -1.453   0.067
  173    HG2  MET  23           HG2      MET  23   7.349  -2.658   1.802
  174    HG3  MET  23           HG3      MET  23   5.823  -3.456   2.175
  175    HE1  MET  23           HE1      MET  23   8.731  -2.987  -0.082
  176    HE2  MET  23           HE2      MET  23   7.639  -1.973  -1.022
  177    HE3  MET  23           HE3      MET  23   8.230  -3.486  -1.703
  178    H    TYR  24           H        TYR  24   5.984   1.388  -0.057
  179    HA   TYR  24           HA       TYR  24   8.639   1.030  -1.350
  180    HB2  TYR  24           HB2      TYR  24   6.002   2.330  -2.031
  181    HB3  TYR  24           HB3      TYR  24   7.444   2.683  -2.980
  182    HD1  TYR  24           HD1      TYR  24   5.264  -0.091  -1.776
  183    HD2  TYR  24           HD2      TYR  24   8.266   1.139  -4.590
  184    HE1  TYR  24           HE1      TYR  24   4.960  -2.209  -3.025
  185    HE2  TYR  24           HE2      TYR  24   7.963  -0.981  -5.839
  186    HH   TYR  24           HH       TYR  24   5.428  -2.867  -5.664
  187    H    GLY  25           H        GLY  25   8.643   2.310   1.255
  188    HA2  GLY  25           HA2      GLY  25   8.820   5.205   0.826
  189    HA3  GLY  25           HA3      GLY  25   9.163   4.358   2.333
  190    H    LEU  26           H        LEU  26  11.034   2.468   0.891
  191    HA   LEU  26           HA       LEU  26  13.398   4.280   0.920
  192    HB2  LEU  26           HB2      LEU  26  12.806   1.382   1.366
  193    HB3  LEU  26           HB3      LEU  26  14.416   1.794   0.782
  194    HG   LEU  26           HG       LEU  26  14.436   1.741   3.220
  195   HD11  LEU  26          HD11      LEU  26  15.499   3.708   1.744
  196   HD12  LEU  26          HD12      LEU  26  15.630   3.689   3.502
  197   HD13  LEU  26          HD13      LEU  26  14.400   4.683   2.721
  198   HD21  LEU  26          HD21      LEU  26  11.927   2.281   3.364
  199   HD22  LEU  26          HD22      LEU  26  12.394   3.974   3.204
  200   HD23  LEU  26          HD23      LEU  26  12.962   3.028   4.580
  201    H    SER  27           H        SER  27  11.755   4.477  -1.419
  202    HA   SER  27           HA       SER  27  12.627   2.795  -3.578
  203    HB2  SER  27           HB2      SER  27  10.628   4.022  -3.866
  204    HB3  SER  27           HB3      SER  27  11.361   5.525  -3.325
  205    HG   SER  27           HG       SER  27  11.021   5.118  -5.702
  206    HA   PRO  28           HA       PRO  28  15.906   6.083  -4.541
  207    HB2  PRO  28           HB2      PRO  28  16.209   8.258  -2.917
  208    HB3  PRO  28           HB3      PRO  28  15.060   8.220  -4.266
  209    HG2  PRO  28           HG2      PRO  28  14.569   8.002  -1.364
  210    HG3  PRO  28           HG3      PRO  28  13.532   8.645  -2.644
  211    HD2  PRO  28           HD2      PRO  28  13.299   6.134  -1.429
  212    HD3  PRO  28           HD3      PRO  28  12.500   6.661  -2.923
  213    H    ALA  29           H        ALA  29  16.275   3.884  -2.901
  214    HA   ALA  29           HA       ALA  29  18.725   4.619  -1.404
  215    HB1  ALA  29           HB1      ALA  29  17.749   3.186   0.535
  216    HB2  ALA  29           HB2      ALA  29  16.189   3.457  -0.242
  217    HB3  ALA  29           HB3      ALA  29  17.133   4.827   0.342
  218    H    ILE  30           H        ILE  30  16.483   1.840  -1.817
  219    HA   ILE  30           HA       ILE  30  18.587  -0.132  -1.941
  220    HB   ILE  30           HB       ILE  30  15.696  -0.147  -2.874
  221   HG12  ILE  30          HG12      ILE  30  16.635  -1.508  -0.387
  222   HG13  ILE  30          HG13      ILE  30  16.523   0.251  -0.346
  223   HG21  ILE  30          HG21      ILE  30  15.926  -2.638  -2.576
  224   HG22  ILE  30          HG22      ILE  30  17.664  -2.403  -2.391
  225   HG23  ILE  30          HG23      ILE  30  16.874  -1.991  -3.913
  226   HD11  ILE  30          HD11      ILE  30  14.331  -1.756  -0.861
  227   HD12  ILE  30          HD12      ILE  30  14.165  -0.073  -1.360
  228   HD13  ILE  30          HD13      ILE  30  14.382  -0.470   0.344
  229    H    THR  31           H        THR  31  16.822   1.725  -4.381
  230    HA   THR  31           HA       THR  31  17.856   0.314  -6.694
  231    HB   THR  31           HB       THR  31  17.000   3.206  -6.675
  232    HG1  THR  31           HG1      THR  31  15.247   2.636  -5.688
  233   HG21  THR  31          HG21      THR  31  16.389   0.864  -8.500
  234   HG22  THR  31          HG22      THR  31  17.611   2.100  -8.801
  235   HG23  THR  31          HG23      THR  31  15.903   2.538  -8.768
  236    H    LYS  32           H        LYS  32  18.781   3.359  -5.048
  237    HA   LYS  32           HA       LYS  32  20.941   4.097  -6.755
  238    HB2  LYS  32           HB2      LYS  32  19.952   4.682  -4.018
  239    HB3  LYS  32           HB3      LYS  32  21.650   5.058  -4.303
  240    HG2  LYS  32           HG2      LYS  32  21.175   6.715  -5.827
  241    HG3  LYS  32           HG3      LYS  32  19.715   5.910  -6.404
  242    HD2  LYS  32           HD2      LYS  32  18.598   6.493  -4.238
  243    HD3  LYS  32           HD3      LYS  32  20.032   7.414  -3.789
  244    HE2  LYS  32           HE2      LYS  32  18.924   8.057  -6.469
  245    HE3  LYS  32           HE3      LYS  32  17.907   8.520  -5.092
  246    HZ1  LYS  32           HZ1      LYS  32  19.774   9.619  -4.075
  247    HZ2  LYS  32           HZ2      LYS  32  19.579  10.228  -5.649
  248    HZ3  LYS  32           HZ3      LYS  32  20.814   9.110  -5.315
  249    H    TYR  33           H        TYR  33  20.775   1.826  -4.060
  250    HA   TYR  33           HA       TYR  33  23.642   1.440  -3.777
  251    HB2  TYR  33           HB2      TYR  33  21.980   0.987  -2.008
  252    HB3  TYR  33           HB3      TYR  33  21.241  -0.262  -3.011
  253    HD1  TYR  33           HD1      TYR  33  24.380   0.703  -1.250
  254    HD2  TYR  33           HD2      TYR  33  22.151  -2.457  -3.120
  255    HE1  TYR  33           HE1      TYR  33  26.013  -0.956  -0.395
  256    HE2  TYR  33           HE2      TYR  33  23.783  -4.115  -2.266
  257    HH   TYR  33           HH       TYR  33  25.589  -3.894   0.041
  258    H    VAL  34           H        VAL  34  21.069  -0.188  -5.627
  259    HA   VAL  34           HA       VAL  34  22.771  -2.362  -6.568
  260    HB   VAL  34           HB       VAL  34  20.062  -1.258  -7.381
  261   HG11  VAL  34          HG11      VAL  34  20.877  -2.421  -9.308
  262   HG12  VAL  34          HG12      VAL  34  19.820  -3.558  -8.470
  263   HG13  VAL  34          HG13      VAL  34  21.571  -3.709  -8.323
  264   HG21  VAL  34          HG21      VAL  34  20.582  -3.896  -6.035
  265   HG22  VAL  34          HG22      VAL  34  19.145  -2.875  -5.968
  266   HG23  VAL  34          HG23      VAL  34  20.593  -2.419  -5.070
  267    H    VAL  35           H        VAL  35  22.076   0.904  -7.677
  268    HA   VAL  35           HA       VAL  35  23.370   0.333 -10.311
  269    HB   VAL  35           HB       VAL  35  21.848   2.775  -9.328
  270   HG11  VAL  35          HG11      VAL  35  21.644   3.277 -11.735
  271   HG12  VAL  35          HG12      VAL  35  22.585   1.835 -12.119
  272   HG13  VAL  35          HG13      VAL  35  23.339   3.179 -11.262
  273   HG21  VAL  35          HG21      VAL  35  20.949   0.137 -10.269
  274   HG22  VAL  35          HG22      VAL  35  20.265   1.474 -11.191
  275   HG23  VAL  35          HG23      VAL  35  20.040   1.403  -9.444
  276    H    ARG  36           H        ARG  36  25.292   0.223  -8.496
  277    HA   ARG  36           HA       ARG  36  26.670   2.878  -8.669
  278    HB2  ARG  36           HB2      ARG  36  25.556   2.217  -6.407
  279    HB3  ARG  36           HB3      ARG  36  26.879   1.059  -6.269
  280    HG2  ARG  36           HG2      ARG  36  27.555   3.092  -5.145
  281    HG3  ARG  36           HG3      ARG  36  28.489   2.960  -6.635
  282    HD2  ARG  36           HD2      ARG  36  27.611   4.893  -7.443
  283    HD3  ARG  36           HD3      ARG  36  25.958   4.371  -7.064
  284    HE   ARG  36           HE       ARG  36  26.291   5.183  -4.765
  285   HH11  ARG  36          HH11      ARG  36  26.924   7.548  -6.553
  286   HH12  ARG  36          HH12      ARG  36  28.398   8.127  -5.853
  287   HH21  ARG  36          HH21      ARG  36  28.998   5.209  -4.062
  288   HH22  ARG  36          HH22      ARG  36  29.578   6.797  -4.437
  Start of MODEL   22
    1    HA   SER   1           HA       SER   1 -29.239 -11.889   4.178
    2    HB2  SER   1           HB2      SER   1 -28.787  -9.900   5.708
    3    HB3  SER   1           HB3      SER   1 -29.841 -11.137   6.386
    4    HG   SER   1           HG       SER   1 -27.089 -10.667   6.893
    5    H    ASP   2           H        ASP   2 -27.985 -11.179   2.498
    6    HA   ASP   2           HA       ASP   2 -25.049 -10.769   2.993
    7    HB2  ASP   2           HB2      ASP   2 -26.595 -11.761   0.576
    8    HB3  ASP   2           HB3      ASP   2 -24.862 -11.437   0.572
    9    H    LEU   3           H        LEU   3 -27.205  -8.737   3.252
   10    HA   LEU   3           HA       LEU   3 -27.081  -7.031   0.876
   11    HB2  LEU   3           HB2      LEU   3 -28.829  -7.363   2.930
   12    HB3  LEU   3           HB3      LEU   3 -27.945  -5.951   3.508
   13    HG   LEU   3           HG       LEU   3 -28.961  -6.060   0.674
   14   HD11  LEU   3          HD11      LEU   3 -30.497  -5.111   3.114
   15   HD12  LEU   3          HD12      LEU   3 -30.890  -6.532   2.145
   16   HD13  LEU   3          HD13      LEU   3 -31.011  -4.921   1.437
   17   HD21  LEU   3          HD21      LEU   3 -28.164  -3.921   2.659
   18   HD22  LEU   3          HD22      LEU   3 -29.080  -3.538   1.200
   19   HD23  LEU   3          HD23      LEU   3 -27.470  -4.248   1.071
   20    HA   PRO   4           HA       PRO   4 -24.200  -4.418   3.601
   21    HB2  PRO   4           HB2      PRO   4 -23.437  -5.322   6.064
   22    HB3  PRO   4           HB3      PRO   4 -24.921  -4.388   5.795
   23    HG2  PRO   4           HG2      PRO   4 -24.575  -7.272   6.308
   24    HG3  PRO   4           HG3      PRO   4 -25.936  -6.210   6.686
   25    HD2  PRO   4           HD2      PRO   4 -25.781  -8.027   4.557
   26    HD3  PRO   4           HD3      PRO   4 -26.995  -6.751   4.770
   27    H    ALA   5           H        ALA   5 -23.336  -6.299   1.798
   28    HA   ALA   5           HA       ALA   5 -20.919  -7.620   2.956
   29    HB1  ALA   5           HB1      ALA   5 -22.562  -8.916   1.596
   30    HB2  ALA   5           HB2      ALA   5 -20.965  -8.885   0.848
   31    HB3  ALA   5           HB3      ALA   5 -22.246  -7.842   0.233
   32    H    LEU   6           H        LEU   6 -21.908  -5.397   0.330
   33    HA   LEU   6           HA       LEU   6 -19.058  -4.757  -0.233
   34    HB2  LEU   6           HB2      LEU   6 -21.606  -4.795  -1.637
   35    HB3  LEU   6           HB3      LEU   6 -20.795  -3.246  -1.857
   36    HG   LEU   6           HG       LEU   6 -20.106  -4.824  -3.610
   37   HD11  LEU   6          HD11      LEU   6 -17.750  -4.655  -1.748
   38   HD12  LEU   6          HD12      LEU   6 -18.474  -3.178  -2.384
   39   HD13  LEU   6          HD13      LEU   6 -17.813  -4.382  -3.489
   40   HD21  LEU   6          HD21      LEU   6 -18.949  -6.525  -1.384
   41   HD22  LEU   6          HD22      LEU   6 -19.012  -6.906  -3.104
   42   HD23  LEU   6          HD23      LEU   6 -20.498  -6.870  -2.155
   43    H    SER   7           H        SER   7 -20.200  -3.874   2.323
   44    HA   SER   7           HA       SER   7 -20.654  -0.960   1.982
   45    HB2  SER   7           HB2      SER   7 -20.648  -2.777   4.412
   46    HB3  SER   7           HB3      SER   7 -21.184  -1.101   4.395
   47    HG   SER   7           HG       SER   7 -22.953  -1.665   3.330
   48    H    THR   8           H        THR   8 -17.937  -2.718   1.903
   49    HA   THR   8           HA       THR   8 -16.378  -0.862   3.673
   50    HB   THR   8           HB       THR   8 -14.702  -2.793   3.583
   51    HG1  THR   8           HG1      THR   8 -16.851  -4.414   2.819
   52   HG21  THR   8          HG21      THR   8 -17.365  -3.649   4.715
   53   HG22  THR   8          HG22      THR   8 -16.442  -2.324   5.424
   54   HG23  THR   8          HG23      THR   8 -15.751  -3.946   5.363
   55    H    GLY   9           H        GLY   9 -17.250  -0.560   0.740
   56    HA2  GLY   9           HA2      GLY   9 -15.000  -0.975  -0.973
   57    HA3  GLY   9           HA3      GLY   9 -16.302   0.177  -1.273
   58    H    LEU  10           H        LEU  10 -16.065   1.994   0.743
   59    HA   LEU  10           HA       LEU  10 -13.832   3.612  -0.055
   60    HB2  LEU  10           HB2      LEU  10 -16.035   3.654   1.935
   61    HB3  LEU  10           HB3      LEU  10 -14.644   4.660   2.332
   62    HG   LEU  10           HG       LEU  10 -16.365   5.893   1.016
   63   HD11  LEU  10          HD11      LEU  10 -14.481   7.034   0.503
   64   HD12  LEU  10          HD12      LEU  10 -14.526   6.178  -1.038
   65   HD13  LEU  10          HD13      LEU  10 -13.545   5.555   0.288
   66   HD21  LEU  10          HD21      LEU  10 -16.792   5.304  -1.296
   67   HD22  LEU  10          HD22      LEU  10 -17.097   3.876  -0.308
   68   HD23  LEU  10          HD23      LEU  10 -15.602   4.005  -1.233
   69    H    LEU  11           H        LEU  11 -14.392   1.668   2.905
   70    HA   LEU  11           HA       LEU  11 -11.944   2.308   4.234
   71    HB2  LEU  11           HB2      LEU  11 -14.092   1.102   5.036
   72    HB3  LEU  11           HB3      LEU  11 -13.375  -0.356   4.350
   73    HG   LEU  11           HG       LEU  11 -11.305   0.143   5.745
   74   HD11  LEU  11          HD11      LEU  11 -11.860   1.589   7.792
   75   HD12  LEU  11          HD12      LEU  11 -13.227   2.197   6.858
   76   HD13  LEU  11          HD13      LEU  11 -11.580   2.450   6.279
   77   HD21  LEU  11          HD21      LEU  11 -12.791  -1.601   6.471
   78   HD22  LEU  11          HD22      LEU  11 -13.977  -0.433   7.052
   79   HD23  LEU  11          HD23      LEU  11 -12.438  -0.618   7.892
   80    H    HIS  12           H        HIS  12 -12.760  -0.375   2.003
   81    HA   HIS  12           HA       HIS  12 -10.190  -1.660   2.052
   82    HB2  HIS  12           HB2      HIS  12 -12.560  -1.557   0.188
   83    HB3  HIS  12           HB3      HIS  12 -11.112  -2.446  -0.278
   84    HD1  HIS  12           HD1      HIS  12 -11.819  -2.437   3.357
   85    HD2  HIS  12           HD2      HIS  12 -12.743  -4.856   0.088
   86    HE1  HIS  12           HE1      HIS  12 -12.655  -4.631   4.301
   87    H    LEU  13           H        LEU  13 -11.543   0.943   0.023
   88    HA   LEU  13           HA       LEU  13  -9.422   1.166  -1.878
   89    HB2  LEU  13           HB2      LEU  13 -11.718   2.239  -1.892
   90    HB3  LEU  13           HB3      LEU  13 -11.128   3.376  -0.680
   91    HG   LEU  13           HG       LEU  13  -9.193   3.807  -2.385
   92   HD11  LEU  13          HD11      LEU  13  -9.636   2.043  -3.957
   93   HD12  LEU  13          HD12      LEU  13 -10.072   3.553  -4.756
   94   HD13  LEU  13          HD13      LEU  13 -11.331   2.510  -4.094
   95   HD21  LEU  13          HD21      LEU  13 -11.016   5.407  -1.738
   96   HD22  LEU  13          HD22      LEU  13 -12.004   4.745  -3.041
   97   HD23  LEU  13          HD23      LEU  13 -10.500   5.584  -3.415
   98    H    HIS  14           H        HIS  14  -9.869   2.659   1.339
   99    HA   HIS  14           HA       HIS  14  -7.546   4.335   1.328
  100    HB2  HIS  14           HB2      HIS  14  -9.282   4.660   2.952
  101    HB3  HIS  14           HB3      HIS  14  -9.207   2.978   3.472
  102    HD1  HIS  14           HD1      HIS  14  -8.469   3.270   5.883
  103    HD2  HIS  14           HD2      HIS  14  -6.037   5.363   3.218
  104    HE1  HIS  14           HE1      HIS  14  -6.505   4.130   7.228
  105    H    GLN  15           H        GLN  15  -8.035   1.043   2.681
  106    HA   GLN  15           HA       GLN  15  -5.380   0.574   3.581
  107    HB2  GLN  15           HB2      GLN  15  -7.617  -0.737   3.853
  108    HB3  GLN  15           HB3      GLN  15  -7.164  -1.528   2.345
  109    HG2  GLN  15           HG2      GLN  15  -6.214  -2.965   3.917
  110    HG3  GLN  15           HG3      GLN  15  -4.857  -1.897   3.560
  111   HE21  GLN  15          HE21      GLN  15  -3.882  -0.978   5.375
  112   HE22  GLN  15          HE22      GLN  15  -4.628  -0.787   6.888
  113    H    ASN  16           H        ASN  16  -6.832   0.168   0.356
  114    HA   ASN  16           HA       ASN  16  -4.658  -1.221  -0.899
  115    HB2  ASN  16           HB2      ASN  16  -7.087  -0.812  -1.656
  116    HB3  ASN  16           HB3      ASN  16  -6.531   0.770  -2.203
  117   HD21  ASN  16          HD21      ASN  16  -4.466   0.636  -3.699
  118   HD22  ASN  16          HD22      ASN  16  -4.440  -0.644  -4.814
  119    H    ILE  17           H        ILE  17  -5.293   2.255  -0.406
  120    HA   ILE  17           HA       ILE  17  -2.925   3.028  -1.995
  121    HB   ILE  17           HB       ILE  17  -4.974   4.551  -0.350
  122   HG12  ILE  17          HG12      ILE  17  -4.681   4.665  -3.337
  123   HG13  ILE  17          HG13      ILE  17  -5.500   3.281  -2.614
  124   HG21  ILE  17          HG21      ILE  17  -3.980   6.444  -1.939
  125   HG22  ILE  17          HG22      ILE  17  -2.543   5.425  -1.864
  126   HG23  ILE  17          HG23      ILE  17  -3.236   6.083  -0.382
  127   HD11  ILE  17          HD11      ILE  17  -6.277   6.189  -2.526
  128   HD12  ILE  17          HD12      ILE  17  -6.847   5.075  -1.284
  129   HD13  ILE  17          HD13      ILE  17  -7.259   4.795  -2.975
  130    H    VAL  18           H        VAL  18  -3.854   2.747   1.424
  131    HA   VAL  18           HA       VAL  18  -1.542   4.139   2.469
  132    HB   VAL  18           HB       VAL  18  -3.977   3.129   3.389
  133   HG11  VAL  18          HG11      VAL  18  -1.691   1.660   4.727
  134   HG12  VAL  18          HG12      VAL  18  -3.044   0.935   3.857
  135   HG13  VAL  18          HG13      VAL  18  -3.324   1.775   5.383
  136   HG21  VAL  18          HG21      VAL  18  -3.326   4.202   5.508
  137   HG22  VAL  18          HG22      VAL  18  -2.827   5.183   4.130
  138   HG23  VAL  18          HG23      VAL  18  -1.640   4.204   4.993
  139    H    ASP  19           H        ASP  19  -2.288   0.699   1.928
  140    HA   ASP  19           HA       ASP  19   0.126  -0.382   3.037
  141    HB2  ASP  19           HB2      ASP  19  -2.192  -1.378   2.098
  142    HB3  ASP  19           HB3      ASP  19  -1.171  -1.690   0.695
  143    H    VAL  20           H        VAL  20  -0.526   1.175  -0.035
  144    HA   VAL  20           HA       VAL  20   1.611   0.165  -1.620
  145    HB   VAL  20           HB       VAL  20   0.128   2.800  -1.487
  146   HG11  VAL  20          HG11      VAL  20   2.131   3.422  -2.570
  147   HG12  VAL  20          HG12      VAL  20   1.039   3.025  -3.896
  148   HG13  VAL  20          HG13      VAL  20   2.271   1.868  -3.392
  149   HG21  VAL  20          HG21      VAL  20  -0.763   0.364  -2.240
  150   HG22  VAL  20          HG22      VAL  20  -0.073   0.905  -3.769
  151   HG23  VAL  20          HG23      VAL  20  -1.331   1.859  -2.983
  152    H    GLN  21           H        GLN  21   1.524   2.855   0.704
  153    HA   GLN  21           HA       GLN  21   4.175   3.838   0.206
  154    HB2  GLN  21           HB2      GLN  21   2.173   3.963   2.453
  155    HB3  GLN  21           HB3      GLN  21   3.780   4.656   2.673
  156    HG2  GLN  21           HG2      GLN  21   2.158   5.329   0.225
  157    HG3  GLN  21           HG3      GLN  21   1.882   6.187   1.741
  158   HE21  GLN  21          HE21      GLN  21   3.848   7.296   2.714
  159   HE22  GLN  21          HE22      GLN  21   5.067   7.848   1.669
  160    H    TYR  22           H        TYR  22   3.031   1.027   1.955
  161    HA   TYR  22           HA       TYR  22   5.598   0.709   3.414
  162    HB2  TYR  22           HB2      TYR  22   3.330  -1.283   3.332
  163    HB3  TYR  22           HB3      TYR  22   4.455  -0.955   4.645
  164    HD1  TYR  22           HD1      TYR  22   4.242   2.118   4.558
  165    HD2  TYR  22           HD2      TYR  22   1.281  -0.992   4.511
  166    HE1  TYR  22           HE1      TYR  22   2.587   3.679   5.538
  167    HE2  TYR  22           HE2      TYR  22  -0.373   0.567   5.490
  168    HH   TYR  22           HH       TYR  22  -0.146   2.776   7.007
  169    H    MET  23           H        MET  23   3.627  -1.107   1.022
  170    HA   MET  23           HA       MET  23   5.688  -3.082   0.486
  171    HB2  MET  23           HB2      MET  23   3.077  -2.200  -0.729
  172    HB3  MET  23           HB3      MET  23   4.091  -3.358  -1.589
  173    HG2  MET  23           HG2      MET  23   4.045  -4.263   1.072
  174    HG3  MET  23           HG3      MET  23   2.385  -3.786   0.717
  175    HE1  MET  23           HE1      MET  23   1.970  -7.390   0.399
  176    HE2  MET  23           HE2      MET  23   2.440  -6.134   1.542
  177    HE3  MET  23           HE3      MET  23   3.652  -7.258   0.931
  178    H    TYR  24           H        TYR  24   4.656  -0.059  -1.103
  179    HA   TYR  24           HA       TYR  24   6.888  -0.316  -3.072
  180    HB2  TYR  24           HB2      TYR  24   4.191   0.802  -2.981
  181    HB3  TYR  24           HB3      TYR  24   5.353   1.972  -3.599
  182    HD1  TYR  24           HD1      TYR  24   6.867   1.308  -5.525
  183    HD2  TYR  24           HD2      TYR  24   3.503  -1.062  -4.290
  184    HE1  TYR  24           HE1      TYR  24   6.900   0.124  -7.704
  185    HE2  TYR  24           HE2      TYR  24   3.537  -2.245  -6.469
  186    HH   TYR  24           HH       TYR  24   5.803  -2.567  -8.350
  187    H    GLY  25           H        GLY  25   7.769   0.212  -0.480
  188    HA2  GLY  25           HA2      GLY  25   9.295   2.599  -0.789
  189    HA3  GLY  25           HA3      GLY  25   7.929   2.954   0.269
  190    H    LEU  26           H        LEU  26   7.657   0.720   1.791
  191    HA   LEU  26           HA       LEU  26  10.149   0.749   3.410
  192    HB2  LEU  26           HB2      LEU  26   7.636   1.137   4.113
  193    HB3  LEU  26           HB3      LEU  26   7.578  -0.624   4.144
  194    HG   LEU  26           HG       LEU  26   9.936  -0.090   5.476
  195   HD11  LEU  26          HD11      LEU  26   7.932   1.831   6.639
  196   HD12  LEU  26          HD12      LEU  26   9.052   2.369   5.388
  197   HD13  LEU  26          HD13      LEU  26   9.671   1.742   6.915
  198   HD21  LEU  26          HD21      LEU  26   7.836  -1.582   5.978
  199   HD22  LEU  26          HD22      LEU  26   7.323  -0.213   6.963
  200   HD23  LEU  26          HD23      LEU  26   8.842  -1.035   7.320
  201    H    SER  27           H        SER  27   9.718  -0.962   0.843
  202    HA   SER  27           HA       SER  27   9.479  -3.718   1.570
  203    HB2  SER  27           HB2      SER  27   9.250  -3.069  -0.710
  204    HB3  SER  27           HB3      SER  27  10.784  -2.208  -0.704
  205    HG   SER  27           HG       SER  27  11.840  -4.064  -0.892
  206    HA   PRO  28           HA       PRO  28  14.273  -3.801   1.838
  207    HB2  PRO  28           HB2      PRO  28  15.606  -1.423   2.057
  208    HB3  PRO  28           HB3      PRO  28  15.259  -2.200   0.500
  209    HG2  PRO  28           HG2      PRO  28  13.871   0.064   1.837
  210    HG3  PRO  28           HG3      PRO  28  14.225  -0.191   0.121
  211    HD2  PRO  28           HD2      PRO  28  11.776  -0.617   1.247
  212    HD3  PRO  28           HD3      PRO  28  12.353  -1.453  -0.210
  213    H    ALA  29           H        ALA  29  12.205  -1.810   3.702
  214    HA   ALA  29           HA       ALA  29  14.002  -1.838   6.077
  215    HB1  ALA  29           HB1      ALA  29  13.060   0.224   6.174
  216    HB2  ALA  29           HB2      ALA  29  11.600  -0.593   6.731
  217    HB3  ALA  29           HB3      ALA  29  11.802  -0.217   5.020
  218    H    ILE  30           H        ILE  30  10.663  -2.795   5.157
  219    HA   ILE  30           HA       ILE  30  10.005  -4.114   7.600
  220    HB   ILE  30           HB       ILE  30   8.514  -3.349   5.677
  221   HG12  ILE  30          HG12      ILE  30   8.011  -6.224   6.466
  222   HG13  ILE  30          HG13      ILE  30   7.876  -4.905   7.629
  223   HG21  ILE  30          HG21      ILE  30   9.029  -6.076   4.504
  224   HG22  ILE  30          HG22      ILE  30  10.002  -4.693   4.004
  225   HG23  ILE  30          HG23      ILE  30   8.256  -4.679   3.758
  226   HD11  ILE  30          HD11      ILE  30   6.257  -3.776   6.093
  227   HD12  ILE  30          HD12      ILE  30   5.679  -5.339   6.670
  228   HD13  ILE  30          HD13      ILE  30   6.328  -5.187   5.037
  229    H    THR  31           H        THR  31  11.928  -5.195   4.873
  230    HA   THR  31           HA       THR  31  11.752  -8.033   5.369
  231    HB   THR  31           HB       THR  31  12.530  -6.763   3.281
  232    HG1  THR  31           HG1      THR  31  13.445  -8.568   2.706
  233   HG21  THR  31          HG21      THR  31  14.763  -5.991   3.137
  234   HG22  THR  31          HG22      THR  31  15.224  -6.789   4.641
  235   HG23  THR  31          HG23      THR  31  14.183  -5.365   4.681
  236    H    LYS  32           H        LYS  32  13.718  -5.455   6.761
  237    HA   LYS  32           HA       LYS  32  15.232  -7.484   8.370
  238    HB2  LYS  32           HB2      LYS  32  16.164  -5.502   6.769
  239    HB3  LYS  32           HB3      LYS  32  16.029  -4.616   8.288
  240    HG2  LYS  32           HG2      LYS  32  17.439  -6.219   9.426
  241    HG3  LYS  32           HG3      LYS  32  17.446  -7.281   8.019
  242    HD2  LYS  32           HD2      LYS  32  18.303  -4.572   7.344
  243    HD3  LYS  32           HD3      LYS  32  19.326  -5.299   8.583
  244    HE2  LYS  32           HE2      LYS  32  18.655  -7.151   6.386
  245    HE3  LYS  32           HE3      LYS  32  19.618  -5.749   5.880
  246    HZ1  LYS  32           HZ1      LYS  32  21.160  -6.166   7.674
  247    HZ2  LYS  32           HZ2      LYS  32  21.016  -7.568   6.725
  248    HZ3  LYS  32           HZ3      LYS  32  20.229  -7.473   8.228
  249    H    TYR  33           H        TYR  33  12.433  -6.156   8.802
  250    HA   TYR  33           HA       TYR  33  12.983  -5.078  11.551
  251    HB2  TYR  33           HB2      TYR  33  11.400  -4.142   9.255
  252    HB3  TYR  33           HB3      TYR  33  10.496  -4.142  10.770
  253    HD1  TYR  33           HD1      TYR  33  13.748  -3.056   9.271
  254    HD2  TYR  33           HD2      TYR  33  10.822  -2.437  12.354
  255    HE1  TYR  33           HE1      TYR  33  14.936  -1.000   9.985
  256    HE2  TYR  33           HE2      TYR  33  12.011  -0.381  13.071
  257    HH   TYR  33           HH       TYR  33  14.981   0.319  12.485
  258    H    VAL  34           H        VAL  34  10.575  -6.827   9.545
  259    HA   VAL  34           HA       VAL  34   8.915  -7.698  11.723
  260    HB   VAL  34           HB       VAL  34   9.456  -8.830   8.953
  261   HG11  VAL  34          HG11      VAL  34   7.293  -9.434  10.987
  262   HG12  VAL  34          HG12      VAL  34   8.416 -10.571  10.242
  263   HG13  VAL  34          HG13      VAL  34   7.140  -9.830   9.275
  264   HG21  VAL  34          HG21      VAL  34   7.301  -6.982  10.038
  265   HG22  VAL  34          HG22      VAL  34   7.338  -7.635   8.400
  266   HG23  VAL  34          HG23      VAL  34   8.601  -6.527   8.936
  267    H    VAL  35           H        VAL  35  11.877  -9.008  10.298
  268    HA   VAL  35           HA       VAL  35  11.707 -11.457  11.979
  269    HB   VAL  35           HB       VAL  35  13.815 -10.599   9.965
  270   HG11  VAL  35          HG11      VAL  35  13.346 -13.403  10.011
  271   HG12  VAL  35          HG12      VAL  35  13.475 -12.878  11.690
  272   HG13  VAL  35          HG13      VAL  35  14.784 -12.542  10.558
  273   HG21  VAL  35          HG21      VAL  35  11.203 -12.090   9.556
  274   HG22  VAL  35          HG22      VAL  35  12.512 -12.076   8.374
  275   HG23  VAL  35          HG23      VAL  35  11.694 -10.574   8.799
  276    H    ARG  36           H        ARG  36  11.916  -9.331  13.627
  277    HA   ARG  36           HA       ARG  36  13.196  -8.442  15.389
  278    HB2  ARG  36           HB2      ARG  36  13.906 -11.037  15.074
  279    HB3  ARG  36           HB3      ARG  36  15.465 -10.272  14.766
  280    HG2  ARG  36           HG2      ARG  36  14.680  -8.875  16.958
  281    HG3  ARG  36           HG3      ARG  36  13.894 -10.421  17.279
  282    HD2  ARG  36           HD2      ARG  36  15.931 -11.020  18.140
  283    HD3  ARG  36           HD3      ARG  36  16.401 -11.224  16.440
  284    HE   ARG  36           HE       ARG  36  16.690  -8.567  17.791
  285   HH11  ARG  36          HH11      ARG  36  17.484  -8.647  14.981
  286   HH12  ARG  36          HH12      ARG  36  19.175  -9.026  15.047
  287   HH21  ARG  36          HH21      ARG  36  19.057 -10.176  18.326
  288   HH22  ARG  36          HH22      ARG  36  20.068  -9.895  16.949
  Start of MODEL   23
    1    HA   SER   1           HA       SER   1 -11.379  -4.347  12.421
    2    HB2  SER   1           HB2      SER   1 -13.190  -4.162  14.848
    3    HB3  SER   1           HB3      SER   1 -11.856  -5.284  14.603
    4    HG   SER   1           HG       SER   1 -11.346  -3.422  15.918
    5    H    ASP   2           H        ASP   2 -13.117  -4.176  10.468
    6    HA   ASP   2           HA       ASP   2 -15.168  -6.286  11.015
    7    HB2  ASP   2           HB2      ASP   2 -15.521  -3.647   9.549
    8    HB3  ASP   2           HB3      ASP   2 -16.745  -4.913   9.641
    9    H    LEU   3           H        LEU   3 -15.920  -7.314   8.957
   10    HA   LEU   3           HA       LEU   3 -14.158  -6.954   6.590
   11    HB2  LEU   3           HB2      LEU   3 -13.280  -8.620   8.411
   12    HB3  LEU   3           HB3      LEU   3 -14.542  -9.687   7.796
   13    HG   LEU   3           HG       LEU   3 -13.528  -9.077   5.449
   14   HD11  LEU   3          HD11      LEU   3 -11.102  -8.688   7.222
   15   HD12  LEU   3          HD12      LEU   3 -11.995  -7.348   6.504
   16   HD13  LEU   3          HD13      LEU   3 -11.186  -8.524   5.469
   17   HD21  LEU   3          HD21      LEU   3 -12.030 -10.877   7.382
   18   HD22  LEU   3          HD22      LEU   3 -12.029 -11.008   5.624
   19   HD23  LEU   3          HD23      LEU   3 -13.509 -11.323   6.531
   20    HA   PRO   4           HA       PRO   4 -18.514  -8.340   5.676
   21    HB2  PRO   4           HB2      PRO   4 -19.698  -5.928   5.136
   22    HB3  PRO   4           HB3      PRO   4 -19.627  -6.627   6.762
   23    HG2  PRO   4           HG2      PRO   4 -18.174  -4.349   5.650
   24    HG3  PRO   4           HG3      PRO   4 -18.476  -4.782   7.337
   25    HD2  PRO   4           HD2      PRO   4 -16.089  -5.183   5.799
   26    HD3  PRO   4           HD3      PRO   4 -16.378  -5.583   7.504
   27    H    ALA   5           H        ALA   5 -19.764  -6.718   3.548
   28    HA   ALA   5           HA       ALA   5 -17.691  -6.884   1.386
   29    HB1  ALA   5           HB1      ALA   5 -18.891  -8.808   0.947
   30    HB2  ALA   5           HB2      ALA   5 -19.936  -7.659   0.110
   31    HB3  ALA   5           HB3      ALA   5 -20.348  -8.201   1.736
   32    H    LEU   6           H        LEU   6 -21.054  -5.771   2.026
   33    HA   LEU   6           HA       LEU   6 -21.062  -3.753  -0.024
   34    HB2  LEU   6           HB2      LEU   6 -22.839  -4.924   1.786
   35    HB3  LEU   6           HB3      LEU   6 -22.772  -3.236   2.293
   36    HG   LEU   6           HG       LEU   6 -23.069  -2.670  -0.211
   37   HD11  LEU   6          HD11      LEU   6 -23.965  -5.570  -0.172
   38   HD12  LEU   6          HD12      LEU   6 -22.614  -4.910  -1.094
   39   HD13  LEU   6          HD13      LEU   6 -24.266  -4.439  -1.491
   40   HD21  LEU   6          HD21      LEU   6 -25.301  -4.018   1.346
   41   HD22  LEU   6          HD22      LEU   6 -25.535  -2.941  -0.031
   42   HD23  LEU   6          HD23      LEU   6 -24.833  -2.322   1.464
   43    H    SER   7           H        SER   7 -20.153  -3.679   3.418
   44    HA   SER   7           HA       SER   7 -19.683  -0.753   3.323
   45    HB2  SER   7           HB2      SER   7 -19.748  -2.935   5.381
   46    HB3  SER   7           HB3      SER   7 -18.902  -1.439   5.765
   47    HG   SER   7           HG       SER   7 -20.822  -0.700   6.184
   48    H    THR   8           H        THR   8 -17.969  -2.982   1.882
   49    HA   THR   8           HA       THR   8 -15.320  -2.162   3.026
   50    HB   THR   8           HB       THR   8 -16.014  -4.574   1.314
   51    HG1  THR   8           HG1      THR   8 -15.823  -4.287   4.131
   52   HG21  THR   8          HG21      THR   8 -13.853  -5.335   2.640
   53   HG22  THR   8          HG22      THR   8 -13.578  -3.597   2.760
   54   HG23  THR   8          HG23      THR   8 -13.708  -4.363   1.176
   55    H    GLY   9           H        GLY   9 -16.587  -0.355   1.308
   56    HA2  GLY   9           HA2      GLY   9 -15.325  -0.794  -1.359
   57    HA3  GLY   9           HA3      GLY   9 -16.606   0.375  -1.023
   58    H    LEU  10           H        LEU  10 -16.016   2.200   0.449
   59    HA   LEU  10           HA       LEU  10 -13.605   3.523  -0.383
   60    HB2  LEU  10           HB2      LEU  10 -15.877   3.943   1.470
   61    HB3  LEU  10           HB3      LEU  10 -14.403   4.802   1.912
   62    HG   LEU  10           HG       LEU  10 -14.393   5.403  -0.682
   63   HD11  LEU  10          HD11      LEU  10 -16.368   4.075  -1.244
   64   HD12  LEU  10          HD12      LEU  10 -16.734   5.787  -1.453
   65   HD13  LEU  10          HD13      LEU  10 -17.318   4.928  -0.028
   66   HD21  LEU  10          HD21      LEU  10 -14.431   7.085   1.058
   67   HD22  LEU  10          HD22      LEU  10 -16.105   6.701   1.459
   68   HD23  LEU  10          HD23      LEU  10 -15.720   7.467  -0.082
   69    H    LEU  11           H        LEU  11 -14.459   1.755   2.604
   70    HA   LEU  11           HA       LEU  11 -12.111   2.264   4.126
   71    HB2  LEU  11           HB2      LEU  11 -14.315   1.139   4.774
   72    HB3  LEU  11           HB3      LEU  11 -13.689  -0.325   4.016
   73    HG   LEU  11           HG       LEU  11 -11.735   0.869   5.823
   74   HD11  LEU  11          HD11      LEU  11 -13.712   1.634   7.046
   75   HD12  LEU  11          HD12      LEU  11 -12.962   0.293   7.911
   76   HD13  LEU  11          HD13      LEU  11 -14.419   0.020   6.956
   77   HD21  LEU  11          HD21      LEU  11 -11.724  -1.455   4.885
   78   HD22  LEU  11          HD22      LEU  11 -13.154  -1.815   5.855
   79   HD23  LEU  11          HD23      LEU  11 -11.626  -1.424   6.646
   80    H    HIS  12           H        HIS  12 -12.817  -0.389   1.823
   81    HA   HIS  12           HA       HIS  12 -10.301  -1.742   2.039
   82    HB2  HIS  12           HB2      HIS  12 -12.320  -2.716   1.045
   83    HB3  HIS  12           HB3      HIS  12 -12.319  -1.490  -0.222
   84    HD1  HIS  12           HD1      HIS  12  -9.544  -3.772   1.104
   85    HD2  HIS  12           HD2      HIS  12 -11.385  -2.739  -2.492
   86    HE1  HIS  12           HE1      HIS  12  -8.310  -5.023  -0.719
   87    H    LEU  13           H        LEU  13 -11.415   0.906  -0.078
   88    HA   LEU  13           HA       LEU  13  -9.113   1.078  -1.769
   89    HB2  LEU  13           HB2      LEU  13 -11.462   2.172  -1.895
   90    HB3  LEU  13           HB3      LEU  13 -10.789   3.414  -0.837
   91    HG   LEU  13           HG       LEU  13  -8.836   3.457  -2.599
   92   HD11  LEU  13          HD11      LEU  13 -11.123   2.135  -4.070
   93   HD12  LEU  13          HD12      LEU  13  -9.436   1.624  -3.990
   94   HD13  LEU  13          HD13      LEU  13  -9.880   3.060  -4.914
   95   HD21  LEU  13          HD21      LEU  13 -11.572   4.595  -3.262
   96   HD22  LEU  13          HD22      LEU  13 -10.020   5.218  -3.822
   97   HD23  LEU  13          HD23      LEU  13 -10.440   5.306  -2.112
   98    H    HIS  14           H        HIS  14  -9.847   2.592   1.385
   99    HA   HIS  14           HA       HIS  14  -7.577   4.318   1.563
  100    HB2  HIS  14           HB2      HIS  14  -9.374   4.606   3.093
  101    HB3  HIS  14           HB3      HIS  14  -9.379   2.902   3.538
  102    HD1  HIS  14           HD1      HIS  14  -8.681   2.846   5.950
  103    HD2  HIS  14           HD2      HIS  14  -6.292   5.430   3.713
  104    HE1  HIS  14           HE1      HIS  14  -6.838   3.641   7.494
  105    H    GLN  15           H        GLN  15  -8.032   1.018   2.917
  106    HA   GLN  15           HA       GLN  15  -5.412   0.648   3.940
  107    HB2  GLN  15           HB2      GLN  15  -7.750  -0.767   3.813
  108    HB3  GLN  15           HB3      GLN  15  -6.747  -1.686   2.692
  109    HG2  GLN  15           HG2      GLN  15  -6.176  -2.716   4.693
  110    HG3  GLN  15           HG3      GLN  15  -4.946  -1.453   4.626
  111   HE21  GLN  15          HE21      GLN  15  -5.262   0.467   6.020
  112   HE22  GLN  15          HE22      GLN  15  -6.330   0.409   7.337
  113    H    ASN  16           H        ASN  16  -6.678   0.148   0.647
  114    HA   ASN  16           HA       ASN  16  -4.359  -1.138  -0.457
  115    HB2  ASN  16           HB2      ASN  16  -6.795  -0.805  -1.335
  116    HB3  ASN  16           HB3      ASN  16  -6.194   0.732  -1.957
  117   HD21  ASN  16          HD21      ASN  16  -4.096   0.515  -3.341
  118   HD22  ASN  16          HD22      ASN  16  -3.982  -0.850  -4.343
  119    H    ILE  17           H        ILE  17  -5.350   2.318  -0.430
  120    HA   ILE  17           HA       ILE  17  -2.975   3.280  -1.769
  121    HB   ILE  17           HB       ILE  17  -5.087   4.552   0.004
  122   HG12  ILE  17          HG12      ILE  17  -4.676   4.891  -2.971
  123   HG13  ILE  17          HG13      ILE  17  -5.618   3.547  -2.325
  124   HG21  ILE  17          HG21      ILE  17  -4.261   6.721  -0.969
  125   HG22  ILE  17          HG22      ILE  17  -2.870   5.847  -1.612
  126   HG23  ILE  17          HG23      ILE  17  -3.113   5.958   0.131
  127   HD11  ILE  17          HD11      ILE  17  -7.393   4.923  -2.178
  128   HD12  ILE  17          HD12      ILE  17  -6.409   6.299  -2.677
  129   HD13  ILE  17          HD13      ILE  17  -6.517   5.864  -0.970
  130    H    VAL  18           H        VAL  18  -3.839   2.860   1.665
  131    HA   VAL  18           HA       VAL  18  -1.439   4.167   2.670
  132    HB   VAL  18           HB       VAL  18  -3.657   2.452   3.792
  133   HG11  VAL  18          HG11      VAL  18  -1.709   1.835   5.108
  134   HG12  VAL  18          HG12      VAL  18  -2.700   2.941   6.059
  135   HG13  VAL  18          HG13      VAL  18  -1.235   3.527   5.270
  136   HG21  VAL  18          HG21      VAL  18  -2.791   5.340   3.973
  137   HG22  VAL  18          HG22      VAL  18  -3.925   4.645   5.130
  138   HG23  VAL  18          HG23      VAL  18  -4.334   4.692   3.415
  139    H    ASP  19           H        ASP  19  -2.165   0.980   1.492
  140    HA   ASP  19           HA       ASP  19   0.358  -0.093   2.685
  141    HB2  ASP  19           HB2      ASP  19  -2.128  -1.095   2.788
  142    HB3  ASP  19           HB3      ASP  19  -1.634  -1.796   1.247
  143    H    VAL  20           H        VAL  20  -0.069   1.641   0.099
  144    HA   VAL  20           HA       VAL  20   1.282  -0.271  -1.774
  145    HB   VAL  20           HB       VAL  20  -1.055   0.693  -2.296
  146   HG11  VAL  20          HG11      VAL  20  -1.219   2.923  -3.076
  147   HG12  VAL  20          HG12      VAL  20   0.532   3.115  -3.147
  148   HG13  VAL  20          HG13      VAL  20  -0.285   3.047  -1.587
  149   HG21  VAL  20          HG21      VAL  20   1.349   0.787  -4.101
  150   HG22  VAL  20          HG22      VAL  20  -0.241   1.235  -4.718
  151   HG23  VAL  20          HG23      VAL  20   0.029  -0.383  -4.072
  152    H    GLN  21           H        GLN  21   1.346   2.994  -0.414
  153    HA   GLN  21           HA       GLN  21   3.768   3.722  -1.941
  154    HB2  GLN  21           HB2      GLN  21   1.725   5.011  -0.236
  155    HB3  GLN  21           HB3      GLN  21   3.349   5.681  -0.060
  156    HG2  GLN  21           HG2      GLN  21   3.484   5.906  -2.544
  157    HG3  GLN  21           HG3      GLN  21   1.814   5.353  -2.655
  158   HE21  GLN  21          HE21      GLN  21   0.134   6.761  -1.601
  159   HE22  GLN  21          HE22      GLN  21   0.444   8.418  -1.405
  160    H    TYR  22           H        TYR  22   2.864   2.781   1.368
  161    HA   TYR  22           HA       TYR  22   5.363   3.348   2.645
  162    HB2  TYR  22           HB2      TYR  22   4.323   2.355   4.454
  163    HB3  TYR  22           HB3      TYR  22   2.906   2.574   3.434
  164    HD1  TYR  22           HD1      TYR  22   2.218   0.630   1.896
  165    HD2  TYR  22           HD2      TYR  22   4.997   0.200   5.141
  166    HE1  TYR  22           HE1      TYR  22   1.845  -1.820   1.891
  167    HE2  TYR  22           HE2      TYR  22   4.622  -2.251   5.133
  168    HH   TYR  22           HH       TYR  22   2.049  -3.714   3.539
  169    H    MET  23           H        MET  23   4.326   0.650   0.616
  170    HA   MET  23           HA       MET  23   6.713  -0.969   1.277
  171    HB2  MET  23           HB2      MET  23   4.149  -1.559   0.634
  172    HB3  MET  23           HB3      MET  23   4.881  -1.652  -0.967
  173    HG2  MET  23           HG2      MET  23   6.535  -3.254  -0.163
  174    HG3  MET  23           HG3      MET  23   5.923  -3.103   1.484
  175    HE1  MET  23           HE1      MET  23   4.857  -4.059  -2.240
  176    HE2  MET  23           HE2      MET  23   4.538  -5.747  -1.852
  177    HE3  MET  23           HE3      MET  23   6.105  -5.043  -1.464
  178    H    TYR  24           H        TYR  24   6.193   1.675  -0.719
  179    HA   TYR  24           HA       TYR  24   8.016   0.660  -2.866
  180    HB2  TYR  24           HB2      TYR  24   5.617   2.214  -2.788
  181    HB3  TYR  24           HB3      TYR  24   6.906   3.253  -3.393
  182    HD1  TYR  24           HD1      TYR  24   8.417   2.316  -5.266
  183    HD2  TYR  24           HD2      TYR  24   4.625   0.603  -4.196
  184    HE1  TYR  24           HE1      TYR  24   8.315   1.172  -7.463
  185    HE2  TYR  24           HE2      TYR  24   4.523  -0.540  -6.394
  186    HH   TYR  24           HH       TYR  24   6.765  -1.257  -8.199
  187    H    GLY  25           H        GLY  25   8.719   1.764  -0.040
  188    HA2  GLY  25           HA2      GLY  25  10.533   3.954  -0.981
  189    HA3  GLY  25           HA3      GLY  25   9.862   3.897   0.648
  190    H    LEU  26           H        LEU  26  10.699   0.794  -0.522
  191    HA   LEU  26           HA       LEU  26  13.434   0.912   0.674
  192    HB2  LEU  26           HB2      LEU  26  11.040  -0.737   1.484
  193    HB3  LEU  26           HB3      LEU  26  12.673  -1.304   1.821
  194    HG   LEU  26           HG       LEU  26  12.780   1.322   2.664
  195   HD11  LEU  26          HD11      LEU  26  10.624   2.015   2.854
  196   HD12  LEU  26          HD12      LEU  26  10.582   0.981   4.282
  197   HD13  LEU  26          HD13      LEU  26   9.988   0.374   2.736
  198   HD21  LEU  26          HD21      LEU  26  12.139  -1.228   4.173
  199   HD22  LEU  26          HD22      LEU  26  12.568   0.286   4.971
  200   HD23  LEU  26          HD23      LEU  26  13.729  -0.512   3.909
  201    H    SER  27           H        SER  27  13.547   0.800  -1.879
  202    HA   SER  27           HA       SER  27  12.890  -1.537  -3.342
  203    HB2  SER  27           HB2      SER  27  14.151   0.898  -3.772
  204    HB3  SER  27           HB3      SER  27  15.427  -0.274  -4.092
  205    HG   SER  27           HG       SER  27  13.517   0.405  -5.703
  206    HA   PRO  28           HA       PRO  28  17.245  -3.293  -2.349
  207    HB2  PRO  28           HB2      PRO  28  18.671  -2.164  -0.304
  208    HB3  PRO  28           HB3      PRO  28  18.808  -1.636  -1.992
  209    HG2  PRO  28           HG2      PRO  28  17.279  -0.420   0.253
  210    HG3  PRO  28           HG3      PRO  28  18.202   0.363  -1.039
  211    HD2  PRO  28           HD2      PRO  28  15.489   0.166  -1.046
  212    HD3  PRO  28           HD3      PRO  28  16.468   0.250  -2.528
  213    H    ALA  29           H        ALA  29  14.943  -2.343   0.026
  214    HA   ALA  29           HA       ALA  29  15.766  -4.476   1.933
  215    HB1  ALA  29           HB1      ALA  29  13.347  -2.909   2.493
  216    HB2  ALA  29           HB2      ALA  29  14.763  -1.901   2.190
  217    HB3  ALA  29           HB3      ALA  29  14.800  -3.111   3.472
  218    H    ILE  30           H        ILE  30  13.007  -3.510  -0.129
  219    HA   ILE  30           HA       ILE  30  11.335  -5.756   0.601
  220    HB   ILE  30           HB       ILE  30  10.716  -3.472  -0.405
  221   HG12  ILE  30          HG12      ILE  30   8.898  -4.590  -1.881
  222   HG13  ILE  30          HG13      ILE  30   9.628  -6.113  -1.375
  223   HG21  ILE  30          HG21      ILE  30  11.332  -4.908  -3.002
  224   HG22  ILE  30          HG22      ILE  30  12.380  -3.678  -2.297
  225   HG23  ILE  30          HG23      ILE  30  10.746  -3.255  -2.807
  226   HD11  ILE  30          HD11      ILE  30   9.032  -5.816   0.855
  227   HD12  ILE  30          HD12      ILE  30   7.664  -5.059   0.039
  228   HD13  ILE  30          HD13      ILE  30   8.955  -4.061   0.708
  229    H    THR  31           H        THR  31  13.929  -5.340  -1.706
  230    HA   THR  31           HA       THR  31  13.312  -7.487  -3.512
  231    HB   THR  31           HB       THR  31  15.933  -7.355  -3.743
  232    HG1  THR  31           HG1      THR  31  16.617  -6.319  -2.010
  233   HG21  THR  31          HG21      THR  31  14.638  -6.340  -5.430
  234   HG22  THR  31          HG22      THR  31  15.628  -5.017  -4.815
  235   HG23  THR  31          HG23      THR  31  13.944  -5.165  -4.314
  236    H    LYS  32           H        LYS  32  15.216  -7.376  -0.492
  237    HA   LYS  32           HA       LYS  32  15.644 -10.313  -0.588
  238    HB2  LYS  32           HB2      LYS  32  17.308  -8.383   0.070
  239    HB3  LYS  32           HB3      LYS  32  16.478  -8.446   1.625
  240    HG2  LYS  32           HG2      LYS  32  18.221  -9.974   1.944
  241    HG3  LYS  32           HG3      LYS  32  16.895 -11.027   1.449
  242    HD2  LYS  32           HD2      LYS  32  17.895 -10.401  -0.983
  243    HD3  LYS  32           HD3      LYS  32  19.368 -10.274  -0.023
  244    HE2  LYS  32           HE2      LYS  32  17.531 -12.685   0.148
  245    HE3  LYS  32           HE3      LYS  32  18.901 -12.600  -0.978
  246    HZ1  LYS  32           HZ1      LYS  32  19.610 -13.570   1.111
  247    HZ2  LYS  32           HZ2      LYS  32  19.035 -12.224   1.971
  248    HZ3  LYS  32           HZ3      LYS  32  20.348 -12.058   0.905
  249    H    TYR  33           H        TYR  33  12.927  -9.006  -0.106
  250    HA   TYR  33           HA       TYR  33  12.349 -10.232   2.570
  251    HB2  TYR  33           HB2      TYR  33  12.270  -7.640   2.139
  252    HB3  TYR  33           HB3      TYR  33  10.753  -8.005   1.318
  253    HD1  TYR  33           HD1      TYR  33   8.838  -8.931   2.548
  254    HD2  TYR  33           HD2      TYR  33  12.509  -7.925   4.539
  255    HE1  TYR  33           HE1      TYR  33   7.686  -9.063   4.740
  256    HE2  TYR  33           HE2      TYR  33  11.357  -8.057   6.731
  257    HH   TYR  33           HH       TYR  33   8.448  -7.774   7.297
  258    H    VAL  34           H        VAL  34  10.901  -9.356  -0.599
  259    HA   VAL  34           HA       VAL  34   8.681 -11.245  -0.248
  260    HB   VAL  34           HB       VAL  34   9.659  -9.573  -2.590
  261   HG11  VAL  34          HG11      VAL  34   7.153  -9.888  -3.238
  262   HG12  VAL  34          HG12      VAL  34   7.219 -11.289  -2.168
  263   HG13  VAL  34          HG13      VAL  34   8.280 -11.202  -3.574
  264   HG21  VAL  34          HG21      VAL  34   7.470  -9.112  -0.535
  265   HG22  VAL  34          HG22      VAL  34   7.785  -8.075  -1.926
  266   HG23  VAL  34          HG23      VAL  34   8.990  -8.223  -0.647
  267    H    VAL  35           H        VAL  35   9.382 -13.381  -0.268
  268    HA   VAL  35           HA       VAL  35  10.860 -14.292  -2.712
  269    HB   VAL  35           HB       VAL  35  12.224 -14.029  -0.568
  270   HG11  VAL  35          HG11      VAL  35  10.628 -16.470   0.265
  271   HG12  VAL  35          HG12      VAL  35  10.435 -14.861   0.960
  272   HG13  VAL  35          HG13      VAL  35  11.955 -15.729   1.158
  273   HG21  VAL  35          HG21      VAL  35  13.484 -16.032  -0.973
  274   HG22  VAL  35          HG22      VAL  35  12.782 -15.559  -2.520
  275   HG23  VAL  35          HG23      VAL  35  12.064 -16.874  -1.592
  276    H    ARG  36           H        ARG  36   7.921 -14.370  -1.662
  277    HA   ARG  36           HA       ARG  36   7.440 -17.187  -2.443
  278    HB2  ARG  36           HB2      ARG  36   7.840 -16.866   0.114
  279    HB3  ARG  36           HB3      ARG  36   6.242 -16.120   0.113
  280    HG2  ARG  36           HG2      ARG  36   6.040 -18.516  -1.408
  281    HG3  ARG  36           HG3      ARG  36   6.910 -18.916   0.073
  282    HD2  ARG  36           HD2      ARG  36   4.545 -19.166   0.546
  283    HD3  ARG  36           HD3      ARG  36   5.070 -17.671   1.344
  284    HE   ARG  36           HE       ARG  36   3.943 -17.538  -1.422
  285   HH11  ARG  36          HH11      ARG  36   1.902 -17.777   0.813
  286   HH12  ARG  36          HH12      ARG  36   1.561 -16.112   1.147
  287   HH21  ARG  36          HH21      ARG  36   4.374 -14.931  -0.520
  288   HH22  ARG  36          HH22      ARG  36   2.967 -14.495   0.392
  Start of MODEL   24
    1    HA   SER   1           HA       SER   1 -23.856 -10.366  -5.738
    2    HB2  SER   1           HB2      SER   1 -25.392  -8.252  -5.737
    3    HB3  SER   1           HB3      SER   1 -25.276  -9.202  -7.215
    4    HG   SER   1           HG       SER   1 -27.457  -8.659  -6.508
    5    H    ASP   2           H        ASP   2 -23.241  -9.064  -3.909
    6    HA   ASP   2           HA       ASP   2 -24.988  -9.204  -1.490
    7    HB2  ASP   2           HB2      ASP   2 -23.329 -11.150  -1.703
    8    HB3  ASP   2           HB3      ASP   2 -22.052  -9.954  -1.479
    9    H    LEU   3           H        LEU   3 -24.881  -7.317  -0.309
   10    HA   LEU   3           HA       LEU   3 -23.032  -5.190  -1.239
   11    HB2  LEU   3           HB2      LEU   3 -25.703  -5.387  -0.183
   12    HB3  LEU   3           HB3      LEU   3 -24.761  -4.317   0.851
   13    HG   LEU   3           HG       LEU   3 -25.844  -3.065  -0.986
   14   HD11  LEU   3          HD11      LEU   3 -22.854  -3.232  -1.441
   15   HD12  LEU   3          HD12      LEU   3 -23.583  -2.408  -0.063
   16   HD13  LEU   3          HD13      LEU   3 -23.901  -1.836  -1.701
   17   HD21  LEU   3          HD21      LEU   3 -25.310  -3.482  -3.290
   18   HD22  LEU   3          HD22      LEU   3 -25.756  -5.039  -2.592
   19   HD23  LEU   3          HD23      LEU   3 -24.058  -4.646  -2.854
   20    HA   PRO   4           HA       PRO   4 -21.753  -5.384   3.307
   21    HB2  PRO   4           HB2      PRO   4 -23.099  -6.964   5.082
   22    HB3  PRO   4           HB3      PRO   4 -23.624  -5.322   4.667
   23    HG2  PRO   4           HG2      PRO   4 -24.756  -7.916   3.863
   24    HG3  PRO   4           HG3      PRO   4 -25.533  -6.336   4.004
   25    HD2  PRO   4           HD2      PRO   4 -24.680  -7.607   1.632
   26    HD3  PRO   4           HD3      PRO   4 -25.269  -5.942   1.803
   27    H    ALA   5           H        ALA   5 -20.576  -6.966   1.514
   28    HA   ALA   5           HA       ALA   5 -20.375  -9.770   2.385
   29    HB1  ALA   5           HB1      ALA   5 -20.284  -8.871   0.003
   30    HB2  ALA   5           HB2      ALA   5 -18.976  -9.974   0.435
   31    HB3  ALA   5           HB3      ALA   5 -18.685  -8.235   0.390
   32    H    LEU   6           H        LEU   6 -18.031  -7.045   2.119
   33    HA   LEU   6           HA       LEU   6 -16.703  -7.979   4.606
   34    HB2  LEU   6           HB2      LEU   6 -15.879  -9.117   2.382
   35    HB3  LEU   6           HB3      LEU   6 -15.048  -7.582   2.127
   36    HG   LEU   6           HG       LEU   6 -14.279  -7.957   4.638
   37   HD11  LEU   6          HD11      LEU   6 -14.575 -10.810   3.668
   38   HD12  LEU   6          HD12      LEU   6 -15.729 -10.051   4.766
   39   HD13  LEU   6          HD13      LEU   6 -14.047 -10.259   5.257
   40   HD21  LEU   6          HD21      LEU   6 -12.720  -7.774   2.791
   41   HD22  LEU   6          HD22      LEU   6 -13.149  -9.383   2.210
   42   HD23  LEU   6          HD23      LEU   6 -12.280  -9.198   3.733
   43    H    SER   7           H        SER   7 -18.096  -5.445   3.443
   44    HA   SER   7           HA       SER   7 -17.769  -3.101   3.463
   45    HB2  SER   7           HB2      SER   7 -16.097  -4.233   5.709
   46    HB3  SER   7           HB3      SER   7 -16.259  -2.495   5.478
   47    HG   SER   7           HG       SER   7 -17.864  -3.264   6.878
   48    H    THR   8           H        THR   8 -16.246  -4.229   1.396
   49    HA   THR   8           HA       THR   8 -13.526  -3.017   1.632
   50    HB   THR   8           HB       THR   8 -13.260  -4.366  -0.555
   51    HG1  THR   8           HG1      THR   8 -14.946  -5.391  -1.246
   52   HG21  THR   8          HG21      THR   8 -13.474  -5.264   2.221
   53   HG22  THR   8          HG22      THR   8 -12.242  -5.632   1.013
   54   HG23  THR   8          HG23      THR   8 -13.735  -6.570   1.064
   55    H    GLY   9           H        GLY   9 -15.882  -1.292   1.287
   56    HA2  GLY   9           HA2      GLY   9 -15.741  -0.438  -1.548
   57    HA3  GLY   9           HA3      GLY   9 -16.854   0.196  -0.332
   58    H    LEU  10           H        LEU  10 -16.044   1.733   1.219
   59    HA   LEU  10           HA       LEU  10 -13.929   3.471   0.156
   60    HB2  LEU  10           HB2      LEU  10 -16.176   4.067   1.320
   61    HB3  LEU  10           HB3      LEU  10 -15.332   3.697   2.824
   62    HG   LEU  10           HG       LEU  10 -13.503   5.309   1.989
   63   HD11  LEU  10          HD11      LEU  10 -14.104   5.549  -0.315
   64   HD12  LEU  10          HD12      LEU  10 -14.494   7.091   0.449
   65   HD13  LEU  10          HD13      LEU  10 -15.777   5.935   0.091
   66   HD21  LEU  10          HD21      LEU  10 -16.265   6.400   2.622
   67   HD22  LEU  10          HD22      LEU  10 -14.743   7.264   2.838
   68   HD23  LEU  10          HD23      LEU  10 -15.092   5.838   3.814
   69    H    LEU  11           H        LEU  11 -14.307   1.153   2.816
   70    HA   LEU  11           HA       LEU  11 -11.995   1.820   4.353
   71    HB2  LEU  11           HB2      LEU  11 -14.050   0.108   4.594
   72    HB3  LEU  11           HB3      LEU  11 -12.843  -1.029   3.992
   73    HG   LEU  11           HG       LEU  11 -12.110   0.843   6.226
   74   HD11  LEU  11          HD11      LEU  11 -13.415  -1.847   6.690
   75   HD12  LEU  11          HD12      LEU  11 -14.324  -0.336   6.740
   76   HD13  LEU  11          HD13      LEU  11 -13.013  -0.615   7.886
   77   HD21  LEU  11          HD21      LEU  11 -10.662  -1.082   6.827
   78   HD22  LEU  11          HD22      LEU  11 -10.374  -0.549   5.171
   79   HD23  LEU  11          HD23      LEU  11 -11.334  -1.997   5.477
   80    H    HIS  12           H        HIS  12 -12.378  -0.642   1.763
   81    HA   HIS  12           HA       HIS  12  -9.617  -1.424   1.675
   82    HB2  HIS  12           HB2      HIS  12 -11.689  -2.595   0.749
   83    HB3  HIS  12           HB3      HIS  12 -11.626  -1.455  -0.596
   84    HD1  HIS  12           HD1      HIS  12  -9.610  -4.226   1.018
   85    HD2  HIS  12           HD2      HIS  12  -9.648  -2.006  -2.511
   86    HE1  HIS  12           HE1      HIS  12  -7.904  -5.294  -0.520
   87    H    LEU  13           H        LEU  13 -11.454   1.087  -0.078
   88    HA   LEU  13           HA       LEU  13  -9.543   1.844  -2.021
   89    HB2  LEU  13           HB2      LEU  13 -11.910   2.642  -1.760
   90    HB3  LEU  13           HB3      LEU  13 -11.388   3.631  -0.397
   91    HG   LEU  13           HG       LEU  13  -9.766   3.968  -2.843
   92   HD11  LEU  13          HD11      LEU  13 -12.146   3.658  -3.694
   93   HD12  LEU  13          HD12      LEU  13 -11.397   5.205  -4.089
   94   HD13  LEU  13          HD13      LEU  13 -12.572   5.103  -2.777
   95   HD21  LEU  13          HD21      LEU  13  -9.380   5.976  -1.864
   96   HD22  LEU  13          HD22      LEU  13 -10.224   5.325  -0.460
   97   HD23  LEU  13          HD23      LEU  13 -11.102   6.288  -1.648
   98    H    HIS  14           H        HIS  14  -9.781   2.796   1.410
   99    HA   HIS  14           HA       HIS  14  -7.515   4.641   1.281
  100    HB2  HIS  14           HB2      HIS  14  -9.275   5.024   2.877
  101    HB3  HIS  14           HB3      HIS  14  -9.173   3.371   3.480
  102    HD1  HIS  14           HD1      HIS  14  -7.319   6.660   3.546
  103    HD2  HIS  14           HD2      HIS  14  -7.148   2.927   5.390
  104    HE1  HIS  14           HE1      HIS  14  -5.652   6.872   5.444
  105    H    GLN  15           H        GLN  15  -8.047   1.417   2.772
  106    HA   GLN  15           HA       GLN  15  -5.392   0.967   3.685
  107    HB2  GLN  15           HB2      GLN  15  -7.881  -0.407   3.453
  108    HB3  GLN  15           HB3      GLN  15  -6.638  -1.469   2.793
  109    HG2  GLN  15           HG2      GLN  15  -6.641  -1.977   5.099
  110    HG3  GLN  15           HG3      GLN  15  -5.279  -0.873   4.915
  111   HE21  GLN  15          HE21      GLN  15  -5.339   1.063   6.123
  112   HE22  GLN  15          HE22      GLN  15  -6.682   1.580   7.022
  113    H    ASN  16           H        ASN  16  -6.910   0.020   0.573
  114    HA   ASN  16           HA       ASN  16  -4.737  -1.344  -0.605
  115    HB2  ASN  16           HB2      ASN  16  -7.117  -1.073  -1.420
  116    HB3  ASN  16           HB3      ASN  16  -6.679   0.542  -1.977
  117   HD21  ASN  16          HD21      ASN  16  -5.068   0.690  -3.749
  118   HD22  ASN  16          HD22      ASN  16  -4.774  -0.647  -4.750
  119    H    ILE  17           H        ILE  17  -5.277   2.165  -0.316
  120    HA   ILE  17           HA       ILE  17  -2.955   2.801  -2.027
  121    HB   ILE  17           HB       ILE  17  -4.839   4.460  -0.311
  122   HG12  ILE  17          HG12      ILE  17  -5.871   3.262  -2.253
  123   HG13  ILE  17          HG13      ILE  17  -5.923   5.015  -2.427
  124   HG21  ILE  17          HG21      ILE  17  -2.928   5.817  -0.548
  125   HG22  ILE  17          HG22      ILE  17  -3.945   6.311  -1.902
  126   HG23  ILE  17          HG23      ILE  17  -2.589   5.216  -2.171
  127   HD11  ILE  17          HD11      ILE  17  -3.666   3.383  -3.600
  128   HD12  ILE  17          HD12      ILE  17  -4.163   5.023  -4.017
  129   HD13  ILE  17          HD13      ILE  17  -5.169   3.652  -4.483
  130    H    VAL  18           H        VAL  18  -3.827   3.083   1.434
  131    HA   VAL  18           HA       VAL  18  -1.347   4.192   2.339
  132    HB   VAL  18           HB       VAL  18  -3.538   2.543   3.625
  133   HG11  VAL  18          HG11      VAL  18  -1.270   4.016   5.000
  134   HG12  VAL  18          HG12      VAL  18  -1.431   2.263   4.905
  135   HG13  VAL  18          HG13      VAL  18  -2.618   3.210   5.801
  136   HG21  VAL  18          HG21      VAL  18  -3.572   5.112   2.711
  137   HG22  VAL  18          HG22      VAL  18  -3.024   5.363   4.368
  138   HG23  VAL  18          HG23      VAL  18  -4.552   4.540   4.059
  139    H    ASP  19           H        ASP  19  -2.421   0.831   1.941
  140    HA   ASP  19           HA       ASP  19  -0.094  -0.382   3.166
  141    HB2  ASP  19           HB2      ASP  19  -2.431  -1.222   1.494
  142    HB3  ASP  19           HB3      ASP  19  -1.083  -2.345   1.651
  143    H    VAL  20           H        VAL  20  -0.522   1.138   0.093
  144    HA   VAL  20           HA       VAL  20   1.741  -0.407  -1.089
  145    HB   VAL  20           HB       VAL  20  -0.285   1.542  -2.235
  146   HG11  VAL  20          HG11      VAL  20   1.981  -0.001  -3.524
  147   HG12  VAL  20          HG12      VAL  20   1.725   1.745  -3.540
  148   HG13  VAL  20          HG13      VAL  20   0.639   0.686  -4.440
  149   HG21  VAL  20          HG21      VAL  20   0.066  -1.438  -2.691
  150   HG22  VAL  20          HG22      VAL  20  -1.255  -0.425  -3.271
  151   HG23  VAL  20          HG23      VAL  20  -1.089  -0.753  -1.547
  152    H    GLN  21           H        GLN  21   1.211   2.419   0.673
  153    HA   GLN  21           HA       GLN  21   3.439   3.916  -0.637
  154    HB2  GLN  21           HB2      GLN  21   1.347   4.627   1.452
  155    HB3  GLN  21           HB3      GLN  21   2.574   5.749   0.867
  156    HG2  GLN  21           HG2      GLN  21   1.032   4.372  -1.252
  157    HG3  GLN  21           HG3      GLN  21   0.097   5.484  -0.255
  158   HE21  GLN  21          HE21      GLN  21   0.027   6.745  -2.421
  159   HE22  GLN  21          HE22      GLN  21   1.318   7.798  -2.747
  160    H    TYR  22           H        TYR  22   2.437   2.489   2.480
  161    HA   TYR  22           HA       TYR  22   4.719   3.334   4.013
  162    HB2  TYR  22           HB2      TYR  22   3.715   2.050   5.672
  163    HB3  TYR  22           HB3      TYR  22   2.347   2.231   4.578
  164    HD1  TYR  22           HD1      TYR  22   5.061  -0.070   5.661
  165    HD2  TYR  22           HD2      TYR  22   1.453   0.366   3.381
  166    HE1  TYR  22           HE1      TYR  22   4.924  -2.531   5.404
  167    HE2  TYR  22           HE2      TYR  22   1.314  -2.095   3.123
  168    HH   TYR  22           HH       TYR  22   2.242  -4.147   4.556
  169    H    MET  23           H        MET  23   4.193   0.649   1.784
  170    HA   MET  23           HA       MET  23   6.749  -0.658   2.530
  171    HB2  MET  23           HB2      MET  23   4.233  -1.425   1.486
  172    HB3  MET  23           HB3      MET  23   5.397  -1.709   0.192
  173    HG2  MET  23           HG2      MET  23   6.125  -2.580   2.962
  174    HG3  MET  23           HG3      MET  23   4.957  -3.547   2.063
  175    HE1  MET  23           HE1      MET  23   6.696  -5.151  -0.740
  176    HE2  MET  23           HE2      MET  23   5.696  -3.710  -0.897
  177    HE3  MET  23           HE3      MET  23   5.277  -4.938   0.295
  178    H    TYR  24           H        TYR  24   5.360   1.277  -0.108
  179    HA   TYR  24           HA       TYR  24   7.939   1.085  -1.612
  180    HB2  TYR  24           HB2      TYR  24   5.115   1.924  -2.323
  181    HB3  TYR  24           HB3      TYR  24   6.469   2.087  -3.434
  182    HD1  TYR  24           HD1      TYR  24   7.665   0.071  -4.268
  183    HD2  TYR  24           HD2      TYR  24   4.161  -0.235  -1.802
  184    HE1  TYR  24           HE1      TYR  24   7.422  -2.314  -4.907
  185    HE2  TYR  24           HE2      TYR  24   3.918  -2.617  -2.441
  186    HH   TYR  24           HH       TYR  24   4.889  -3.997  -4.791
  187    H    GLY  25           H        GLY  25   8.168   2.635   0.633
  188    HA2  GLY  25           HA2      GLY  25   9.225   5.059  -0.125
  189    HA3  GLY  25           HA3      GLY  25   7.516   5.436   0.100
  190    H    LEU  26           H        LEU  26   6.988   3.658   2.261
  191    HA   LEU  26           HA       LEU  26   7.141   3.506   4.606
  192    HB2  LEU  26           HB2      LEU  26   9.701   3.325   3.573
  193    HB3  LEU  26           HB3      LEU  26   9.860   4.618   4.761
  194    HG   LEU  26           HG       LEU  26   8.251   2.525   5.892
  195   HD11  LEU  26          HD11      LEU  26  10.751   1.670   4.455
  196   HD12  LEU  26          HD12      LEU  26   9.194   0.848   4.557
  197   HD13  LEU  26          HD13      LEU  26  10.276   0.865   5.951
  198   HD21  LEU  26          HD21      LEU  26   9.625   4.214   7.100
  199   HD22  LEU  26          HD22      LEU  26  11.085   3.430   6.497
  200   HD23  LEU  26          HD23      LEU  26  10.012   2.568   7.600
  201    H    SER  27           H        SER  27   6.337   6.071   3.230
  202    HA   SER  27           HA       SER  27   7.356   8.341   4.656
  203    HB2  SER  27           HB2      SER  27   4.638   8.777   3.944
  204    HB3  SER  27           HB3      SER  27   6.071   9.272   3.053
  205    HG   SER  27           HG       SER  27   4.526   7.861   1.928
  206    HA   PRO  28           HA       PRO  28   3.643   7.785   7.641
  207    HB2  PRO  28           HB2      PRO  28   2.256   5.430   7.582
  208    HB3  PRO  28           HB3      PRO  28   1.817   6.837   6.593
  209    HG2  PRO  28           HG2      PRO  28   3.279   4.365   5.827
  210    HG3  PRO  28           HG3      PRO  28   2.097   5.310   4.909
  211    HD2  PRO  28           HD2      PRO  28   4.797   5.431   4.503
  212    HD3  PRO  28           HD3      PRO  28   3.675   6.753   4.118
  213    H    ALA  29           H        ALA  29   6.022   5.429   6.971
  214    HA   ALA  29           HA       ALA  29   5.864   4.194   9.676
  215    HB1  ALA  29           HB1      ALA  29   7.227   3.612   7.056
  216    HB2  ALA  29           HB2      ALA  29   6.167   2.573   8.007
  217    HB3  ALA  29           HB3      ALA  29   7.825   2.861   8.537
  218    H    ILE  30           H        ILE  30   8.189   5.944   7.574
  219    HA   ILE  30           HA       ILE  30  10.318   6.126   9.470
  220    HB   ILE  30           HB       ILE  30  10.011   6.651   6.871
  221   HG12  ILE  30          HG12      ILE  30  12.154   6.488   8.144
  222   HG13  ILE  30          HG13      ILE  30  12.189   7.723   6.889
  223   HG21  ILE  30          HG21      ILE  30  10.053   9.054   6.405
  224   HG22  ILE  30          HG22      ILE  30   9.882   9.408   8.124
  225   HG23  ILE  30          HG23      ILE  30   8.565   8.625   7.251
  226   HD11  ILE  30          HD11      ILE  30  12.154   8.041   9.862
  227   HD12  ILE  30          HD12      ILE  30  11.361   9.280   8.887
  228   HD13  ILE  30          HD13      ILE  30  13.073   8.933   8.650
  229    H    THR  31           H        THR  31   7.412   8.071   9.038
  230    HA   THR  31           HA       THR  31   8.159  10.316  10.684
  231    HB   THR  31           HB       THR  31   5.554  10.448  10.817
  232    HG1  THR  31           HG1      THR  31   4.935   8.417  10.383
  233   HG21  THR  31          HG21      THR  31   5.431  11.152   8.450
  234   HG22  THR  31          HG22      THR  31   6.970  10.350   8.139
  235   HG23  THR  31          HG23      THR  31   6.903  11.740   9.222
  236    H    LYS  32           H        LYS  32   6.859   7.110  11.408
  237    HA   LYS  32           HA       LYS  32   6.528   7.827  14.287
  238    HB2  LYS  32           HB2      LYS  32   4.980   6.420  12.527
  239    HB3  LYS  32           HB3      LYS  32   5.906   5.109  13.262
  240    HG2  LYS  32           HG2      LYS  32   5.283   6.124  15.525
  241    HG3  LYS  32           HG3      LYS  32   4.129   7.128  14.646
  242    HD2  LYS  32           HD2      LYS  32   2.825   5.275  15.256
  243    HD3  LYS  32           HD3      LYS  32   3.320   4.871  13.613
  244    HE2  LYS  32           HE2      LYS  32   5.112   3.436  14.447
  245    HE3  LYS  32           HE3      LYS  32   4.765   3.926  16.118
  246    HZ1  LYS  32           HZ1      LYS  32   2.830   2.611  14.277
  247    HZ2  LYS  32           HZ2      LYS  32   2.526   3.064  15.887
  248    HZ3  LYS  32           HZ3      LYS  32   3.649   1.836  15.544
  249    H    TYR  33           H        TYR  33   9.151   7.197  12.647
  250    HA   TYR  33           HA       TYR  33  10.158   4.939  14.336
  251    HB2  TYR  33           HB2      TYR  33  10.440   5.785  11.577
  252    HB3  TYR  33           HB3      TYR  33  12.026   5.693  12.342
  253    HD1  TYR  33           HD1      TYR  33  12.309   3.544  13.948
  254    HD2  TYR  33           HD2      TYR  33   9.610   3.830  10.620
  255    HE1  TYR  33           HE1      TYR  33  12.247   1.071  13.786
  256    HE2  TYR  33           HE2      TYR  33   9.546   1.358  10.458
  257    HH   TYR  33           HH       TYR  33  11.457  -0.589  11.319
  258    H    VAL  34           H        VAL  34  10.766   8.305  13.376
  259    HA   VAL  34           HA       VAL  34  13.182   8.516  15.054
  260    HB   VAL  34           HB       VAL  34  11.551  10.585  13.527
  261   HG11  VAL  34          HG11      VAL  34  14.239  10.616  14.888
  262   HG12  VAL  34          HG12      VAL  34  12.947  11.814  14.961
  263   HG13  VAL  34          HG13      VAL  34  13.932  11.668  13.507
  264   HG21  VAL  34          HG21      VAL  34  13.387  10.286  11.812
  265   HG22  VAL  34          HG22      VAL  34  12.328   8.888  11.986
  266   HG23  VAL  34          HG23      VAL  34  13.929   8.877  12.725
  267    H    VAL  35           H        VAL  35  13.275  10.104  16.847
  268    HA   VAL  35           HA       VAL  35  12.477  11.037  18.860
  269    HB   VAL  35           HB       VAL  35   9.877  11.313  17.309
  270   HG11  VAL  35          HG11      VAL  35  11.145  12.718  19.661
  271   HG12  VAL  35          HG12      VAL  35   9.530  12.019  19.538
  272   HG13  VAL  35          HG13      VAL  35   9.911  13.514  18.684
  273   HG21  VAL  35          HG21      VAL  35  12.508  12.734  17.045
  274   HG22  VAL  35          HG22      VAL  35  11.025  13.671  16.864
  275   HG23  VAL  35          HG23      VAL  35  11.339  12.303  15.796
  276    H    ARG  36           H        ARG  36  12.574   8.381  19.064
  277    HA   ARG  36           HA       ARG  36  11.704   6.523  20.213
  278    HB2  ARG  36           HB2      ARG  36  10.941   8.892  21.498
  279    HB3  ARG  36           HB3      ARG  36   9.454   7.952  21.420
  280    HG2  ARG  36           HG2      ARG  36  12.108   6.955  22.503
  281    HG3  ARG  36           HG3      ARG  36  10.727   7.445  23.481
  282    HD2  ARG  36           HD2      ARG  36  10.708   5.167  21.460
  283    HD3  ARG  36           HD3      ARG  36  10.783   4.978  23.224
  284    HE   ARG  36           HE       ARG  36   8.465   6.138  21.732
  285   HH11  ARG  36          HH11      ARG  36   8.702   7.229  24.496
  286   HH12  ARG  36          HH12      ARG  36   7.778   6.098  25.425
  287   HH21  ARG  36          HH21      ARG  36   7.806   3.650  22.956
  288   HH22  ARG  36          HH22      ARG  36   7.268   4.062  24.550
  Start of MODEL   25
    1    HA   SER   1           HA       SER   1 -27.976 -15.167   5.771
    2    HB2  SER   1           HB2      SER   1 -26.449 -14.983   3.690
    3    HB3  SER   1           HB3      SER   1 -27.359 -16.479   3.887
    4    HG   SER   1           HG       SER   1 -27.409 -15.346   1.754
    5    H    ASP   2           H        ASP   2 -27.341 -13.243   6.636
    6    HA   ASP   2           HA       ASP   2 -27.774 -10.737   5.041
    7    HB2  ASP   2           HB2      ASP   2 -28.251  -9.673   7.177
    8    HB3  ASP   2           HB3      ASP   2 -29.219 -11.142   7.075
    9    H    LEU   3           H        LEU   3 -26.299  -8.986   6.568
   10    HA   LEU   3           HA       LEU   3 -24.090  -8.185   6.800
   11    HB2  LEU   3           HB2      LEU   3 -24.491  -9.892   8.668
   12    HB3  LEU   3           HB3      LEU   3 -23.553 -11.020   7.693
   13    HG   LEU   3           HG       LEU   3 -21.973  -8.749   7.675
   14   HD11  LEU   3          HD11      LEU   3 -21.837  -7.948   9.956
   15   HD12  LEU   3          HD12      LEU   3 -23.044  -9.119  10.487
   16   HD13  LEU   3          HD13      LEU   3 -23.510  -7.791   9.425
   17   HD21  LEU   3          HD21      LEU   3 -21.114 -10.992   7.958
   18   HD22  LEU   3          HD22      LEU   3 -21.949 -11.171   9.501
   19   HD23  LEU   3          HD23      LEU   3 -20.599 -10.045   9.354
   20    HA   PRO   4           HA       PRO   4 -22.559 -10.324   3.016
   21    HB2  PRO   4           HB2      PRO   4 -23.212  -8.385   1.192
   22    HB3  PRO   4           HB3      PRO   4 -24.332  -9.666   1.684
   23    HG2  PRO   4           HG2      PRO   4 -24.386  -6.818   2.310
   24    HG3  PRO   4           HG3      PRO   4 -25.673  -8.025   2.433
   25    HD2  PRO   4           HD2      PRO   4 -24.007  -6.955   4.525
   26    HD3  PRO   4           HD3      PRO   4 -25.369  -8.087   4.671
   27    H    ALA   5           H        ALA   5 -21.351  -8.580   1.087
   28    HA   ALA   5           HA       ALA   5 -19.145  -7.409   2.726
   29    HB1  ALA   5           HB1      ALA   5 -19.324  -8.162  -0.210
   30    HB2  ALA   5           HB2      ALA   5 -18.672  -9.196   1.063
   31    HB3  ALA   5           HB3      ALA   5 -17.857  -7.688   0.648
   32    H    LEU   6           H        LEU   6 -21.454  -5.832   2.618
   33    HA   LEU   6           HA       LEU   6 -20.930  -3.765   0.523
   34    HB2  LEU   6           HB2      LEU   6 -23.243  -4.773   2.084
   35    HB3  LEU   6           HB3      LEU   6 -23.225  -3.032   1.804
   36    HG   LEU   6           HG       LEU   6 -22.612  -3.777  -0.672
   37   HD11  LEU   6          HD11      LEU   6 -24.279  -6.110   0.311
   38   HD12  LEU   6          HD12      LEU   6 -22.542  -6.205   0.022
   39   HD13  LEU   6          HD13      LEU   6 -23.641  -5.867  -1.315
   40   HD21  LEU   6          HD21      LEU   6 -25.093  -3.817  -1.150
   41   HD22  LEU   6          HD22      LEU   6 -24.574  -2.464  -0.145
   42   HD23  LEU   6          HD23      LEU   6 -25.367  -3.857   0.591
   43    H    SER   7           H        SER   7 -19.770  -4.345   3.527
   44    HA   SER   7           HA       SER   7 -20.031  -1.518   4.477
   45    HB2  SER   7           HB2      SER   7 -19.297  -4.134   5.830
   46    HB3  SER   7           HB3      SER   7 -19.240  -2.572   6.640
   47    HG   SER   7           HG       SER   7 -21.385  -2.457   6.597
   48    H    THR   8           H        THR   8 -18.233  -2.129   2.297
   49    HA   THR   8           HA       THR   8 -15.602  -1.633   3.635
   50    HB   THR   8           HB       THR   8 -16.232  -3.357   1.213
   51    HG1  THR   8           HG1      THR   8 -16.392  -4.826   2.678
   52   HG21  THR   8          HG21      THR   8 -13.681  -2.305   2.363
   53   HG22  THR   8          HG22      THR   8 -14.114  -2.601   0.680
   54   HG23  THR   8          HG23      THR   8 -13.693  -3.952   1.731
   55    H    GLY   9           H        GLY   9 -15.926  -1.785   0.158
   56    HA2  GLY   9           HA2      GLY   9 -15.644  -0.142  -1.490
   57    HA3  GLY   9           HA3      GLY   9 -16.679   0.860  -0.475
   58    H    LEU  10           H        LEU  10 -15.755   2.548   0.636
   59    HA   LEU  10           HA       LEU  10 -13.127   3.474  -0.026
   60    HB2  LEU  10           HB2      LEU  10 -15.408   4.490   1.096
   61    HB3  LEU  10           HB3      LEU  10 -14.358   4.390   2.510
   62    HG   LEU  10           HG       LEU  10 -12.579   5.487   0.910
   63   HD11  LEU  10          HD11      LEU  10 -13.457   6.822  -0.852
   64   HD12  LEU  10          HD12      LEU  10 -15.118   6.592  -0.305
   65   HD13  LEU  10          HD13      LEU  10 -14.238   5.254  -1.044
   66   HD21  LEU  10          HD21      LEU  10 -13.614   7.776   1.517
   67   HD22  LEU  10          HD22      LEU  10 -13.268   6.672   2.848
   68   HD23  LEU  10          HD23      LEU  10 -14.920   6.847   2.255
   69    H    LEU  11           H        LEU  11 -14.334   1.504   2.668
   70    HA   LEU  11           HA       LEU  11 -12.161   1.693   4.480
   71    HB2  LEU  11           HB2      LEU  11 -14.395  -0.117   3.859
   72    HB3  LEU  11           HB3      LEU  11 -13.026  -0.941   4.602
   73    HG   LEU  11           HG       LEU  11 -13.049   1.028   6.303
   74   HD11  LEU  11          HD11      LEU  11 -15.859   1.191   5.166
   75   HD12  LEU  11          HD12      LEU  11 -14.626   2.447   5.055
   76   HD13  LEU  11          HD13      LEU  11 -15.301   2.010   6.625
   77   HD21  LEU  11          HD21      LEU  11 -13.613  -1.157   7.067
   78   HD22  LEU  11          HD22      LEU  11 -15.116  -1.175   6.145
   79   HD23  LEU  11          HD23      LEU  11 -14.964  -0.139   7.564
   80    H    HIS  12           H        HIS  12 -12.557  -0.365   1.591
   81    HA   HIS  12           HA       HIS  12  -9.929  -1.649   1.981
   82    HB2  HIS  12           HB2      HIS  12 -12.365  -2.013   0.429
   83    HB3  HIS  12           HB3      HIS  12 -10.942  -2.165  -0.597
   84    HD1  HIS  12           HD1      HIS  12 -11.568  -3.276   3.011
   85    HD2  HIS  12           HD2      HIS  12 -10.341  -4.855  -0.649
   86    HE1  HIS  12           HE1      HIS  12 -10.985  -5.703   3.436
   87    H    LEU  13           H        LEU  13 -11.425   0.738  -0.213
   88    HA   LEU  13           HA       LEU  13  -9.268   1.172  -2.002
   89    HB2  LEU  13           HB2      LEU  13 -11.613   2.038  -2.151
   90    HB3  LEU  13           HB3      LEU  13 -11.245   3.172  -0.851
   91    HG   LEU  13           HG       LEU  13  -9.309   3.212  -3.079
   92   HD11  LEU  13          HD11      LEU  13 -12.103   4.307  -3.518
   93   HD12  LEU  13          HD12      LEU  13 -11.515   2.810  -4.242
   94   HD13  LEU  13          HD13      LEU  13 -10.752   4.346  -4.651
   95   HD21  LEU  13          HD21      LEU  13  -9.692   4.798  -1.006
   96   HD22  LEU  13          HD22      LEU  13 -10.917   5.532  -2.042
   97   HD23  LEU  13          HD23      LEU  13  -9.231   5.489  -2.562
   98    H    HIS  14           H        HIS  14  -9.952   2.701   1.161
   99    HA   HIS  14           HA       HIS  14  -7.722   4.512   1.173
  100    HB2  HIS  14           HB2      HIS  14  -9.571   4.844   2.661
  101    HB3  HIS  14           HB3      HIS  14  -9.454   3.201   3.288
  102    HD1  HIS  14           HD1      HIS  14  -7.530   6.482   3.317
  103    HD2  HIS  14           HD2      HIS  14  -7.741   2.918   5.471
  104    HE1  HIS  14           HE1      HIS  14  -6.062   6.788   5.360
  105    H    GLN  15           H        GLN  15  -8.122   1.278   2.702
  106    HA   GLN  15           HA       GLN  15  -5.453   1.066   3.718
  107    HB2  GLN  15           HB2      GLN  15  -7.798  -0.375   3.811
  108    HB3  GLN  15           HB3      GLN  15  -6.775  -1.418   2.823
  109    HG2  GLN  15           HG2      GLN  15  -6.136  -2.155   4.916
  110    HG3  GLN  15           HG3      GLN  15  -4.986  -0.832   4.720
  111   HE21  GLN  15          HE21      GLN  15  -5.609   1.298   5.752
  112   HE22  GLN  15          HE22      GLN  15  -6.626   1.284   7.110
  113    H    ASN  16           H        ASN  16  -6.870   0.219   0.569
  114    HA   ASN  16           HA       ASN  16  -4.719  -1.245  -0.568
  115    HB2  ASN  16           HB2      ASN  16  -6.823  -1.152  -1.682
  116    HB3  ASN  16           HB3      ASN  16  -6.856   0.610  -1.641
  117   HD21  ASN  16          HD21      ASN  16  -4.232  -1.633  -2.720
  118   HD22  ASN  16          HD22      ASN  16  -4.129  -0.984  -4.283
  119    H    ILE  17           H        ILE  17  -5.295   2.286  -0.484
  120    HA   ILE  17           HA       ILE  17  -2.786   2.893  -1.885
  121    HB   ILE  17           HB       ILE  17  -4.943   4.483  -0.461
  122   HG12  ILE  17          HG12      ILE  17  -5.534   3.457  -2.636
  123   HG13  ILE  17          HG13      ILE  17  -5.483   5.215  -2.755
  124   HG21  ILE  17          HG21      ILE  17  -3.046   5.865  -0.169
  125   HG22  ILE  17          HG22      ILE  17  -3.783   6.466  -1.654
  126   HG23  ILE  17          HG23      ILE  17  -2.368   5.417  -1.734
  127   HD11  ILE  17          HD11      ILE  17  -2.994   4.840  -3.480
  128   HD12  ILE  17          HD12      ILE  17  -4.279   4.555  -4.654
  129   HD13  ILE  17          HD13      ILE  17  -3.526   3.193  -3.823
  130    H    VAL  18           H        VAL  18  -3.978   2.905   1.462
  131    HA   VAL  18           HA       VAL  18  -1.697   4.172   2.671
  132    HB   VAL  18           HB       VAL  18  -3.914   2.345   3.617
  133   HG11  VAL  18          HG11      VAL  18  -2.138   1.918   5.175
  134   HG12  VAL  18          HG12      VAL  18  -3.210   3.090   5.943
  135   HG13  VAL  18          HG13      VAL  18  -1.690   3.625   5.226
  136   HG21  VAL  18          HG21      VAL  18  -3.395   5.220   4.363
  137   HG22  VAL  18          HG22      VAL  18  -4.913   4.326   4.411
  138   HG23  VAL  18          HG23      VAL  18  -4.226   4.809   2.861
  139    H    ASP  19           H        ASP  19  -2.214   0.917   1.518
  140    HA   ASP  19           HA       ASP  19   0.212  -0.031   2.984
  141    HB2  ASP  19           HB2      ASP  19  -2.292  -1.114   2.676
  142    HB3  ASP  19           HB3      ASP  19  -1.398  -1.932   1.395
  143    H    VAL  20           H        VAL  20  -0.267   1.498   0.152
  144    HA   VAL  20           HA       VAL  20   1.585  -0.295  -1.373
  145    HB   VAL  20           HB       VAL  20  -0.863   0.382  -2.125
  146   HG11  VAL  20          HG11      VAL  20  -0.976   2.400  -3.431
  147   HG12  VAL  20          HG12      VAL  20   0.749   2.699  -3.224
  148   HG13  VAL  20          HG13      VAL  20  -0.342   2.843  -1.846
  149   HG21  VAL  20          HG21      VAL  20   0.625  -0.969  -3.487
  150   HG22  VAL  20          HG22      VAL  20   1.584   0.447  -3.916
  151   HG23  VAL  20          HG23      VAL  20  -0.070   0.291  -4.507
  152    H    GLN  21           H        GLN  21   1.069   2.939  -0.128
  153    HA   GLN  21           HA       GLN  21   3.392   4.071  -1.561
  154    HB2  GLN  21           HB2      GLN  21   1.600   5.195   0.623
  155    HB3  GLN  21           HB3      GLN  21   2.690   6.125  -0.406
  156    HG2  GLN  21           HG2      GLN  21   1.375   5.161  -2.395
  157    HG3  GLN  21           HG3      GLN  21   0.172   4.657  -1.210
  158   HE21  GLN  21          HE21      GLN  21   1.323   7.344  -3.060
  159   HE22  GLN  21          HE22      GLN  21   0.331   8.526  -2.354
  160    H    TYR  22           H        TYR  22   2.504   3.117   1.768
  161    HA   TYR  22           HA       TYR  22   4.878   4.009   3.082
  162    HB2  TYR  22           HB2      TYR  22   3.926   2.934   4.898
  163    HB3  TYR  22           HB3      TYR  22   2.517   2.971   3.843
  164    HD1  TYR  22           HD1      TYR  22   1.866   0.949   2.553
  165    HD2  TYR  22           HD2      TYR  22   5.049   0.867   5.431
  166    HE1  TYR  22           HE1      TYR  22   1.765  -1.525   2.595
  167    HE2  TYR  22           HE2      TYR  22   4.947  -1.609   5.470
  168    HH   TYR  22           HH       TYR  22   2.366  -3.370   4.007
  169    H    MET  23           H        MET  23   4.254   1.163   1.098
  170    HA   MET  23           HA       MET  23   6.835  -0.086   1.875
  171    HB2  MET  23           HB2      MET  23   4.340  -1.049   1.303
  172    HB3  MET  23           HB3      MET  23   5.138  -1.245  -0.258
  173    HG2  MET  23           HG2      MET  23   7.032  -2.396   0.936
  174    HG3  MET  23           HG3      MET  23   6.068  -2.337   2.411
  175    HE1  MET  23           HE1      MET  23   5.526  -4.840  -1.341
  176    HE2  MET  23           HE2      MET  23   7.029  -4.645  -0.444
  177    HE3  MET  23           HE3      MET  23   6.277  -3.245  -1.204
  178    H    TYR  24           H        TYR  24   5.367   1.661  -0.835
  179    HA   TYR  24           HA       TYR  24   7.846   1.205  -2.460
  180    HB2  TYR  24           HB2      TYR  24   4.966   1.867  -3.074
  181    HB3  TYR  24           HB3      TYR  24   6.227   2.119  -4.276
  182    HD1  TYR  24           HD1      TYR  24   4.384  -0.394  -2.303
  183    HD2  TYR  24           HD2      TYR  24   7.414   0.240  -5.282
  184    HE1  TYR  24           HE1      TYR  24   4.314  -2.803  -2.887
  185    HE2  TYR  24           HE2      TYR  24   7.344  -2.169  -5.864
  186    HH   TYR  24           HH       TYR  24   6.398  -4.445  -4.163
  187    H    GLY  25           H        GLY  25   8.249   3.041  -0.465
  188    HA2  GLY  25           HA2      GLY  25   9.369   5.273  -1.405
  189    HA3  GLY  25           HA3      GLY  25   7.677   5.737  -1.568
  190    H    LEU  26           H        LEU  26   7.088   4.081   0.956
  191    HA   LEU  26           HA       LEU  26   6.858   4.508   3.257
  192    HB2  LEU  26           HB2      LEU  26   9.653   5.248   2.512
  193    HB3  LEU  26           HB3      LEU  26   9.090   5.746   4.106
  194    HG   LEU  26           HG       LEU  26   8.207   3.240   4.201
  195   HD11  LEU  26          HD11      LEU  26  10.489   3.178   2.204
  196   HD12  LEU  26          HD12      LEU  26   8.842   2.595   1.956
  197   HD13  LEU  26          HD13      LEU  26   9.914   1.757   3.079
  198   HD21  LEU  26          HD21      LEU  26  10.447   2.619   5.201
  199   HD22  LEU  26          HD22      LEU  26   9.779   4.134   5.805
  200   HD23  LEU  26          HD23      LEU  26  11.070   4.157   4.604
  201    H    SER  27           H        SER  27   5.667   6.433   1.473
  202    HA   SER  27           HA       SER  27   6.260   9.156   2.103
  203    HB2  SER  27           HB2      SER  27   4.106   7.573   0.866
  204    HB3  SER  27           HB3      SER  27   3.536   9.058   1.620
  205    HG   SER  27           HG       SER  27   4.631   8.861  -0.703
  206    HA   PRO  28           HA       PRO  28   3.134   8.830   5.671
  207    HB2  PRO  28           HB2      PRO  28   1.954   6.433   6.240
  208    HB3  PRO  28           HB3      PRO  28   1.294   7.572   5.053
  209    HG2  PRO  28           HG2      PRO  28   2.755   5.043   4.628
  210    HG3  PRO  28           HG3      PRO  28   1.530   5.826   3.622
  211    HD2  PRO  28           HD2      PRO  28   4.292   5.841   3.178
  212    HD3  PRO  28           HD3      PRO  28   3.093   6.888   2.391
  213    H    ALA  29           H        ALA  29   5.918   8.173   5.713
  214    HA   ALA  29           HA       ALA  29   6.105   6.624   8.266
  215    HB1  ALA  29           HB1      ALA  29   7.942   5.380   7.385
  216    HB2  ALA  29           HB2      ALA  29   8.128   6.477   6.017
  217    HB3  ALA  29           HB3      ALA  29   6.747   5.383   6.088
  218    H    ILE  30           H        ILE  30   8.020   8.653   5.997
  219    HA   ILE  30           HA       ILE  30   9.744   9.749   8.043
  220    HB   ILE  30           HB       ILE  30   8.991  10.557   5.215
  221   HG12  ILE  30          HG12      ILE  30  11.719   9.817   5.502
  222   HG13  ILE  30          HG13      ILE  30  10.778   8.615   6.384
  223   HG21  ILE  30          HG21      ILE  30  11.067  11.987   5.324
  224   HG22  ILE  30          HG22      ILE  30  11.089  11.725   7.068
  225   HG23  ILE  30          HG23      ILE  30   9.736  12.576   6.321
  226   HD11  ILE  30          HD11      ILE  30  11.206   8.393   3.759
  227   HD12  ILE  30          HD12      ILE  30   9.789   9.441   3.689
  228   HD13  ILE  30          HD13      ILE  30   9.688   7.874   4.491
  229    H    THR  31           H        THR  31   6.807  10.918   6.416
  230    HA   THR  31           HA       THR  31   6.673  13.471   7.752
  231    HB   THR  31           HB       THR  31   5.528  12.755   5.613
  232    HG1  THR  31           HG1      THR  31   4.406  14.440   6.096
  233   HG21  THR  31          HG21      THR  31   4.753  10.538   6.672
  234   HG22  THR  31          HG22      THR  31   3.591  11.388   5.654
  235   HG23  THR  31          HG23      THR  31   3.460  11.485   7.410
  236    H    LYS  32           H        LYS  32   5.692  10.215   8.663
  237    HA   LYS  32           HA       LYS  32   3.953  11.047  10.862
  238    HB2  LYS  32           HB2      LYS  32   5.238   8.439  10.002
  239    HB3  LYS  32           HB3      LYS  32   4.140   8.559  11.375
  240    HG2  LYS  32           HG2      LYS  32   3.316   9.642   8.690
  241    HG3  LYS  32           HG3      LYS  32   3.165   7.920   9.033
  242    HD2  LYS  32           HD2      LYS  32   1.173   8.432   9.973
  243    HD3  LYS  32           HD3      LYS  32   2.108   9.107  11.308
  244    HE2  LYS  32           HE2      LYS  32   1.932  11.318  10.474
  245    HE3  LYS  32           HE3      LYS  32   1.477  10.760   8.853
  246    HZ1  LYS  32           HZ1      LYS  32  -0.128  10.360  11.328
  247    HZ2  LYS  32           HZ2      LYS  32  -0.556   9.829   9.769
  248    HZ3  LYS  32           HZ3      LYS  32  -0.469  11.491  10.110
  249    H    TYR  33           H        TYR  33   7.337  10.144  10.450
  250    HA   TYR  33           HA       TYR  33   8.025   9.837  13.230
  251    HB2  TYR  33           HB2      TYR  33   9.351   9.033  11.289
  252    HB3  TYR  33           HB3      TYR  33   9.677  10.704  10.830
  253    HD1  TYR  33           HD1      TYR  33  10.094   8.264  13.635
  254    HD2  TYR  33           HD2      TYR  33  11.481  11.884  11.783
  255    HE1  TYR  33           HE1      TYR  33  12.026   8.319  15.187
  256    HE2  TYR  33           HE2      TYR  33  13.414  11.938  13.337
  257    HH   TYR  33           HH       TYR  33  13.614  10.503  16.070
  258    H    VAL  34           H        VAL  34   7.689  12.647  11.115
  259    HA   VAL  34           HA       VAL  34   9.114  14.583  12.667
  260    HB   VAL  34           HB       VAL  34   6.664  14.819  10.881
  261   HG11  VAL  34          HG11      VAL  34   7.582  17.182  10.567
  262   HG12  VAL  34          HG12      VAL  34   8.588  16.880  11.983
  263   HG13  VAL  34          HG13      VAL  34   6.831  16.854  12.127
  264   HG21  VAL  34          HG21      VAL  34   9.199  15.742   9.798
  265   HG22  VAL  34          HG22      VAL  34   8.073  14.560   9.133
  266   HG23  VAL  34          HG23      VAL  34   9.306  14.051  10.286
  267    H    VAL  35           H        VAL  35   5.933  13.122  13.093
  268    HA   VAL  35           HA       VAL  35   5.393  14.986  15.383
  269    HB   VAL  35           HB       VAL  35   3.376  13.194  14.016
  270   HG11  VAL  35          HG11      VAL  35   3.321  15.720  15.663
  271   HG12  VAL  35          HG12      VAL  35   2.476  14.200  15.952
  272   HG13  VAL  35          HG13      VAL  35   1.950  15.268  14.651
  273   HG21  VAL  35          HG21      VAL  35   4.477  15.846  13.064
  274   HG22  VAL  35          HG22      VAL  35   2.845  15.326  12.645
  275   HG23  VAL  35          HG23      VAL  35   4.234  14.366  12.136
  276    H    ARG  36           H        ARG  36   6.995  12.300  15.202
  277    HA   ARG  36           HA       ARG  36   5.849  11.145  17.673
  278    HB2  ARG  36           HB2      ARG  36   4.984  10.191  15.274
  279    HB3  ARG  36           HB3      ARG  36   6.403   9.173  15.517
  280    HG2  ARG  36           HG2      ARG  36   5.574   8.471  17.704
  281    HG3  ARG  36           HG3      ARG  36   4.195   9.562  17.560
  282    HD2  ARG  36           HD2      ARG  36   4.680   7.472  15.437
  283    HD3  ARG  36           HD3      ARG  36   3.838   7.046  16.940
  284    HE   ARG  36           HE       ARG  36   2.936   9.284  15.157
  285   HH11  ARG  36          HH11      ARG  36   1.617   6.590  14.884
  286   HH12  ARG  36          HH12      ARG  36   0.241   6.756  15.922
  287   HH21  ARG  36          HH21      ARG  36   1.493   9.557  17.558
  288   HH22  ARG  36          HH22      ARG  36   0.170   8.445  17.444
  Start of MODEL   26
    1    HA   SER   1           HA       SER   1 -24.710   2.018  -6.409
    2    HB2  SER   1           HB2      SER   1 -25.771   3.581  -4.672
    3    HB3  SER   1           HB3      SER   1 -26.302   2.125  -3.834
    4    HG   SER   1           HG       SER   1 -23.798   3.245  -4.052
    5    H    ASP   2           H        ASP   2 -23.751   0.171  -5.083
    6    HA   ASP   2           HA       ASP   2 -25.498  -2.257  -5.317
    7    HB2  ASP   2           HB2      ASP   2 -22.538  -1.705  -5.583
    8    HB3  ASP   2           HB3      ASP   2 -23.147  -3.347  -5.375
    9    H    LEU   3           H        LEU   3 -25.697  -0.637  -2.972
   10    HA   LEU   3           HA       LEU   3 -25.544  -0.742  -0.619
   11    HB2  LEU   3           HB2      LEU   3 -26.657  -2.901  -1.467
   12    HB3  LEU   3           HB3      LEU   3 -25.112  -3.685  -1.147
   13    HG   LEU   3           HG       LEU   3 -25.234  -2.834   1.211
   14   HD11  LEU   3          HD11      LEU   3 -27.730  -2.246   1.831
   15   HD12  LEU   3          HD12      LEU   3 -27.825  -1.762   0.138
   16   HD13  LEU   3          HD13      LEU   3 -26.659  -0.990   1.211
   17   HD21  LEU   3          HD21      LEU   3 -25.922  -5.112   0.781
   18   HD22  LEU   3          HD22      LEU   3 -27.492  -4.577   0.181
   19   HD23  LEU   3          HD23      LEU   3 -27.095  -4.405   1.891
   20    HA   PRO   4           HA       PRO   4 -20.963  -1.397  -0.557
   21    HB2  PRO   4           HB2      PRO   4 -20.125   1.177  -0.973
   22    HB3  PRO   4           HB3      PRO   4 -20.450   0.041  -2.294
   23    HG2  PRO   4           HG2      PRO   4 -21.956   2.393  -1.469
   24    HG3  PRO   4           HG3      PRO   4 -22.044   1.472  -2.974
   25    HD2  PRO   4           HD2      PRO   4 -23.793   1.354  -0.675
   26    HD3  PRO   4           HD3      PRO   4 -23.978   0.555  -2.253
   27    H    ALA   5           H        ALA   5 -19.420   0.574   0.725
   28    HA   ALA   5           HA       ALA   5 -18.968   1.573   2.811
   29    HB1  ALA   5           HB1      ALA   5 -20.666   2.898   3.656
   30    HB2  ALA   5           HB2      ALA   5 -21.893   1.652   3.432
   31    HB3  ALA   5           HB3      ALA   5 -21.311   2.575   2.046
   32    H    LEU   6           H        LEU   6 -20.346  -1.459   2.481
   33    HA   LEU   6           HA       LEU   6 -19.956  -2.033   5.395
   34    HB2  LEU   6           HB2      LEU   6 -22.371  -1.998   3.950
   35    HB3  LEU   6           HB3      LEU   6 -21.964  -3.706   4.127
   36    HG   LEU   6           HG       LEU   6 -21.434  -2.985   6.623
   37   HD11  LEU   6          HD11      LEU   6 -21.790  -0.622   6.422
   38   HD12  LEU   6          HD12      LEU   6 -23.176  -1.257   7.308
   39   HD13  LEU   6          HD13      LEU   6 -23.331  -0.858   5.597
   40   HD21  LEU   6          HD21      LEU   6 -23.640  -3.734   7.236
   41   HD22  LEU   6          HD22      LEU   6 -23.208  -4.581   5.750
   42   HD23  LEU   6          HD23      LEU   6 -24.310  -3.205   5.692
   43    H    SER   7           H        SER   7 -18.852  -2.676   2.330
   44    HA   SER   7           HA       SER   7 -17.741  -5.303   3.157
   45    HB2  SER   7           HB2      SER   7 -19.207  -4.746   0.550
   46    HB3  SER   7           HB3      SER   7 -18.422  -6.264   0.975
   47    HG   SER   7           HG       SER   7 -19.887  -6.462   2.699
   48    H    THR   8           H        THR   8 -15.885  -3.747   3.357
   49    HA   THR   8           HA       THR   8 -14.000  -2.571   2.540
   50    HB   THR   8           HB       THR   8 -12.818  -4.039   0.827
   51    HG1  THR   8           HG1      THR   8 -14.622  -4.868  -0.220
   52   HG21  THR   8          HG21      THR   8 -12.860  -4.332   3.392
   53   HG22  THR   8          HG22      THR   8 -12.335  -5.707   2.421
   54   HG23  THR   8          HG23      THR   8 -13.968  -5.669   3.084
   55    H    GLY   9           H        GLY   9 -16.171  -1.200   1.577
   56    HA2  GLY   9           HA2      GLY   9 -15.915  -0.944  -1.359
   57    HA3  GLY   9           HA3      GLY   9 -17.070  -0.079  -0.340
   58    H    LEU  10           H        LEU  10 -16.118   1.596   1.135
   59    HA   LEU  10           HA       LEU  10 -14.061   3.159  -0.322
   60    HB2  LEU  10           HB2      LEU  10 -14.818   4.972   1.132
   61    HB3  LEU  10           HB3      LEU  10 -16.224   4.143   0.470
   62    HG   LEU  10           HG       LEU  10 -15.650   2.745   2.827
   63   HD11  LEU  10          HD11      LEU  10 -15.527   4.493   4.547
   64   HD12  LEU  10          HD12      LEU  10 -15.461   5.737   3.299
   65   HD13  LEU  10          HD13      LEU  10 -14.128   4.596   3.479
   66   HD21  LEU  10          HD21      LEU  10 -17.866   3.441   1.806
   67   HD22  LEU  10          HD22      LEU  10 -17.615   5.032   2.522
   68   HD23  LEU  10          HD23      LEU  10 -17.774   3.613   3.559
   69    H    LEU  11           H        LEU  11 -14.411   1.249   2.607
   70    HA   LEU  11           HA       LEU  11 -12.145   2.284   4.064
   71    HB2  LEU  11           HB2      LEU  11 -14.207   0.388   4.379
   72    HB3  LEU  11           HB3      LEU  11 -12.712  -0.543   4.482
   73    HG   LEU  11           HG       LEU  11 -11.909   1.349   6.080
   74   HD11  LEU  11          HD11      LEU  11 -14.922   1.703   6.204
   75   HD12  LEU  11          HD12      LEU  11 -13.769   2.896   5.604
   76   HD13  LEU  11          HD13      LEU  11 -13.759   2.440   7.308
   77   HD21  LEU  11          HD21      LEU  11 -14.128  -0.539   6.936
   78   HD22  LEU  11          HD22      LEU  11 -12.917   0.181   7.996
   79   HD23  LEU  11          HD23      LEU  11 -12.430  -0.983   6.764
   80    H    HIS  12           H        HIS  12 -12.542  -0.426   1.762
   81    HA   HIS  12           HA       HIS  12  -9.862  -1.434   1.918
   82    HB2  HIS  12           HB2      HIS  12 -12.102  -2.310   0.824
   83    HB3  HIS  12           HB3      HIS  12 -11.504  -1.464  -0.603
   84    HD1  HIS  12           HD1      HIS  12 -11.091  -3.755  -1.819
   85    HD2  HIS  12           HD2      HIS  12  -8.852  -3.247   1.661
   86    HE1  HIS  12           HE1      HIS  12  -9.305  -5.550  -1.847
   87    H    LEU  13           H        LEU  13 -11.351   1.121  -0.079
   88    HA   LEU  13           HA       LEU  13  -9.216   1.621  -1.886
   89    HB2  LEU  13           HB2      LEU  13 -11.610   2.556  -1.782
   90    HB3  LEU  13           HB3      LEU  13 -10.993   3.714  -0.604
   91    HG   LEU  13           HG       LEU  13  -9.317   3.499  -3.009
   92   HD11  LEU  13          HD11      LEU  13 -10.852   4.643  -4.510
   93   HD12  LEU  13          HD12      LEU  13 -12.103   4.668  -3.267
   94   HD13  LEU  13          HD13      LEU  13 -11.599   3.135  -3.980
   95   HD21  LEU  13          HD21      LEU  13  -9.280   5.896  -2.788
   96   HD22  LEU  13          HD22      LEU  13  -9.213   5.234  -1.155
   97   HD23  LEU  13          HD23      LEU  13 -10.729   5.884  -1.781
   98    H    HIS  14           H        HIS  14  -9.794   2.891   1.409
   99    HA   HIS  14           HA       HIS  14  -7.506   4.642   1.506
  100    HB2  HIS  14           HB2      HIS  14  -9.245   4.976   3.091
  101    HB3  HIS  14           HB3      HIS  14  -9.307   3.266   3.511
  102    HD1  HIS  14           HD1      HIS  14  -8.612   3.215   5.930
  103    HD2  HIS  14           HD2      HIS  14  -6.073   5.596   3.634
  104    HE1  HIS  14           HE1      HIS  14  -6.695   3.889   7.441
  105    H    GLN  15           H        GLN  15  -8.013   1.359   2.878
  106    HA   GLN  15           HA       GLN  15  -5.359   0.916   3.798
  107    HB2  GLN  15           HB2      GLN  15  -7.701  -0.380   3.954
  108    HB3  GLN  15           HB3      GLN  15  -6.985  -1.316   2.642
  109    HG2  GLN  15           HG2      GLN  15  -6.422  -2.376   4.759
  110    HG3  GLN  15           HG3      GLN  15  -4.960  -1.674   4.067
  111   HE21  GLN  15          HE21      GLN  15  -3.806  -0.253   5.404
  112   HE22  GLN  15          HE22      GLN  15  -4.422   0.450   6.821
  113    H    ASN  16           H        ASN  16  -6.837   0.345   0.611
  114    HA   ASN  16           HA       ASN  16  -4.714  -1.083  -0.635
  115    HB2  ASN  16           HB2      ASN  16  -7.047  -0.731  -1.465
  116    HB3  ASN  16           HB3      ASN  16  -6.641   0.950  -1.809
  117   HD21  ASN  16          HD21      ASN  16  -5.407   1.398  -3.714
  118   HD22  ASN  16          HD22      ASN  16  -4.935   0.190  -4.809
  119    H    ILE  17           H        ILE  17  -5.275   2.445  -0.369
  120    HA   ILE  17           HA       ILE  17  -2.855   3.116  -1.882
  121    HB   ILE  17           HB       ILE  17  -4.867   4.660  -0.213
  122   HG12  ILE  17          HG12      ILE  17  -4.379   4.911  -3.175
  123   HG13  ILE  17          HG13      ILE  17  -5.352   3.577  -2.558
  124   HG21  ILE  17          HG21      ILE  17  -2.459   5.638  -1.772
  125   HG22  ILE  17          HG22      ILE  17  -2.835   5.934  -0.074
  126   HG23  ILE  17          HG23      ILE  17  -3.808   6.687  -1.337
  127   HD11  ILE  17          HD11      ILE  17  -6.424   5.679  -1.181
  128   HD12  ILE  17          HD12      ILE  17  -7.068   5.064  -2.703
  129   HD13  ILE  17          HD13      ILE  17  -5.986   6.458  -2.702
  130    H    VAL  18           H        VAL  18  -3.736   2.745   1.527
  131    HA   VAL  18           HA       VAL  18  -1.284   3.964   2.547
  132    HB   VAL  18           HB       VAL  18  -3.579   2.353   3.680
  133   HG11  VAL  18          HG11      VAL  18  -2.634   2.837   5.935
  134   HG12  VAL  18          HG12      VAL  18  -1.165   3.437   5.165
  135   HG13  VAL  18          HG13      VAL  18  -1.616   1.739   5.003
  136   HG21  VAL  18          HG21      VAL  18  -2.634   5.221   3.842
  137   HG22  VAL  18          HG22      VAL  18  -3.851   4.566   4.936
  138   HG23  VAL  18          HG23      VAL  18  -4.161   4.617   3.201
  139    H    ASP  19           H        ASP  19  -2.301   0.745   1.583
  140    HA   ASP  19           HA       ASP  19   0.077  -0.526   2.807
  141    HB2  ASP  19           HB2      ASP  19  -2.459  -1.377   1.458
  142    HB3  ASP  19           HB3      ASP  19  -1.114  -2.514   1.497
  143    H    VAL  20           H        VAL  20   0.024   1.424   0.306
  144    HA   VAL  20           HA       VAL  20   1.605  -0.377  -1.488
  145    HB   VAL  20           HB       VAL  20  -0.681   0.768  -2.161
  146   HG11  VAL  20          HG11      VAL  20  -0.508   2.980  -3.027
  147   HG12  VAL  20          HG12      VAL  20   1.248   2.984  -2.870
  148   HG13  VAL  20          HG13      VAL  20   0.235   3.042  -1.429
  149   HG21  VAL  20          HG21      VAL  20   1.529   1.207  -4.142
  150   HG22  VAL  20          HG22      VAL  20  -0.057   0.478  -4.383
  151   HG23  VAL  20          HG23      VAL  20   1.216  -0.430  -3.566
  152    H    GLN  21           H        GLN  21   1.481   2.755   0.136
  153    HA   GLN  21           HA       GLN  21   4.089   3.602  -0.976
  154    HB2  GLN  21           HB2      GLN  21   2.063   4.791   0.942
  155    HB3  GLN  21           HB3      GLN  21   3.579   5.595   0.536
  156    HG2  GLN  21           HG2      GLN  21   1.524   4.713  -1.512
  157    HG3  GLN  21           HG3      GLN  21   1.646   6.352  -0.875
  158   HE21  GLN  21          HE21      GLN  21   4.069   7.249  -1.048
  159   HE22  GLN  21          HE22      GLN  21   4.840   6.944  -2.529
  160    H    TYR  22           H        TYR  22   2.750   2.293   2.038
  161    HA   TYR  22           HA       TYR  22   4.950   2.857   3.770
  162    HB2  TYR  22           HB2      TYR  22   3.752   1.544   5.253
  163    HB3  TYR  22           HB3      TYR  22   2.489   1.822   4.059
  164    HD1  TYR  22           HD1      TYR  22   1.923   0.063   2.398
  165    HD2  TYR  22           HD2      TYR  22   4.761  -0.627   5.544
  166    HE1  TYR  22           HE1      TYR  22   1.747  -2.382   2.020
  167    HE2  TYR  22           HE2      TYR  22   4.586  -3.070   5.164
  168    HH   TYR  22           HH       TYR  22   3.805  -4.518   2.820
  169    H    MET  23           H        MET  23   4.508   0.388   1.295
  170    HA   MET  23           HA       MET  23   6.741  -1.297   2.127
  171    HB2  MET  23           HB2      MET  23   4.599  -1.745   0.662
  172    HB3  MET  23           HB3      MET  23   5.598  -1.131  -0.656
  173    HG2  MET  23           HG2      MET  23   7.383  -2.812   0.197
  174    HG3  MET  23           HG3      MET  23   6.042  -3.570   1.058
  175    HE1  MET  23           HE1      MET  23   7.732  -4.828  -2.270
  176    HE2  MET  23           HE2      MET  23   6.715  -5.993  -1.426
  177    HE3  MET  23           HE3      MET  23   7.751  -4.906  -0.503
  178    H    TYR  24           H        TYR  24   6.363   1.578   0.140
  179    HA   TYR  24           HA       TYR  24   9.197   1.347  -0.804
  180    HB2  TYR  24           HB2      TYR  24   6.669   2.635  -1.808
  181    HB3  TYR  24           HB3      TYR  24   8.228   3.256  -2.344
  182    HD1  TYR  24           HD1      TYR  24   9.745   1.882  -3.697
  183    HD2  TYR  24           HD2      TYR  24   5.923   0.390  -2.418
  184    HE1  TYR  24           HE1      TYR  24   9.928   0.018  -5.322
  185    HE2  TYR  24           HE2      TYR  24   6.107  -1.473  -4.043
  186    HH   TYR  24           HH       TYR  24   8.395  -2.673  -5.209
  187    H    GLY  25           H        GLY  25   8.340   2.284   1.919
  188    HA2  GLY  25           HA2      GLY  25  10.070   4.495   2.250
  189    HA3  GLY  25           HA3      GLY  25   8.437   5.142   2.079
  190    H    LEU  26           H        LEU  26  10.212   2.621   3.901
  191    HA   LEU  26           HA       LEU  26   8.273   2.978   6.149
  192    HB2  LEU  26           HB2      LEU  26   9.059   0.775   6.845
  193    HB3  LEU  26           HB3      LEU  26   8.640   0.728   5.136
  194    HG   LEU  26           HG       LEU  26  11.410   1.513   5.457
  195   HD11  LEU  26          HD11      LEU  26  12.260  -0.601   6.393
  196   HD12  LEU  26          HD12      LEU  26  10.607  -1.146   6.681
  197   HD13  LEU  26          HD13      LEU  26  11.248   0.236   7.570
  198   HD21  LEU  26          HD21      LEU  26  11.750  -0.188   3.822
  199   HD22  LEU  26          HD22      LEU  26  10.153   0.470   3.470
  200   HD23  LEU  26          HD23      LEU  26  10.303  -1.066   4.323
  201    H    SER  27           H        SER  27  10.994   4.486   5.334
  202    HA   SER  27           HA       SER  27  12.890   4.127   7.411
  203    HB2  SER  27           HB2      SER  27  12.150   6.154   5.408
  204    HB3  SER  27           HB3      SER  27  12.941   6.829   6.829
  205    HG   SER  27           HG       SER  27  14.593   6.213   5.563
  206    HA   PRO  28           HA       PRO  28  10.511   7.426   9.962
  207    HB2  PRO  28           HB2      PRO  28   7.945   8.025   9.215
  208    HB3  PRO  28           HB3      PRO  28   9.359   8.927   8.634
  209    HG2  PRO  28           HG2      PRO  28   7.786   6.793   7.277
  210    HG3  PRO  28           HG3      PRO  28   8.491   8.274   6.610
  211    HD2  PRO  28           HD2      PRO  28   9.618   5.822   6.304
  212    HD3  PRO  28           HD3      PRO  28  10.560   7.329   6.339
  213    H    ALA  29           H        ALA  29   8.739   4.773   8.491
  214    HA   ALA  29           HA       ALA  29   6.949   4.204  10.682
  215    HB1  ALA  29           HB1      ALA  29   6.803   3.448   8.265
  216    HB2  ALA  29           HB2      ALA  29   6.561   2.159   9.445
  217    HB3  ALA  29           HB3      ALA  29   8.107   2.313   8.610
  218    H    ILE  30           H        ILE  30  10.231   3.073   9.833
  219    HA   ILE  30           HA       ILE  30  10.336   1.276  12.163
  220    HB   ILE  30           HB       ILE  30  11.352   0.836   9.880
  221   HG12  ILE  30          HG12      ILE  30  13.616   0.094  10.912
  222   HG13  ILE  30          HG13      ILE  30  12.975   0.742  12.421
  223   HG21  ILE  30          HG21      ILE  30  13.618   1.877   9.513
  224   HG22  ILE  30          HG22      ILE  30  13.254   2.998  10.824
  225   HG23  ILE  30          HG23      ILE  30  12.273   3.005   9.359
  226   HD11  ILE  30          HD11      ILE  30  10.885  -0.695  11.930
  227   HD12  ILE  30          HD12      ILE  30  12.341  -1.538  12.456
  228   HD13  ILE  30          HD13      ILE  30  11.897  -1.528  10.750
  229    H    THR  31           H        THR  31  11.439   4.505  11.300
  230    HA   THR  31           HA       THR  31  13.298   4.793  13.527
  231    HB   THR  31           HB       THR  31  11.894   6.788  11.712
  232    HG1  THR  31           HG1      THR  31  13.222   5.682  10.444
  233   HG21  THR  31          HG21      THR  31  12.639   8.013  13.618
  234   HG22  THR  31          HG22      THR  31  13.887   8.239  12.393
  235   HG23  THR  31          HG23      THR  31  14.143   7.095  13.710
  236    H    LYS  32           H        LYS  32   9.872   5.622  12.965
  237    HA   LYS  32           HA       LYS  32   9.634   6.862  15.645
  238    HB2  LYS  32           HB2      LYS  32   7.746   6.361  13.325
  239    HB3  LYS  32           HB3      LYS  32   7.243   7.144  14.822
  240    HG2  LYS  32           HG2      LYS  32   9.381   8.658  14.333
  241    HG3  LYS  32           HG3      LYS  32   9.064   8.153  12.674
  242    HD2  LYS  32           HD2      LYS  32   6.825   9.195  14.399
  243    HD3  LYS  32           HD3      LYS  32   7.902  10.314  13.564
  244    HE2  LYS  32           HE2      LYS  32   7.306   9.405  11.404
  245    HE3  LYS  32           HE3      LYS  32   6.416   8.066  12.156
  246    HZ1  LYS  32           HZ1      LYS  32   5.787  10.958  12.477
  247    HZ2  LYS  32           HZ2      LYS  32   4.946   9.675  13.211
  248    HZ3  LYS  32           HZ3      LYS  32   4.912   9.863  11.523
  249    H    TYR  33           H        TYR  33  10.142   3.831  15.135
  250    HA   TYR  33           HA       TYR  33   7.746   2.761  16.580
  251    HB2  TYR  33           HB2      TYR  33   8.707   1.975  14.218
  252    HB3  TYR  33           HB3      TYR  33   9.810   1.051  15.236
  253    HD1  TYR  33           HD1      TYR  33   6.271   1.588  14.318
  254    HD2  TYR  33           HD2      TYR  33   9.025  -0.784  16.607
  255    HE1  TYR  33           HE1      TYR  33   4.491  -0.091  14.720
  256    HE2  TYR  33           HE2      TYR  33   7.244  -2.463  17.009
  257    HH   TYR  33           HH       TYR  33   4.312  -2.084  16.928
  258    H    VAL  34           H        VAL  34  11.315   2.476  16.376
  259    HA   VAL  34           HA       VAL  34  11.469   1.154  19.003
  260    HB   VAL  34           HB       VAL  34  13.554   2.212  17.055
  261   HG11  VAL  34          HG11      VAL  34  13.744   0.649  19.625
  262   HG12  VAL  34          HG12      VAL  34  14.706   2.029  19.096
  263   HG13  VAL  34          HG13      VAL  34  14.961   0.444  18.365
  264   HG21  VAL  34          HG21      VAL  34  13.727  -0.056  16.274
  265   HG22  VAL  34          HG22      VAL  34  12.009   0.344  16.275
  266   HG23  VAL  34          HG23      VAL  34  12.685  -0.646  17.569
  267    H    VAL  35           H        VAL  35  12.648   4.248  17.603
  268    HA   VAL  35           HA       VAL  35  13.229   6.287  18.634
  269    HB   VAL  35           HB       VAL  35  11.135   5.360  20.634
  270   HG11  VAL  35          HG11      VAL  35  10.686   7.985  20.277
  271   HG12  VAL  35          HG12      VAL  35  12.412   7.959  19.921
  272   HG13  VAL  35          HG13      VAL  35  11.824   7.385  21.482
  273   HG21  VAL  35          HG21      VAL  35  10.125   5.040  18.497
  274   HG22  VAL  35          HG22      VAL  35  10.877   6.493  17.838
  275   HG23  VAL  35          HG23      VAL  35   9.578   6.632  19.024
  276    H    ARG  36           H        ARG  36  14.963   4.160  19.294
  277    HA   ARG  36           HA       ARG  36  16.394   3.276  20.967
  278    HB2  ARG  36           HB2      ARG  36  17.794   5.114  21.776
  279    HB3  ARG  36           HB3      ARG  36  17.309   5.415  20.112
  280    HG2  ARG  36           HG2      ARG  36  16.131   7.274  20.672
  281    HG3  ARG  36           HG3      ARG  36  15.441   6.513  22.102
  282    HD2  ARG  36           HD2      ARG  36  17.953   6.749  22.997
  283    HD3  ARG  36           HD3      ARG  36  17.957   8.100  21.845
  284    HE   ARG  36           HE       ARG  36  16.371   9.210  23.215
  285   HH11  ARG  36          HH11      ARG  36  17.537   7.692  25.540
  286   HH12  ARG  36          HH12      ARG  36  16.125   6.993  26.257
  287   HH21  ARG  36          HH21      ARG  36  14.125   7.519  23.461
  288   HH22  ARG  36          HH22      ARG  36  14.187   6.891  25.074
  Start of MODEL   27
    1    HA   SER   1           HA       SER   1 -26.521  -2.551  -4.168
    2    HB2  SER   1           HB2      SER   1 -29.114  -4.050  -4.680
    3    HB3  SER   1           HB3      SER   1 -28.512  -3.573  -3.094
    4    HG   SER   1           HG       SER   1 -29.914  -1.993  -3.780
    5    H    ASP   2           H        ASP   2 -25.119  -4.001  -3.238
    6    HA   ASP   2           HA       ASP   2 -25.433  -6.910  -3.769
    7    HB2  ASP   2           HB2      ASP   2 -23.642  -5.180  -5.144
    8    HB3  ASP   2           HB3      ASP   2 -22.665  -6.161  -4.050
    9    H    LEU   3           H        LEU   3 -23.970  -8.192  -2.335
   10    HA   LEU   3           HA       LEU   3 -24.020  -7.309   0.386
   11    HB2  LEU   3           HB2      LEU   3 -23.251  -9.627  -1.182
   12    HB3  LEU   3           HB3      LEU   3 -22.084  -9.347   0.111
   13    HG   LEU   3           HG       LEU   3 -25.059  -9.294   0.634
   14   HD11  LEU   3          HD11      LEU   3 -24.910 -11.643   1.306
   15   HD12  LEU   3          HD12      LEU   3 -23.207 -11.689   0.852
   16   HD13  LEU   3          HD13      LEU   3 -24.444 -11.482  -0.387
   17   HD21  LEU   3          HD21      LEU   3 -24.192  -9.953   2.931
   18   HD22  LEU   3          HD22      LEU   3 -23.719  -8.341   2.396
   19   HD23  LEU   3          HD23      LEU   3 -22.563  -9.671   2.316
   20    HA   PRO   4           HA       PRO   4 -19.343  -6.450  -0.032
   21    HB2  PRO   4           HB2      PRO   4 -18.173  -6.559  -2.500
   22    HB3  PRO   4           HB3      PRO   4 -18.325  -7.974  -1.442
   23    HG2  PRO   4           HG2      PRO   4 -19.905  -7.221  -3.832
   24    HG3  PRO   4           HG3      PRO   4 -19.441  -8.821  -3.239
   25    HD2  PRO   4           HD2      PRO   4 -21.937  -7.673  -2.934
   26    HD3  PRO   4           HD3      PRO   4 -21.298  -9.006  -1.951
   27    H    ALA   5           H        ALA   5 -21.300  -4.564  -0.176
   28    HA   ALA   5           HA       ALA   5 -19.995  -2.331  -1.605
   29    HB1  ALA   5           HB1      ALA   5 -22.120  -1.792  -2.803
   30    HB2  ALA   5           HB2      ALA   5 -22.817  -3.290  -2.183
   31    HB3  ALA   5           HB3      ALA   5 -21.450  -3.348  -3.296
   32    H    LEU   6           H        LEU   6 -20.357  -2.852   1.185
   33    HA   LEU   6           HA       LEU   6 -22.262  -0.654   1.927
   34    HB2  LEU   6           HB2      LEU   6 -22.264  -3.464   2.594
   35    HB3  LEU   6           HB3      LEU   6 -22.031  -2.515   4.062
   36    HG   LEU   6           HG       LEU   6 -23.985  -1.049   2.958
   37   HD11  LEU   6          HD11      LEU   6 -25.493  -2.271   1.637
   38   HD12  LEU   6          HD12      LEU   6 -24.808  -3.823   2.121
   39   HD13  LEU   6          HD13      LEU   6 -23.928  -2.780   1.003
   40   HD21  LEU   6          HD21      LEU   6 -23.870  -2.352   5.182
   41   HD22  LEU   6          HD22      LEU   6 -24.676  -3.660   4.317
   42   HD23  LEU   6          HD23      LEU   6 -25.471  -2.095   4.489
   43    H    SER   7           H        SER   7 -19.642  -2.675   3.356
   44    HA   SER   7           HA       SER   7 -18.401  -0.145   4.387
   45    HB2  SER   7           HB2      SER   7 -19.048  -2.754   5.763
   46    HB3  SER   7           HB3      SER   7 -17.833  -1.655   6.409
   47    HG   SER   7           HG       SER   7 -20.596  -1.397   6.245
   48    H    THR   8           H        THR   8 -17.826  -2.275   2.112
   49    HA   THR   8           HA       THR   8 -14.955  -2.720   2.873
   50    HB   THR   8           HB       THR   8 -15.171  -4.723   1.319
   51    HG1  THR   8           HG1      THR   8 -16.963  -4.929   0.283
   52   HG21  THR   8          HG21      THR   8 -16.558  -6.049   2.986
   53   HG22  THR   8          HG22      THR   8 -16.861  -4.525   3.819
   54   HG23  THR   8          HG23      THR   8 -15.213  -5.138   3.675
   55    H    GLY   9           H        GLY   9 -16.470  -0.506   1.289
   56    HA2  GLY   9           HA2      GLY   9 -15.079  -0.810  -1.333
   57    HA3  GLY   9           HA3      GLY   9 -16.410   0.308  -1.015
   58    H    LEU  10           H        LEU  10 -15.943   2.100   0.536
   59    HA   LEU  10           HA       LEU  10 -13.575   3.550  -0.145
   60    HB2  LEU  10           HB2      LEU  10 -15.985   4.044   1.082
   61    HB3  LEU  10           HB3      LEU  10 -14.871   4.158   2.445
   62    HG   LEU  10           HG       LEU  10 -14.251   5.562  -0.147
   63   HD11  LEU  10          HD11      LEU  10 -15.885   6.700   2.142
   64   HD12  LEU  10          HD12      LEU  10 -16.547   6.232   0.575
   65   HD13  LEU  10          HD13      LEU  10 -15.388   7.556   0.682
   66   HD21  LEU  10          HD21      LEU  10 -13.465   5.824   2.759
   67   HD22  LEU  10          HD22      LEU  10 -13.193   7.137   1.613
   68   HD23  LEU  10          HD23      LEU  10 -12.421   5.571   1.361
   69    H    LEU  11           H        LEU  11 -14.372   1.560   2.722
   70    HA   LEU  11           HA       LEU  11 -12.047   2.092   4.276
   71    HB2  LEU  11           HB2      LEU  11 -14.220   0.814   4.822
   72    HB3  LEU  11           HB3      LEU  11 -13.462  -0.579   4.049
   73    HG   LEU  11           HG       LEU  11 -11.758   0.820   6.021
   74   HD11  LEU  11          HD11      LEU  11 -12.903   0.077   7.973
   75   HD12  LEU  11          HD12      LEU  11 -14.039  -0.888   7.031
   76   HD13  LEU  11          HD13      LEU  11 -14.133   0.873   6.991
   77   HD21  LEU  11          HD21      LEU  11 -11.333  -1.390   4.778
   78   HD22  LEU  11          HD22      LEU  11 -12.541  -2.098   5.851
   79   HD23  LEU  11          HD23      LEU  11 -11.064  -1.404   6.522
   80    H    HIS  12           H        HIS  12 -12.637  -0.474   1.837
   81    HA   HIS  12           HA       HIS  12 -10.010  -1.652   1.978
   82    HB2  HIS  12           HB2      HIS  12 -12.272  -1.592  -0.028
   83    HB3  HIS  12           HB3      HIS  12 -10.775  -2.453  -0.379
   84    HD1  HIS  12           HD1      HIS  12 -11.987  -4.770  -0.256
   85    HD2  HIS  12           HD2      HIS  12 -12.148  -2.583   3.292
   86    HE1  HIS  12           HE1      HIS  12 -12.793  -6.367   1.536
   87    H    LEU  13           H        LEU  13 -11.412   0.943  -0.028
   88    HA   LEU  13           HA       LEU  13  -9.237   1.321  -1.838
   89    HB2  LEU  13           HB2      LEU  13 -11.725   2.494  -1.196
   90    HB3  LEU  13           HB3      LEU  13 -10.546   3.794  -1.043
   91    HG   LEU  13           HG       LEU  13 -11.294   3.787  -3.329
   92   HD11  LEU  13          HD11      LEU  13  -8.762   3.902  -2.791
   93   HD12  LEU  13          HD12      LEU  13  -9.231   3.604  -4.465
   94   HD13  LEU  13          HD13      LEU  13  -8.689   2.267  -3.450
   95   HD21  LEU  13          HD21      LEU  13 -12.180   1.438  -3.261
   96   HD22  LEU  13          HD22      LEU  13 -10.526   0.853  -3.437
   97   HD23  LEU  13          HD23      LEU  13 -11.270   1.799  -4.727
   98    H    HIS  14           H        HIS  14  -9.853   2.667   1.409
   99    HA   HIS  14           HA       HIS  14  -7.618   4.460   1.529
  100    HB2  HIS  14           HB2      HIS  14  -9.418   4.638   3.107
  101    HB3  HIS  14           HB3      HIS  14  -9.280   2.942   3.562
  102    HD1  HIS  14           HD1      HIS  14  -8.582   3.084   5.984
  103    HD2  HIS  14           HD2      HIS  14  -6.283   5.565   3.545
  104    HE1  HIS  14           HE1      HIS  14  -6.729   4.007   7.441
  105    H    GLN  15           H        GLN  15  -7.990   1.108   2.763
  106    HA   GLN  15           HA       GLN  15  -5.291   0.763   3.650
  107    HB2  GLN  15           HB2      GLN  15  -7.525  -0.613   3.952
  108    HB3  GLN  15           HB3      GLN  15  -6.963  -1.466   2.513
  109    HG2  GLN  15           HG2      GLN  15  -5.951  -2.747   4.156
  110    HG3  GLN  15           HG3      GLN  15  -4.682  -1.553   3.879
  111   HE21  GLN  15          HE21      GLN  15  -4.094  -0.224   5.645
  112   HE22  GLN  15          HE22      GLN  15  -4.921  -0.198   7.126
  113    H    ASN  16           H        ASN  16  -6.848   0.210   0.500
  114    HA   ASN  16           HA       ASN  16  -4.727  -1.144  -0.835
  115    HB2  ASN  16           HB2      ASN  16  -7.090  -0.850  -1.599
  116    HB3  ASN  16           HB3      ASN  16  -6.747   0.851  -1.916
  117   HD21  ASN  16          HD21      ASN  16  -5.424   1.377  -3.782
  118   HD22  ASN  16          HD22      ASN  16  -5.008   0.209  -4.942
  119    H    ILE  17           H        ILE  17  -5.282   2.334  -0.279
  120    HA   ILE  17           HA       ILE  17  -2.943   3.092  -1.925
  121    HB   ILE  17           HB       ILE  17  -4.976   4.583  -0.229
  122   HG12  ILE  17          HG12      ILE  17  -4.562   4.759  -3.215
  123   HG13  ILE  17          HG13      ILE  17  -5.541   3.470  -2.515
  124   HG21  ILE  17          HG21      ILE  17  -2.651   5.624  -1.872
  125   HG22  ILE  17          HG22      ILE  17  -2.973   5.913  -0.162
  126   HG23  ILE  17          HG23      ILE  17  -4.016   6.632  -1.390
  127   HD11  ILE  17          HD11      ILE  17  -7.081   5.213  -3.007
  128   HD12  ILE  17          HD12      ILE  17  -6.005   6.451  -2.361
  129   HD13  ILE  17          HD13      ILE  17  -6.808   5.323  -1.269
  130    H    VAL  18           H        VAL  18  -3.876   3.030   1.522
  131    HA   VAL  18           HA       VAL  18  -1.436   4.211   2.513
  132    HB   VAL  18           HB       VAL  18  -3.738   2.622   3.634
  133   HG11  VAL  18          HG11      VAL  18  -2.763   3.078   5.914
  134   HG12  VAL  18          HG12      VAL  18  -1.249   3.511   5.120
  135   HG13  VAL  18          HG13      VAL  18  -1.879   1.869   4.984
  136   HG21  VAL  18          HG21      VAL  18  -4.305   4.881   3.289
  137   HG22  VAL  18          HG22      VAL  18  -2.707   5.451   3.771
  138   HG23  VAL  18          HG23      VAL  18  -3.831   4.845   4.987
  139    H    ASP  19           H        ASP  19  -2.414   0.877   1.826
  140    HA   ASP  19           HA       ASP  19   0.065  -0.216   3.004
  141    HB2  ASP  19           HB2      ASP  19  -2.414  -1.164   2.900
  142    HB3  ASP  19           HB3      ASP  19  -1.874  -1.791   1.343
  143    H    VAL  20           H        VAL  20  -0.228   1.501   0.303
  144    HA   VAL  20           HA       VAL  20   1.439  -0.372  -1.338
  145    HB   VAL  20           HB       VAL  20  -0.978   0.519  -2.010
  146   HG11  VAL  20          HG11      VAL  20  -1.041   2.583  -3.121
  147   HG12  VAL  20          HG12      VAL  20   0.714   2.657  -3.284
  148   HG13  VAL  20          HG13      VAL  20  -0.038   2.931  -1.714
  149   HG21  VAL  20          HG21      VAL  20   1.354   0.510  -3.950
  150   HG22  VAL  20          HG22      VAL  20  -0.342   0.255  -4.359
  151   HG23  VAL  20          HG23      VAL  20   0.514  -0.930  -3.373
  152    H    GLN  21           H        GLN  21   1.200   2.808   0.091
  153    HA   GLN  21           HA       GLN  21   3.659   3.730  -1.317
  154    HB2  GLN  21           HB2      GLN  21   1.224   4.900  -0.370
  155    HB3  GLN  21           HB3      GLN  21   2.561   5.646   0.509
  156    HG2  GLN  21           HG2      GLN  21   2.844   5.273  -2.449
  157    HG3  GLN  21           HG3      GLN  21   1.808   6.576  -1.864
  158   HE21  GLN  21          HE21      GLN  21   5.162   5.309  -1.661
  159   HE22  GLN  21          HE22      GLN  21   5.858   6.797  -1.229
  160    H    TYR  22           H        TYR  22   2.460   2.807   1.887
  161    HA   TYR  22           HA       TYR  22   4.593   3.858   3.472
  162    HB2  TYR  22           HB2      TYR  22   3.576   2.625   5.171
  163    HB3  TYR  22           HB3      TYR  22   2.261   2.708   4.006
  164    HD1  TYR  22           HD1      TYR  22   1.955   0.751   2.381
  165    HD2  TYR  22           HD2      TYR  22   4.471   0.544   5.854
  166    HE1  TYR  22           HE1      TYR  22   1.875  -1.724   2.293
  167    HE2  TYR  22           HE2      TYR  22   4.392  -1.932   5.761
  168    HH   TYR  22           HH       TYR  22   2.153  -3.629   3.955
  169    H    MET  23           H        MET  23   4.402   1.000   1.419
  170    HA   MET  23           HA       MET  23   6.898  -0.165   2.471
  171    HB2  MET  23           HB2      MET  23   4.713  -1.271   1.471
  172    HB3  MET  23           HB3      MET  23   5.511  -0.973  -0.073
  173    HG2  MET  23           HG2      MET  23   6.123  -3.197   0.662
  174    HG3  MET  23           HG3      MET  23   7.540  -2.161   0.826
  175    HE1  MET  23           HE1      MET  23   6.682  -5.143   2.862
  176    HE2  MET  23           HE2      MET  23   5.315  -4.489   1.965
  177    HE3  MET  23           HE3      MET  23   5.252  -4.560   3.723
  178    H    TYR  24           H        TYR  24   6.033   2.201   0.105
  179    HA   TYR  24           HA       TYR  24   8.665   1.858  -1.291
  180    HB2  TYR  24           HB2      TYR  24   5.911   2.764  -2.089
  181    HB3  TYR  24           HB3      TYR  24   7.304   3.354  -2.995
  182    HD1  TYR  24           HD1      TYR  24   5.338   0.374  -2.066
  183    HD2  TYR  24           HD2      TYR  24   8.672   1.849  -4.339
  184    HE1  TYR  24           HE1      TYR  24   5.437  -1.769  -3.309
  185    HE2  TYR  24           HE2      TYR  24   8.769  -0.294  -5.584
  186    HH   TYR  24           HH       TYR  24   7.679  -2.984  -4.702
  187    H    GLY  25           H        GLY  25   8.010   3.418   1.292
  188    HA2  GLY  25           HA2      GLY  25   9.653   5.699   0.766
  189    HA3  GLY  25           HA3      GLY  25   7.966   6.209   0.782
  190    H    LEU  26           H        LEU  26   6.701   5.416   2.781
  191    HA   LEU  26           HA       LEU  26   6.431   5.485   5.126
  192    HB2  LEU  26           HB2      LEU  26   8.124   3.482   4.498
  193    HB3  LEU  26           HB3      LEU  26   9.206   4.453   5.495
  194    HG   LEU  26           HG       LEU  26   6.576   4.240   6.715
  195   HD11  LEU  26          HD11      LEU  26   6.218   2.104   5.856
  196   HD12  LEU  26          HD12      LEU  26   7.112   1.730   7.330
  197   HD13  LEU  26          HD13      LEU  26   7.940   1.738   5.773
  198   HD21  LEU  26          HD21      LEU  26   9.394   3.445   7.508
  199   HD22  LEU  26          HD22      LEU  26   8.011   3.356   8.599
  200   HD23  LEU  26          HD23      LEU  26   8.536   4.916   7.966
  201    H    SER  27           H        SER  27   7.768   7.805   3.706
  202    HA   SER  27           HA       SER  27   9.871   8.877   5.358
  203    HB2  SER  27           HB2      SER  27   8.066   9.750   3.177
  204    HB3  SER  27           HB3      SER  27   8.705  11.044   4.186
  205    HG   SER  27           HG       SER  27  10.032   9.220   2.524
  206    HA   PRO  28           HA       PRO  28   6.413  11.435   7.491
  207    HB2  PRO  28           HB2      PRO  28   3.823  10.597   7.210
  208    HB3  PRO  28           HB3      PRO  28   4.583  11.782   6.127
  209    HG2  PRO  28           HG2      PRO  28   4.107   8.872   5.717
  210    HG3  PRO  28           HG3      PRO  28   3.972  10.213   4.568
  211    HD2  PRO  28           HD2      PRO  28   6.095   8.514   4.644
  212    HD3  PRO  28           HD3      PRO  28   6.209  10.196   4.082
  213    H    ALA  29           H        ALA  29   6.262   7.966   7.238
  214    HA   ALA  29           HA       ALA  29   5.017   7.479   9.831
  215    HB1  ALA  29           HB1      ALA  29   4.832   5.856   8.053
  216    HB2  ALA  29           HB2      ALA  29   5.847   5.135   9.302
  217    HB3  ALA  29           HB3      ALA  29   6.582   5.805   7.847
  218    H    ILE  30           H        ILE  30   8.383   7.393   8.585
  219    HA   ILE  30           HA       ILE  30   9.541   6.631  11.130
  220    HB   ILE  30           HB       ILE  30  10.483   6.277   8.806
  221   HG12  ILE  30          HG12      ILE  30  12.867   7.058   9.544
  222   HG13  ILE  30          HG13      ILE  30  12.063   7.536  11.040
  223   HG21  ILE  30          HG21      ILE  30  11.079   9.238   9.075
  224   HG22  ILE  30          HG22      ILE  30  10.061   8.475   7.855
  225   HG23  ILE  30          HG23      ILE  30  11.799   8.180   7.861
  226   HD11  ILE  30          HD11      ILE  30  12.299   4.777   9.839
  227   HD12  ILE  30          HD12      ILE  30  11.062   5.152  11.039
  228   HD13  ILE  30          HD13      ILE  30  12.769   5.316  11.452
  229    H    THR  31           H        THR  31   8.744   9.720   9.652
  230    HA   THR  31           HA       THR  31  10.337  11.329  11.500
  231    HB   THR  31           HB       THR  31   8.752  13.135  10.473
  232    HG1  THR  31           HG1      THR  31   8.299  11.314   8.435
  233   HG21  THR  31          HG21      THR  31  10.016  13.021   8.311
  234   HG22  THR  31          HG22      THR  31  10.613  11.434   8.794
  235   HG23  THR  31          HG23      THR  31  11.043  12.862   9.735
  236    H    LYS  32           H        LYS  32   6.959  10.222  11.327
  237    HA   LYS  32           HA       LYS  32   6.196  11.763  13.727
  238    HB2  LYS  32           HB2      LYS  32   4.848   9.840  11.825
  239    HB3  LYS  32           HB3      LYS  32   4.030  10.423  13.275
  240    HG2  LYS  32           HG2      LYS  32   4.268  12.729  12.549
  241    HG3  LYS  32           HG3      LYS  32   5.243  12.232  11.166
  242    HD2  LYS  32           HD2      LYS  32   3.367  11.060  10.183
  243    HD3  LYS  32           HD3      LYS  32   2.385  11.335  11.623
  244    HE2  LYS  32           HE2      LYS  32   2.372  13.742  11.225
  245    HE3  LYS  32           HE3      LYS  32   3.494  13.554   9.863
  246    HZ1  LYS  32           HZ1      LYS  32   0.853  12.199  10.038
  247    HZ2  LYS  32           HZ2      LYS  32   1.909  12.219   8.705
  248    HZ3  LYS  32           HZ3      LYS  32   1.117  13.644   9.188
  249    H    TYR  33           H        TYR  33   8.140   9.199  13.522
  250    HA   TYR  33           HA       TYR  33   6.856   7.675  15.763
  251    HB2  TYR  33           HB2      TYR  33   7.265   6.427  13.681
  252    HB3  TYR  33           HB3      TYR  33   8.960   6.909  13.709
  253    HD1  TYR  33           HD1      TYR  33   6.361   4.974  15.544
  254    HD2  TYR  33           HD2      TYR  33  10.554   5.760  15.053
  255    HE1  TYR  33           HE1      TYR  33   6.892   3.036  16.995
  256    HE2  TYR  33           HE2      TYR  33  11.088   3.822  16.505
  257    HH   TYR  33           HH       TYR  33   9.249   2.509  18.565
  258    H    VAL  34           H        VAL  34   9.924   9.122  14.623
  259    HA   VAL  34           HA       VAL  34  11.200   8.610  17.258
  260    HB   VAL  34           HB       VAL  34  12.246   9.927  14.728
  261   HG11  VAL  34          HG11      VAL  34  13.617   8.774  17.174
  262   HG12  VAL  34          HG12      VAL  34  13.609  10.462  16.666
  263   HG13  VAL  34          HG13      VAL  34  14.461   9.256  15.703
  264   HG21  VAL  34          HG21      VAL  34  11.539   7.640  14.239
  265   HG22  VAL  34          HG22      VAL  34  12.376   7.045  15.673
  266   HG23  VAL  34          HG23      VAL  34  13.300   7.690  14.317
  267    H    VAL  35           H        VAL  35  10.051  10.100  18.608
  268    HA   VAL  35           HA       VAL  35  10.632  12.991  18.054
  269    HB   VAL  35           HB       VAL  35   8.241  12.122  17.682
  270   HG11  VAL  35          HG11      VAL  35   8.487  10.773  19.945
  271   HG12  VAL  35          HG12      VAL  35   6.928  11.452  19.479
  272   HG13  VAL  35          HG13      VAL  35   7.936  12.288  20.661
  273   HG21  VAL  35          HG21      VAL  35   8.800  14.516  17.998
  274   HG22  VAL  35          HG22      VAL  35   8.666  14.308  19.744
  275   HG23  VAL  35          HG23      VAL  35   7.242  14.115  18.721
  276    H    ARG  36           H        ARG  36  11.893  10.776  19.830
  277    HA   ARG  36           HA       ARG  36  11.410  11.802  22.562
  278    HB2  ARG  36           HB2      ARG  36  13.184   9.645  21.371
  279    HB3  ARG  36           HB3      ARG  36  13.070   9.974  23.098
  280    HG2  ARG  36           HG2      ARG  36  11.297   8.585  23.169
  281    HG3  ARG  36           HG3      ARG  36  10.407   9.775  22.218
  282    HD2  ARG  36           HD2      ARG  36  10.806   8.656  20.196
  283    HD3  ARG  36           HD3      ARG  36  12.243   7.828  20.827
  284    HE   ARG  36           HE       ARG  36  10.816   6.261  21.952
  285   HH11  ARG  36          HH11      ARG  36   9.241   6.821  19.332
  286   HH12  ARG  36          HH12      ARG  36   7.634   6.951  19.965
  287   HH21  ARG  36          HH21      ARG  36   8.674   7.301  23.261
  288   HH22  ARG  36          HH22      ARG  36   7.312   7.233  22.194
  Start of MODEL   28
    1    HA   SER   1           HA       SER   1 -28.738   1.868   4.994
    2    HB2  SER   1           HB2      SER   1 -28.261   3.514   3.067
    3    HB3  SER   1           HB3      SER   1 -29.832   3.650   3.849
    4    HG   SER   1           HG       SER   1 -27.880   5.473   3.647
    5    H    ASP   2           H        ASP   2 -26.833   0.840   4.463
    6    HA   ASP   2           HA       ASP   2 -24.295   1.957   5.488
    7    HB2  ASP   2           HB2      ASP   2 -25.331  -0.656   4.445
    8    HB3  ASP   2           HB3      ASP   2 -23.588  -0.393   4.482
    9    H    LEU   3           H        LEU   3 -24.207   3.738   3.885
   10    HA   LEU   3           HA       LEU   3 -23.930   3.132   1.039
   11    HB2  LEU   3           HB2      LEU   3 -24.333   5.386   2.735
   12    HB3  LEU   3           HB3      LEU   3 -22.872   5.699   1.798
   13    HG   LEU   3           HG       LEU   3 -25.396   4.674   0.493
   14   HD11  LEU   3          HD11      LEU   3 -26.028   6.745   1.593
   15   HD12  LEU   3          HD12      LEU   3 -25.820   7.071  -0.127
   16   HD13  LEU   3          HD13      LEU   3 -24.565   7.543   1.018
   17   HD21  LEU   3          HD21      LEU   3 -24.350   5.681  -1.505
   18   HD22  LEU   3          HD22      LEU   3 -23.266   4.508  -0.758
   19   HD23  LEU   3          HD23      LEU   3 -22.995   6.235  -0.520
   20    HA   PRO   4           HA       PRO   4 -19.302   4.035   1.874
   21    HB2  PRO   4           HB2      PRO   4 -18.440   4.229   4.464
   22    HB3  PRO   4           HB3      PRO   4 -18.992   5.628   3.521
   23    HG2  PRO   4           HG2      PRO   4 -20.436   4.051   5.588
   24    HG3  PRO   4           HG3      PRO   4 -20.458   5.794   5.276
   25    HD2  PRO   4           HD2      PRO   4 -22.441   4.094   4.494
   26    HD3  PRO   4           HD3      PRO   4 -22.064   5.617   3.659
   27    H    ALA   5           H        ALA   5 -21.006   2.012   4.201
   28    HA   ALA   5           HA       ALA   5 -18.880  -0.085   3.970
   29    HB1  ALA   5           HB1      ALA   5 -21.221   0.074   5.889
   30    HB2  ALA   5           HB2      ALA   5 -19.676   0.863   6.209
   31    HB3  ALA   5           HB3      ALA   5 -19.756  -0.893   6.059
   32    H    LEU   6           H        LEU   6 -20.844   0.455   1.834
   33    HA   LEU   6           HA       LEU   6 -23.009  -1.468   1.946
   34    HB2  LEU   6           HB2      LEU   6 -22.668   0.679   0.523
   35    HB3  LEU   6           HB3      LEU   6 -21.713  -0.349  -0.545
   36    HG   LEU   6           HG       LEU   6 -24.280  -1.554   0.217
   37   HD11  LEU   6          HD11      LEU   6 -24.346   0.890  -1.571
   38   HD12  LEU   6          HD12      LEU   6 -24.832   0.926   0.123
   39   HD13  LEU   6          HD13      LEU   6 -25.714  -0.080  -1.026
   40   HD21  LEU   6          HD21      LEU   6 -23.208  -0.855  -2.526
   41   HD22  LEU   6          HD22      LEU   6 -24.301  -2.168  -2.089
   42   HD23  LEU   6          HD23      LEU   6 -22.606  -2.235  -1.608
   43    H    SER   7           H        SER   7 -19.854  -1.478   0.212
   44    HA   SER   7           HA       SER   7 -19.935  -4.471   0.267
   45    HB2  SER   7           HB2      SER   7 -19.226  -4.416  -2.122
   46    HB3  SER   7           HB3      SER   7 -20.803  -3.669  -1.886
   47    HG   SER   7           HG       SER   7 -19.909  -2.011  -2.826
   48    H    THR   8           H        THR   8 -18.353  -2.471   1.842
   49    HA   THR   8           HA       THR   8 -16.117  -2.103   2.517
   50    HB   THR   8           HB       THR   8 -15.591  -4.685   1.013
   51    HG1  THR   8           HG1      THR   8 -16.953  -5.627   2.279
   52   HG21  THR   8          HG21      THR   8 -14.490  -3.417   3.532
   53   HG22  THR   8          HG22      THR   8 -13.625  -3.737   2.029
   54   HG23  THR   8          HG23      THR   8 -14.146  -5.078   3.049
   55    H    GLY   9           H        GLY   9 -16.555  -0.468   0.463
   56    HA2  GLY   9           HA2      GLY   9 -14.429  -0.989  -1.574
   57    HA3  GLY   9           HA3      GLY   9 -15.797   0.099  -1.811
   58    H    LEU  10           H        LEU  10 -15.860   1.878   0.054
   59    HA   LEU  10           HA       LEU  10 -13.581   3.568  -0.274
   60    HB2  LEU  10           HB2      LEU  10 -16.164   3.755   0.686
   61    HB3  LEU  10           HB3      LEU  10 -15.214   3.957   2.156
   62    HG   LEU  10           HG       LEU  10 -15.655   6.131   1.064
   63   HD11  LEU  10          HD11      LEU  10 -12.736   5.395   0.740
   64   HD12  LEU  10          HD12      LEU  10 -13.497   5.638   2.313
   65   HD13  LEU  10          HD13      LEU  10 -13.411   6.969   1.160
   66   HD21  LEU  10          HD21      LEU  10 -13.841   5.353  -1.198
   67   HD22  LEU  10          HD22      LEU  10 -15.077   6.609  -1.140
   68   HD23  LEU  10          HD23      LEU  10 -15.547   4.916  -1.286
   69    H    LEU  11           H        LEU  11 -14.572   1.561   2.535
   70    HA   LEU  11           HA       LEU  11 -12.402   2.194   4.266
   71    HB2  LEU  11           HB2      LEU  11 -14.550   0.914   4.739
   72    HB3  LEU  11           HB3      LEU  11 -13.806  -0.482   3.958
   73    HG   LEU  11           HG       LEU  11 -12.104   0.808   5.993
   74   HD11  LEU  11          HD11      LEU  11 -13.347  -0.056   7.907
   75   HD12  LEU  11          HD12      LEU  11 -14.612  -0.671   6.844
   76   HD13  LEU  11          HD13      LEU  11 -14.370   1.068   7.012
   77   HD21  LEU  11          HD21      LEU  11 -11.511  -1.436   6.468
   78   HD22  LEU  11          HD22      LEU  11 -11.817  -1.436   4.731
   79   HD23  LEU  11          HD23      LEU  11 -13.036  -2.061   5.841
   80    H    HIS  12           H        HIS  12 -12.731  -0.409   1.831
   81    HA   HIS  12           HA       HIS  12 -10.100  -1.531   2.228
   82    HB2  HIS  12           HB2      HIS  12 -12.294  -2.403   1.061
   83    HB3  HIS  12           HB3      HIS  12 -11.632  -1.606  -0.365
   84    HD1  HIS  12           HD1      HIS  12 -11.210  -3.924  -1.511
   85    HD2  HIS  12           HD2      HIS  12  -9.105  -3.379   2.047
   86    HE1  HIS  12           HE1      HIS  12  -9.467  -5.758  -1.422
   87    H    LEU  13           H        LEU  13 -11.380   1.073   0.196
   88    HA   LEU  13           HA       LEU  13  -9.175   1.415  -1.585
   89    HB2  LEU  13           HB2      LEU  13 -11.651   2.612  -0.995
   90    HB3  LEU  13           HB3      LEU  13 -10.471   3.896  -0.756
   91    HG   LEU  13           HG       LEU  13 -11.284   3.827  -3.094
   92   HD11  LEU  13          HD11      LEU  13  -8.395   2.955  -2.776
   93   HD12  LEU  13          HD12      LEU  13  -8.991   4.608  -2.625
   94   HD13  LEU  13          HD13      LEU  13  -9.070   3.781  -4.180
   95   HD21  LEU  13          HD21      LEU  13 -11.217   1.939  -4.417
   96   HD22  LEU  13          HD22      LEU  13 -11.409   1.160  -2.846
   97   HD23  LEU  13          HD23      LEU  13  -9.811   1.275  -3.584
   98    H    HIS  14           H        HIS  14  -9.837   2.855   1.629
   99    HA   HIS  14           HA       HIS  14  -7.530   4.542   1.770
  100    HB2  HIS  14           HB2      HIS  14  -9.168   4.951   3.387
  101    HB3  HIS  14           HB3      HIS  14  -9.446   3.236   3.682
  102    HD1  HIS  14           HD1      HIS  14  -8.409   2.336   5.763
  103    HD2  HIS  14           HD2      HIS  14  -6.426   5.755   4.436
  104    HE1  HIS  14           HE1      HIS  14  -6.638   2.858   7.498
  105    H    GLN  15           H        GLN  15  -8.034   1.281   3.199
  106    HA   GLN  15           HA       GLN  15  -5.360   0.858   4.080
  107    HB2  GLN  15           HB2      GLN  15  -7.794  -0.466   4.114
  108    HB3  GLN  15           HB3      GLN  15  -6.804  -1.512   3.095
  109    HG2  GLN  15           HG2      GLN  15  -6.506  -2.240   5.375
  110    HG3  GLN  15           HG3      GLN  15  -5.022  -1.422   4.886
  111   HE21  GLN  15          HE21      GLN  15  -4.290   0.108   6.370
  112   HE22  GLN  15          HE22      GLN  15  -5.268   0.927   7.490
  113    H    ASN  16           H        ASN  16  -6.897   0.211   0.932
  114    HA   ASN  16           HA       ASN  16  -4.747  -1.241  -0.284
  115    HB2  ASN  16           HB2      ASN  16  -7.119  -1.032  -1.071
  116    HB3  ASN  16           HB3      ASN  16  -6.782   0.637  -1.535
  117   HD21  ASN  16          HD21      ASN  16  -5.636   0.993  -3.508
  118   HD22  ASN  16          HD22      ASN  16  -5.124  -0.268  -4.521
  119    H    ILE  17           H        ILE  17  -5.516   2.270  -0.311
  120    HA   ILE  17           HA       ILE  17  -3.180   2.993  -1.890
  121    HB   ILE  17           HB       ILE  17  -5.133   4.508  -0.128
  122   HG12  ILE  17          HG12      ILE  17  -6.032   3.486  -2.212
  123   HG13  ILE  17          HG13      ILE  17  -6.070   5.246  -2.274
  124   HG21  ILE  17          HG21      ILE  17  -3.131   5.838  -0.154
  125   HG22  ILE  17          HG22      ILE  17  -4.226   6.547  -1.341
  126   HG23  ILE  17          HG23      ILE  17  -2.882   5.538  -1.875
  127   HD11  ILE  17          HD11      ILE  17  -4.007   3.436  -3.567
  128   HD12  ILE  17          HD12      ILE  17  -3.901   5.196  -3.532
  129   HD13  ILE  17          HD13      ILE  17  -5.223   4.409  -4.396
  130    H    VAL  18           H        VAL  18  -3.882   2.732   1.575
  131    HA   VAL  18           HA       VAL  18  -1.438   4.044   2.452
  132    HB   VAL  18           HB       VAL  18  -3.541   2.289   3.744
  133   HG11  VAL  18          HG11      VAL  18  -1.722   1.875   5.163
  134   HG12  VAL  18          HG12      VAL  18  -2.458   3.299   5.899
  135   HG13  VAL  18          HG13      VAL  18  -1.021   3.471   4.891
  136   HG21  VAL  18          HG21      VAL  18  -2.882   5.219   4.145
  137   HG22  VAL  18          HG22      VAL  18  -4.313   4.358   4.706
  138   HG23  VAL  18          HG23      VAL  18  -4.079   4.650   2.984
  139    H    ASP  19           H        ASP  19  -2.192   0.851   1.315
  140    HA   ASP  19           HA       ASP  19   0.314  -0.253   2.510
  141    HB2  ASP  19           HB2      ASP  19  -2.332  -1.255   1.813
  142    HB3  ASP  19           HB3      ASP  19  -1.065  -2.256   1.109
  143    H    VAL  20           H        VAL  20  -0.062   1.587  -0.021
  144    HA   VAL  20           HA       VAL  20   1.379  -0.222  -1.923
  145    HB   VAL  20           HB       VAL  20  -0.960   0.843  -2.424
  146   HG11  VAL  20          HG11      VAL  20   0.824   3.161  -3.204
  147   HG12  VAL  20          HG12      VAL  20  -0.147   3.151  -1.733
  148   HG13  VAL  20          HG13      VAL  20  -0.934   3.073  -3.307
  149   HG21  VAL  20          HG21      VAL  20   1.447   0.871  -4.249
  150   HG22  VAL  20          HG22      VAL  20  -0.173   1.241  -4.839
  151   HG23  VAL  20          HG23      VAL  20   0.171  -0.342  -4.142
  152    H    GLN  21           H        GLN  21   1.348   3.005  -0.451
  153    HA   GLN  21           HA       GLN  21   3.825   3.826  -1.810
  154    HB2  GLN  21           HB2      GLN  21   1.649   5.018  -0.389
  155    HB3  GLN  21           HB3      GLN  21   3.135   5.454   0.455
  156    HG2  GLN  21           HG2      GLN  21   2.904   5.690  -2.547
  157    HG3  GLN  21           HG3      GLN  21   2.386   6.992  -1.477
  158   HE21  GLN  21          HE21      GLN  21   5.076   5.819  -3.163
  159   HE22  GLN  21          HE22      GLN  21   6.291   6.618  -2.286
  160    H    TYR  22           H        TYR  22   2.854   2.614   1.392
  161    HA   TYR  22           HA       TYR  22   5.355   3.067   2.728
  162    HB2  TYR  22           HB2      TYR  22   4.266   2.024   4.474
  163    HB3  TYR  22           HB3      TYR  22   2.865   2.312   3.450
  164    HD1  TYR  22           HD1      TYR  22   2.195   0.443   1.793
  165    HD2  TYR  22           HD2      TYR  22   4.859  -0.164   5.106
  166    HE1  TYR  22           HE1      TYR  22   1.774  -1.997   1.688
  167    HE2  TYR  22           HE2      TYR  22   4.434  -2.603   4.997
  168    HH   TYR  22           HH       TYR  22   1.885  -3.951   3.335
  169    H    MET  23           H        MET  23   4.312   0.595   0.462
  170    HA   MET  23           HA       MET  23   6.626  -1.155   1.070
  171    HB2  MET  23           HB2      MET  23   4.010  -1.493   0.152
  172    HB3  MET  23           HB3      MET  23   4.997  -1.766  -1.283
  173    HG2  MET  23           HG2      MET  23   6.448  -3.262   0.276
  174    HG3  MET  23           HG3      MET  23   5.043  -3.246   1.341
  175    HE1  MET  23           HE1      MET  23   5.667  -6.384   0.119
  176    HE2  MET  23           HE2      MET  23   3.932  -6.420   0.424
  177    HE3  MET  23           HE3      MET  23   4.975  -5.423   1.433
  178    H    TYR  24           H        TYR  24   6.386   1.689  -0.558
  179    HA   TYR  24           HA       TYR  24   7.924   0.857  -2.967
  180    HB2  TYR  24           HB2      TYR  24   6.234   3.130  -2.080
  181    HB3  TYR  24           HB3      TYR  24   7.593   3.566  -3.112
  182    HD1  TYR  24           HD1      TYR  24   5.522   0.444  -3.100
  183    HD2  TYR  24           HD2      TYR  24   6.649   4.005  -5.222
  184    HE1  TYR  24           HE1      TYR  24   4.265  -0.343  -5.086
  185    HE2  TYR  24           HE2      TYR  24   5.392   3.216  -7.210
  186    HH   TYR  24           HH       TYR  24   3.151   1.284  -7.318
  187    H    GLY  25           H        GLY  25   9.262   0.590  -0.427
  188    HA2  GLY  25           HA2      GLY  25  11.376   1.058   0.473
  189    HA3  GLY  25           HA3      GLY  25  11.690   2.043  -0.954
  190    H    LEU  26           H        LEU  26   8.867   2.761   0.967
  191    HA   LEU  26           HA       LEU  26   8.285   4.730   2.127
  192    HB2  LEU  26           HB2      LEU  26  11.097   4.248   3.169
  193    HB3  LEU  26           HB3      LEU  26   9.840   5.174   3.986
  194    HG   LEU  26           HG       LEU  26   9.625   2.234   3.263
  195   HD11  LEU  26          HD11      LEU  26  10.460   3.687   5.760
  196   HD12  LEU  26          HD12      LEU  26  11.171   2.253   5.018
  197   HD13  LEU  26          HD13      LEU  26   9.640   2.130   5.884
  198   HD21  LEU  26          HD21      LEU  26   7.854   4.097   4.880
  199   HD22  LEU  26          HD22      LEU  26   7.639   2.349   4.785
  200   HD23  LEU  26          HD23      LEU  26   7.449   3.339   3.340
  201    H    SER  27           H        SER  27   8.583   5.737  -0.166
  202    HA   SER  27           HA       SER  27  10.817   7.209  -1.012
  203    HB2  SER  27           HB2      SER  27   7.960   8.163  -1.271
  204    HB3  SER  27           HB3      SER  27   9.272   8.342  -2.429
  205    HG   SER  27           HG       SER  27   8.904   6.385  -3.130
  206    HA   PRO  28           HA       PRO  28   9.257  11.030   1.456
  207    HB2  PRO  28           HB2      PRO  28   7.481  10.606   3.495
  208    HB3  PRO  28           HB3      PRO  28   6.984  10.987   1.835
  209    HG2  PRO  28           HG2      PRO  28   7.087   8.354   3.221
  210    HG3  PRO  28           HG3      PRO  28   5.874   8.993   2.100
  211    HD2  PRO  28           HD2      PRO  28   7.784   7.213   1.361
  212    HD3  PRO  28           HD3      PRO  28   7.085   8.405   0.245
  213    H    ALA  29           H        ALA  29  10.060   7.976   2.816
  214    HA   ALA  29           HA       ALA  29  11.161   9.175   5.311
  215    HB1  ALA  29           HB1      ALA  29  11.091   6.988   6.137
  216    HB2  ALA  29           HB2      ALA  29  11.300   6.274   4.539
  217    HB3  ALA  29           HB3      ALA  29   9.745   6.968   4.998
  218    H    ILE  30           H        ILE  30  12.193   7.330   2.421
  219    HA   ILE  30           HA       ILE  30  14.990   7.242   3.138
  220    HB   ILE  30           HB       ILE  30  13.719   5.742   1.540
  221   HG12  ILE  30          HG12      ILE  30  16.086   7.019   0.166
  222   HG13  ILE  30          HG13      ILE  30  16.286   6.090   1.652
  223   HG21  ILE  30          HG21      ILE  30  13.521   6.559  -0.808
  224   HG22  ILE  30          HG22      ILE  30  13.996   8.168  -0.265
  225   HG23  ILE  30          HG23      ILE  30  12.487   7.454   0.304
  226   HD11  ILE  30          HD11      ILE  30  15.156   5.117  -0.984
  227   HD12  ILE  30          HD12      ILE  30  15.040   4.196   0.516
  228   HD13  ILE  30          HD13      ILE  30  16.621   4.562  -0.175
  229    H    THR  31           H        THR  31  12.995   9.686   1.639
  230    HA   THR  31           HA       THR  31  15.006  11.171   0.234
  231    HB   THR  31           HB       THR  31  13.258  13.064   0.773
  232    HG1  THR  31           HG1      THR  31  11.234  12.042   1.367
  233   HG21  THR  31          HG21      THR  31  12.847  10.557  -0.832
  234   HG22  THR  31          HG22      THR  31  13.183  12.195  -1.394
  235   HG23  THR  31          HG23      THR  31  11.582  11.783  -0.780
  236    H    LYS  32           H        LYS  32  13.744  11.491   3.572
  237    HA   LYS  32           HA       LYS  32  15.810  13.516   4.216
  238    HB2  LYS  32           HB2      LYS  32  13.556  12.218   5.786
  239    HB3  LYS  32           HB3      LYS  32  14.568  13.529   6.396
  240    HG2  LYS  32           HG2      LYS  32  13.800  14.574   4.002
  241    HG3  LYS  32           HG3      LYS  32  12.381  13.604   4.397
  242    HD2  LYS  32           HD2      LYS  32  11.721  15.119   5.925
  243    HD3  LYS  32           HD3      LYS  32  13.271  14.999   6.757
  244    HE2  LYS  32           HE2      LYS  32  13.181  17.277   6.101
  245    HE3  LYS  32           HE3      LYS  32  14.155  16.530   4.820
  246    HZ1  LYS  32           HZ1      LYS  32  12.242  16.305   3.445
  247    HZ2  LYS  32           HZ2      LYS  32  12.259  17.911   3.996
  248    HZ3  LYS  32           HZ3      LYS  32  11.196  16.784   4.692
  249    H    TYR  33           H        TYR  33  16.284  10.452   3.702
  250    HA   TYR  33           HA       TYR  33  17.733   9.877   6.263
  251    HB2  TYR  33           HB2      TYR  33  15.758   8.435   5.315
  252    HB3  TYR  33           HB3      TYR  33  16.968   7.842   4.177
  253    HD1  TYR  33           HD1      TYR  33  16.130   8.169   7.779
  254    HD2  TYR  33           HD2      TYR  33  18.691   6.332   4.861
  255    HE1  TYR  33           HE1      TYR  33  17.017   6.642   9.520
  256    HE2  TYR  33           HE2      TYR  33  19.578   4.803   6.602
  257    HH   TYR  33           HH       TYR  33  18.292   3.992   9.164
  258    H    VAL  34           H        VAL  34  17.914   9.667   2.693
  259    HA   VAL  34           HA       VAL  34  20.810   9.026   2.834
  260    HB   VAL  34           HB       VAL  34  18.948   9.410   0.464
  261   HG11  VAL  34          HG11      VAL  34  21.623   8.004   0.746
  262   HG12  VAL  34          HG12      VAL  34  21.345   9.533  -0.089
  263   HG13  VAL  34          HG13      VAL  34  20.640   8.044  -0.718
  264   HG21  VAL  34          HG21      VAL  34  19.615   6.980   2.143
  265   HG22  VAL  34          HG22      VAL  34  18.997   6.840   0.497
  266   HG23  VAL  34          HG23      VAL  34  18.020   7.618   1.742
  267    H    VAL  35           H        VAL  35  21.377  11.165   3.768
  268    HA   VAL  35           HA       VAL  35  21.398  13.342   1.701
  269    HB   VAL  35           HB       VAL  35  19.885  13.556   3.763
  270   HG11  VAL  35          HG11      VAL  35  21.516  12.605   5.380
  271   HG12  VAL  35          HG12      VAL  35  20.965  14.210   5.859
  272   HG13  VAL  35          HG13      VAL  35  22.557  14.006   5.128
  273   HG21  VAL  35          HG21      VAL  35  20.288  15.904   3.937
  274   HG22  VAL  35          HG22      VAL  35  20.789  15.455   2.306
  275   HG23  VAL  35          HG23      VAL  35  22.001  15.710   3.561
  276    H    ARG  36           H        ARG  36  23.422  11.136   2.645
  277    HA   ARG  36           HA       ARG  36  25.752  12.996   2.817
  278    HB2  ARG  36           HB2      ARG  36  26.665  11.694   4.666
  279    HB3  ARG  36           HB3      ARG  36  25.035  12.211   5.091
  280    HG2  ARG  36           HG2      ARG  36  24.561   9.806   3.831
  281    HG3  ARG  36           HG3      ARG  36  26.088   9.495   4.657
  282    HD2  ARG  36           HD2      ARG  36  25.081  10.317   6.785
  283    HD3  ARG  36           HD3      ARG  36  23.532  10.527   5.941
  284    HE   ARG  36           HE       ARG  36  24.911   7.896   6.313
  285   HH11  ARG  36          HH11      ARG  36  22.318   8.696   7.711
  286   HH12  ARG  36          HH12      ARG  36  21.144   7.881   6.734
  287   HH21  ARG  36          HH21      ARG  36  23.342   7.331   4.096
  288   HH22  ARG  36          HH22      ARG  36  21.726   7.103   4.677
  Start of MODEL   29
    1    HA   SER   1           HA       SER   1 -16.439  -2.008  -7.777
    2    HB2  SER   1           HB2      SER   1 -19.298  -2.363  -8.731
    3    HB3  SER   1           HB3      SER   1 -18.678  -0.879  -8.011
    4    HG   SER   1           HG       SER   1 -18.439  -0.666 -10.194
    5    H    ASP   2           H        ASP   2 -17.467  -1.049  -5.770
    6    HA   ASP   2           HA       ASP   2 -18.360  -3.233  -3.929
    7    HB2  ASP   2           HB2      ASP   2 -16.356  -1.272  -3.834
    8    HB3  ASP   2           HB3      ASP   2 -17.602  -0.676  -2.739
    9    H    LEU   3           H        LEU   3 -20.263  -1.934  -5.737
   10    HA   LEU   3           HA       LEU   3 -21.742   0.118  -4.292
   11    HB2  LEU   3           HB2      LEU   3 -21.689  -1.100  -6.872
   12    HB3  LEU   3           HB3      LEU   3 -23.327  -1.281  -6.244
   13    HG   LEU   3           HG       LEU   3 -23.043   1.245  -5.565
   14   HD11  LEU   3          HD11      LEU   3 -20.618   1.264  -6.230
   15   HD12  LEU   3          HD12      LEU   3 -21.580   2.501  -7.039
   16   HD13  LEU   3          HD13      LEU   3 -21.124   1.032  -7.903
   17   HD21  LEU   3          HD21      LEU   3 -23.937   1.897  -7.788
   18   HD22  LEU   3          HD22      LEU   3 -24.677   0.407  -7.203
   19   HD23  LEU   3          HD23      LEU   3 -23.422   0.341  -8.440
   20    HA   PRO   4           HA       PRO   4 -24.698  -3.398  -3.133
   21    HB2  PRO   4           HB2      PRO   4 -24.257  -5.942  -4.024
   22    HB3  PRO   4           HB3      PRO   4 -25.137  -4.732  -4.973
   23    HG2  PRO   4           HG2      PRO   4 -22.397  -5.761  -5.315
   24    HG3  PRO   4           HG3      PRO   4 -23.521  -5.112  -6.515
   25    HD2  PRO   4           HD2      PRO   4 -21.337  -3.768  -5.368
   26    HD3  PRO   4           HD3      PRO   4 -22.631  -3.048  -6.346
   27    H    ALA   5           H        ALA   5 -22.415  -2.717  -1.710
   28    HA   ALA   5           HA       ALA   5 -21.925  -5.161  -0.079
   29    HB1  ALA   5           HB1      ALA   5 -20.064  -5.137  -1.580
   30    HB2  ALA   5           HB2      ALA   5 -19.459  -4.424  -0.084
   31    HB3  ALA   5           HB3      ALA   5 -19.887  -3.387  -1.445
   32    H    LEU   6           H        LEU   6 -21.080  -1.675  -0.353
   33    HA   LEU   6           HA       LEU   6 -21.023   0.031   1.278
   34    HB2  LEU   6           HB2      LEU   6 -23.302  -1.769   2.132
   35    HB3  LEU   6           HB3      LEU   6 -22.963  -0.242   2.945
   36    HG   LEU   6           HG       LEU   6 -23.180  -0.271  -0.047
   37   HD11  LEU   6          HD11      LEU   6 -25.175  -1.484   0.655
   38   HD12  LEU   6          HD12      LEU   6 -25.633   0.157   0.197
   39   HD13  LEU   6          HD13      LEU   6 -25.506  -0.280   1.901
   40   HD21  LEU   6          HD21      LEU   6 -22.491   1.727   1.420
   41   HD22  LEU   6          HD22      LEU   6 -24.166   1.759   1.967
   42   HD23  LEU   6          HD23      LEU   6 -23.789   2.010   0.262
   43    H    SER   7           H        SER   7 -19.089  -2.004   1.687
   44    HA   SER   7           HA       SER   7 -18.785  -1.877   4.649
   45    HB2  SER   7           HB2      SER   7 -19.862  -4.047   3.848
   46    HB3  SER   7           HB3      SER   7 -18.349  -4.391   3.015
   47    HG   SER   7           HG       SER   7 -18.979  -4.501   5.688
   48    H    THR   8           H        THR   8 -17.217  -3.072   1.668
   49    HA   THR   8           HA       THR   8 -14.606  -1.991   2.673
   50    HB   THR   8           HB       THR   8 -13.900  -3.650   0.688
   51    HG1  THR   8           HG1      THR   8 -16.139  -5.028   1.636
   52   HG21  THR   8          HG21      THR   8 -13.755  -5.462   2.394
   53   HG22  THR   8          HG22      THR   8 -14.790  -4.505   3.454
   54   HG23  THR   8          HG23      THR   8 -13.193  -3.905   3.002
   55    H    GLY   9           H        GLY   9 -16.752  -0.428   1.231
   56    HA2  GLY   9           HA2      GLY   9 -15.903  -0.059  -1.510
   57    HA3  GLY   9           HA3      GLY   9 -16.947   1.036  -0.601
   58    H    LEU  10           H        LEU  10 -15.794   2.422   1.058
   59    HA   LEU  10           HA       LEU  10 -13.384   3.605  -0.166
   60    HB2  LEU  10           HB2      LEU  10 -15.350   4.272   2.011
   61    HB3  LEU  10           HB3      LEU  10 -13.813   5.135   1.951
   62    HG   LEU  10           HG       LEU  10 -15.514   4.860  -0.522
   63   HD11  LEU  10          HD11      LEU  10 -15.731   6.993   1.626
   64   HD12  LEU  10          HD12      LEU  10 -16.979   5.826   1.188
   65   HD13  LEU  10          HD13      LEU  10 -16.498   7.074   0.039
   66   HD21  LEU  10          HD21      LEU  10 -13.251   5.661  -0.859
   67   HD22  LEU  10          HD22      LEU  10 -13.416   6.820   0.460
   68   HD23  LEU  10          HD23      LEU  10 -14.341   7.038  -1.026
   69    H    LEU  11           H        LEU  11 -14.267   1.734   2.710
   70    HA   LEU  11           HA       LEU  11 -11.896   2.067   4.256
   71    HB2  LEU  11           HB2      LEU  11 -14.183   0.198   4.024
   72    HB3  LEU  11           HB3      LEU  11 -12.749  -0.485   4.788
   73    HG   LEU  11           HG       LEU  11 -12.681   1.524   6.303
   74   HD11  LEU  11          HD11      LEU  11 -13.924   3.120   4.978
   75   HD12  LEU  11          HD12      LEU  11 -14.844   2.821   6.453
   76   HD13  LEU  11          HD13      LEU  11 -15.335   2.062   4.938
   77   HD21  LEU  11          HD21      LEU  11 -13.738  -0.646   6.964
   78   HD22  LEU  11          HD22      LEU  11 -15.285  -0.035   6.375
   79   HD23  LEU  11          HD23      LEU  11 -14.493   0.744   7.745
   80    H    HIS  12           H        HIS  12 -12.722  -0.629   2.018
   81    HA   HIS  12           HA       HIS  12 -10.170  -1.909   2.083
   82    HB2  HIS  12           HB2      HIS  12 -12.478  -2.648   1.160
   83    HB3  HIS  12           HB3      HIS  12 -12.012  -1.797  -0.311
   84    HD1  HIS  12           HD1      HIS  12 -12.216  -4.469  -1.135
   85    HD2  HIS  12           HD2      HIS  12  -8.868  -3.371   1.096
   86    HE1  HIS  12           HE1      HIS  12 -10.466  -6.253  -1.541
   87    H    LEU  13           H        LEU  13 -11.477   0.600  -0.107
   88    HA   LEU  13           HA       LEU  13  -9.262   0.791  -1.894
   89    HB2  LEU  13           HB2      LEU  13 -11.623   1.808  -1.996
   90    HB3  LEU  13           HB3      LEU  13 -11.007   3.076  -0.935
   91    HG   LEU  13           HG       LEU  13  -9.115   3.355  -2.665
   92   HD11  LEU  13          HD11      LEU  13  -9.990   2.705  -5.007
   93   HD12  LEU  13          HD12      LEU  13 -11.077   1.606  -4.154
   94   HD13  LEU  13          HD13      LEU  13  -9.330   1.411  -4.005
   95   HD21  LEU  13          HD21      LEU  13 -11.095   4.895  -2.317
   96   HD22  LEU  13          HD22      LEU  13 -11.923   4.014  -3.600
   97   HD23  LEU  13          HD23      LEU  13 -10.443   4.906  -3.954
   98    H    HIS  14           H        HIS  14  -9.913   2.435   1.211
   99    HA   HIS  14           HA       HIS  14  -7.637   4.174   1.224
  100    HB2  HIS  14           HB2      HIS  14  -9.457   4.549   2.730
  101    HB3  HIS  14           HB3      HIS  14  -9.388   2.897   3.340
  102    HD1  HIS  14           HD1      HIS  14  -7.627   6.217   3.575
  103    HD2  HIS  14           HD2      HIS  14  -7.409   2.439   5.324
  104    HE1  HIS  14           HE1      HIS  14  -6.058   6.430   5.553
  105    H    GLN  15           H        GLN  15  -8.101   0.914   2.655
  106    HA   GLN  15           HA       GLN  15  -5.546   0.582   3.826
  107    HB2  GLN  15           HB2      GLN  15  -7.683  -0.852   3.932
  108    HB3  GLN  15           HB3      GLN  15  -7.133  -1.583   2.424
  109    HG2  GLN  15           HG2      GLN  15  -6.249  -3.022   4.064
  110    HG3  GLN  15           HG3      GLN  15  -4.889  -1.966   3.684
  111   HE21  GLN  15          HE21      GLN  15  -3.937  -0.918   5.451
  112   HE22  GLN  15          HE22      GLN  15  -4.668  -0.738   6.975
  113    H    ASN  16           H        ASN  16  -6.609  -0.126   0.474
  114    HA   ASN  16           HA       ASN  16  -4.153  -1.278  -0.448
  115    HB2  ASN  16           HB2      ASN  16  -6.185  -1.515  -1.707
  116    HB3  ASN  16           HB3      ASN  16  -6.422   0.230  -1.778
  117   HD21  ASN  16          HD21      ASN  16  -3.702  -2.028  -2.611
  118   HD22  ASN  16          HD22      ASN  16  -3.403  -1.322  -4.126
  119    H    ILE  17           H        ILE  17  -5.343   2.106  -0.664
  120    HA   ILE  17           HA       ILE  17  -2.980   3.168  -1.919
  121    HB   ILE  17           HB       ILE  17  -5.189   4.375  -0.214
  122   HG12  ILE  17          HG12      ILE  17  -4.771   4.624  -3.198
  123   HG13  ILE  17          HG13      ILE  17  -5.647   3.258  -2.507
  124   HG21  ILE  17          HG21      ILE  17  -3.117   5.779  -1.936
  125   HG22  ILE  17          HG22      ILE  17  -3.198   5.837  -0.175
  126   HG23  ILE  17          HG23      ILE  17  -4.487   6.556  -1.141
  127   HD11  ILE  17          HD11      ILE  17  -6.805   5.382  -1.202
  128   HD12  ILE  17          HD12      ILE  17  -7.464   4.614  -2.646
  129   HD13  ILE  17          HD13      ILE  17  -6.479   6.070  -2.794
  130    H    VAL  18           H        VAL  18  -3.936   2.839   1.506
  131    HA   VAL  18           HA       VAL  18  -1.662   4.277   2.574
  132    HB   VAL  18           HB       VAL  18  -3.738   2.356   3.631
  133   HG11  VAL  18          HG11      VAL  18  -2.852   3.005   5.929
  134   HG12  VAL  18          HG12      VAL  18  -1.397   3.579   5.112
  135   HG13  VAL  18          HG13      VAL  18  -1.846   1.874   5.023
  136   HG21  VAL  18          HG21      VAL  18  -4.114   4.568   5.021
  137   HG22  VAL  18          HG22      VAL  18  -4.705   4.459   3.364
  138   HG23  VAL  18          HG23      VAL  18  -3.198   5.307   3.710
  139    H    ASP  19           H        ASP  19  -2.292   0.858   1.856
  140    HA   ASP  19           HA       ASP  19   0.290   0.008   2.984
  141    HB2  ASP  19           HB2      ASP  19  -2.109  -1.266   1.716
  142    HB3  ASP  19           HB3      ASP  19  -0.611  -2.191   1.817
  143    H    VAL  20           H        VAL  20  -0.463   1.558   0.125
  144    HA   VAL  20           HA       VAL  20   1.566   0.019  -1.442
  145    HB   VAL  20           HB       VAL  20  -0.912   0.566  -2.179
  146   HG11  VAL  20          HG11      VAL  20  -1.321   2.663  -3.087
  147   HG12  VAL  20          HG12      VAL  20   0.393   3.008  -3.326
  148   HG13  VAL  20          HG13      VAL  20  -0.307   3.089  -1.710
  149   HG21  VAL  20          HG21      VAL  20   0.774  -0.545  -3.587
  150   HG22  VAL  20          HG22      VAL  20   1.482   1.020  -3.988
  151   HG23  VAL  20          HG23      VAL  20  -0.149   0.623  -4.532
  152    H    GLN  21           H        GLN  21   1.035   2.989   0.226
  153    HA   GLN  21           HA       GLN  21   3.177   4.428  -1.251
  154    HB2  GLN  21           HB2      GLN  21   0.976   5.069   0.678
  155    HB3  GLN  21           HB3      GLN  21   2.367   6.152   0.630
  156    HG2  GLN  21           HG2      GLN  21   2.076   6.375  -1.833
  157    HG3  GLN  21           HG3      GLN  21   0.635   5.362  -1.731
  158   HE21  GLN  21          HE21      GLN  21   1.977   8.387  -0.273
  159   HE22  GLN  21          HE22      GLN  21   0.471   9.159  -0.144
  160    H    TYR  22           H        TYR  22   2.456   3.104   1.987
  161    HA   TYR  22           HA       TYR  22   4.801   4.070   3.319
  162    HB2  TYR  22           HB2      TYR  22   3.980   2.786   5.070
  163    HB3  TYR  22           HB3      TYR  22   2.536   2.839   4.067
  164    HD1  TYR  22           HD1      TYR  22   5.364   0.754   5.191
  165    HD2  TYR  22           HD2      TYR  22   1.799   0.897   2.810
  166    HE1  TYR  22           HE1      TYR  22   5.389  -1.716   5.003
  167    HE2  TYR  22           HE2      TYR  22   1.819  -1.575   2.626
  168    HH   TYR  22           HH       TYR  22   2.955  -3.533   4.299
  169    H    MET  23           H        MET  23   4.238   1.239   1.265
  170    HA   MET  23           HA       MET  23   6.749  -0.095   1.857
  171    HB2  MET  23           HB2      MET  23   4.350  -0.481   0.324
  172    HB3  MET  23           HB3      MET  23   5.735  -0.768  -0.727
  173    HG2  MET  23           HG2      MET  23   6.374  -1.991   1.737
  174    HG3  MET  23           HG3      MET  23   4.700  -2.431   1.396
  175    HE1  MET  23           HE1      MET  23   8.424  -3.087   0.573
  176    HE2  MET  23           HE2      MET  23   7.975  -1.680  -0.390
  177    HE3  MET  23           HE3      MET  23   8.403  -3.187  -1.194
  178    H    TYR  24           H        TYR  24   5.764   2.425  -0.408
  179    HA   TYR  24           HA       TYR  24   8.367   2.254  -1.852
  180    HB2  TYR  24           HB2      TYR  24   5.664   3.498  -2.284
  181    HB3  TYR  24           HB3      TYR  24   7.051   4.139  -3.163
  182    HD1  TYR  24           HD1      TYR  24   5.022   1.095  -2.539
  183    HD2  TYR  24           HD2      TYR  24   8.085   2.905  -4.947
  184    HE1  TYR  24           HE1      TYR  24   4.874  -0.789  -4.143
  185    HE2  TYR  24           HE2      TYR  24   7.938   1.019  -6.549
  186    HH   TYR  24           HH       TYR  24   5.520  -0.935  -6.869
  187    H    GLY  25           H        GLY  25   7.935   3.376   1.006
  188    HA2  GLY  25           HA2      GLY  25   9.236   6.016   0.481
  189    HA3  GLY  25           HA3      GLY  25   7.989   5.856   1.720
  190    H    LEU  26           H        LEU  26   8.470   4.626   3.628
  191    HA   LEU  26           HA       LEU  26   9.859   3.904   5.389
  192    HB2  LEU  26           HB2      LEU  26  10.437   2.470   3.100
  193    HB3  LEU  26           HB3      LEU  26  12.030   3.045   3.592
  194    HG   LEU  26           HG       LEU  26  10.253   1.933   5.720
  195   HD11  LEU  26          HD11      LEU  26  11.205  -0.366   5.139
  196   HD12  LEU  26          HD12      LEU  26  11.612   0.307   3.560
  197   HD13  LEU  26          HD13      LEU  26   9.928   0.227   4.077
  198   HD21  LEU  26          HD21      LEU  26  13.211   1.947   5.075
  199   HD22  LEU  26          HD22      LEU  26  12.536   0.992   6.394
  200   HD23  LEU  26          HD23      LEU  26  12.393   2.750   6.415
  201    H    SER  27           H        SER  27  10.306   6.651   4.035
  202    HA   SER  27           HA       SER  27  12.494   7.531   5.681
  203    HB2  SER  27           HB2      SER  27  13.053   6.547   2.957
  204    HB3  SER  27           HB3      SER  27  13.705   8.152   3.275
  205    HG   SER  27           HG       SER  27  14.157   5.733   4.681
  206    HA   PRO  28           HA       PRO  28  11.132  11.199   2.935
  207    HB2  PRO  28           HB2      PRO  28   9.574  10.712   0.736
  208    HB3  PRO  28           HB3      PRO  28  11.348  10.738   0.677
  209    HG2  PRO  28           HG2      PRO  28   9.493   8.410   0.806
  210    HG3  PRO  28           HG3      PRO  28  10.986   8.614  -0.126
  211    HD2  PRO  28           HD2      PRO  28  10.867   7.184   2.175
  212    HD3  PRO  28           HD3      PRO  28  12.328   8.042   1.642
  213    H    ALA  29           H        ALA  29   8.863   8.508   3.149
  214    HA   ALA  29           HA       ALA  29   6.458  10.095   3.464
  215    HB1  ALA  29           HB1      ALA  29   6.347   7.817   2.699
  216    HB2  ALA  29           HB2      ALA  29   5.605   7.846   4.299
  217    HB3  ALA  29           HB3      ALA  29   7.250   7.241   4.101
  218    H    ILE  30           H        ILE  30   9.088   9.413   5.611
  219    HA   ILE  30           HA       ILE  30   7.365  10.058   7.971
  220    HB   ILE  30           HB       ILE  30   8.573   7.824   7.821
  221   HG12  ILE  30          HG12      ILE  30   9.502   8.040  10.189
  222   HG13  ILE  30          HG13      ILE  30   9.116   9.758  10.087
  223   HG21  ILE  30          HG21      ILE  30  10.662   8.443   6.831
  224   HG22  ILE  30          HG22      ILE  30  11.022   7.960   8.487
  225   HG23  ILE  30          HG23      ILE  30  10.960   9.669   8.062
  226   HD11  ILE  30          HD11      ILE  30   7.027   7.683   9.447
  227   HD12  ILE  30          HD12      ILE  30   6.803   9.359   9.950
  228   HD13  ILE  30          HD13      ILE  30   7.343   8.153  11.118
  229    H    THR  31           H        THR  31  10.261  11.014   6.196
  230    HA   THR  31           HA       THR  31  10.916  13.058   8.257
  231    HB   THR  31           HB       THR  31  12.551  11.456   7.004
  232    HG1  THR  31           HG1      THR  31  13.036  14.251   7.112
  233   HG21  THR  31          HG21      THR  31  13.358  12.188   4.869
  234   HG22  THR  31          HG22      THR  31  12.400  13.667   4.942
  235   HG23  THR  31          HG23      THR  31  11.601  12.108   4.738
  236    H    LYS  32           H        LYS  32   9.327  12.808   5.158
  237    HA   LYS  32           HA       LYS  32   9.352  15.797   4.903
  238    HB2  LYS  32           HB2      LYS  32  10.093  13.803   3.127
  239    HB3  LYS  32           HB3      LYS  32   8.450  14.190   2.612
  240    HG2  LYS  32           HG2      LYS  32   9.353  16.691   2.937
  241    HG3  LYS  32           HG3      LYS  32  10.894  15.902   2.601
  242    HD2  LYS  32           HD2      LYS  32  10.399  15.852   0.408
  243    HD3  LYS  32           HD3      LYS  32   8.964  14.886   0.752
  244    HE2  LYS  32           HE2      LYS  32   8.106  16.833  -0.320
  245    HE3  LYS  32           HE3      LYS  32   7.858  17.159   1.407
  246    HZ1  LYS  32           HZ1      LYS  32   9.929  18.351   1.488
  247    HZ2  LYS  32           HZ2      LYS  32   8.985  19.006   0.236
  248    HZ3  LYS  32           HZ3      LYS  32  10.277  17.967  -0.128
  249    H    TYR  33           H        TYR  33   7.474  13.753   6.406
  250    HA   TYR  33           HA       TYR  33   4.914  14.866   5.299
  251    HB2  TYR  33           HB2      TYR  33   5.831  12.104   5.930
  252    HB3  TYR  33           HB3      TYR  33   4.168  12.491   6.362
  253    HD1  TYR  33           HD1      TYR  33   6.608  12.595   3.537
  254    HD2  TYR  33           HD2      TYR  33   2.482  12.585   4.720
  255    HE1  TYR  33           HE1      TYR  33   5.930  12.338   1.165
  256    HE2  TYR  33           HE2      TYR  33   1.801  12.331   2.349
  257    HH   TYR  33           HH       TYR  33   3.598  11.260   0.029
  258    H    VAL  34           H        VAL  34   6.802  15.525   7.709
  259    HA   VAL  34           HA       VAL  34   4.683  15.351   9.830
  260    HB   VAL  34           HB       VAL  34   7.706  15.383  10.163
  261   HG11  VAL  34          HG11      VAL  34   6.852  16.060  12.221
  262   HG12  VAL  34          HG12      VAL  34   6.837  14.307  12.420
  263   HG13  VAL  34          HG13      VAL  34   5.350  15.160  12.009
  264   HG21  VAL  34          HG21      VAL  34   7.355  12.940  10.754
  265   HG22  VAL  34          HG22      VAL  34   7.125  13.322   9.047
  266   HG23  VAL  34          HG23      VAL  34   5.725  13.086  10.094
  267    H    VAL  35           H        VAL  35   5.028  17.511   7.858
  268    HA   VAL  35           HA       VAL  35   5.665  19.758   9.737
  269    HB   VAL  35           HB       VAL  35   6.344  19.537   6.779
  270   HG11  VAL  35          HG11      VAL  35   6.037  21.836   7.217
  271   HG12  VAL  35          HG12      VAL  35   7.769  21.604   7.454
  272   HG13  VAL  35          HG13      VAL  35   6.694  21.705   8.849
  273   HG21  VAL  35          HG21      VAL  35   8.730  19.649   7.765
  274   HG22  VAL  35          HG22      VAL  35   7.870  18.118   7.925
  275   HG23  VAL  35          HG23      VAL  35   7.981  19.214   9.302
  276    H    ARG  36           H        ARG  36   3.156  19.283   9.837
  277    HA   ARG  36           HA       ARG  36   1.791  20.925   7.724
  278    HB2  ARG  36           HB2      ARG  36   1.219  18.288   8.980
  279    HB3  ARG  36           HB3      ARG  36  -0.173  19.333   8.704
  280    HG2  ARG  36           HG2      ARG  36   1.119  19.617   6.328
  281    HG3  ARG  36           HG3      ARG  36   1.580  17.966   6.742
  282    HD2  ARG  36           HD2      ARG  36  -1.264  18.488   7.253
  283    HD3  ARG  36           HD3      ARG  36  -0.820  18.694   5.547
  284    HE   ARG  36           HE       ARG  36  -0.069  16.235   7.093
  285   HH11  ARG  36          HH11      ARG  36  -2.676  16.221   5.559
  286   HH12  ARG  36          HH12      ARG  36  -2.191  15.521   4.051
  287   HH21  ARG  36          HH21      ARG  36   1.202  16.047   4.598
  288   HH22  ARG  36          HH22      ARG  36   0.014  15.421   3.506
  Start of MODEL   30
    1    HA   SER   1           HA       SER   1 -28.782   5.840  -3.705
    2    HB2  SER   1           HB2      SER   1 -30.512   7.921  -2.765
    3    HB3  SER   1           HB3      SER   1 -29.972   6.995  -1.368
    4    HG   SER   1           HG       SER   1 -28.521   8.695  -1.987
    5    H    ASP   2           H        ASP   2 -28.472   3.767  -2.979
    6    HA   ASP   2           HA       ASP   2 -30.364   2.695  -0.909
    7    HB2  ASP   2           HB2      ASP   2 -29.241   1.366  -3.395
    8    HB3  ASP   2           HB3      ASP   2 -30.111   0.501  -2.129
    9    H    LEU   3           H        LEU   3 -27.648   3.914  -0.644
   10    HA   LEU   3           HA       LEU   3 -25.578   3.485   0.410
   11    HB2  LEU   3           HB2      LEU   3 -27.424   2.827   2.037
   12    HB3  LEU   3           HB3      LEU   3 -27.130   1.158   1.559
   13    HG   LEU   3           HG       LEU   3 -24.591   1.906   2.079
   14   HD11  LEU   3          HD11      LEU   3 -25.324   4.200   2.734
   15   HD12  LEU   3          HD12      LEU   3 -24.533   3.342   4.056
   16   HD13  LEU   3          HD13      LEU   3 -26.290   3.493   4.030
   17   HD21  LEU   3          HD21      LEU   3 -24.925   0.891   4.337
   18   HD22  LEU   3          HD22      LEU   3 -25.716  -0.032   3.059
   19   HD23  LEU   3          HD23      LEU   3 -26.670   1.019   4.106
   20    HA   PRO   4           HA       PRO   4 -24.678  -0.151  -2.382
   21    HB2  PRO   4           HB2      PRO   4 -23.491   1.199  -4.444
   22    HB3  PRO   4           HB3      PRO   4 -25.236   0.888  -4.367
   23    HG2  PRO   4           HG2      PRO   4 -23.744   3.385  -3.882
   24    HG3  PRO   4           HG3      PRO   4 -25.397   3.146  -4.459
   25    HD2  PRO   4           HD2      PRO   4 -24.625   3.865  -1.858
   26    HD3  PRO   4           HD3      PRO   4 -26.240   3.331  -2.368
   27    H    ALA   5           H        ALA   5 -23.250   0.286  -0.177
   28    HA   ALA   5           HA       ALA   5 -20.457  -0.013  -1.024
   29    HB1  ALA   5           HB1      ALA   5 -19.695   1.937   0.341
   30    HB2  ALA   5           HB2      ALA   5 -21.383   2.361   0.629
   31    HB3  ALA   5           HB3      ALA   5 -20.724   2.426  -1.006
   32    H    LEU   6           H        LEU   6 -22.590   0.636   1.793
   33    HA   LEU   6           HA       LEU   6 -22.693  -0.382   3.920
   34    HB2  LEU   6           HB2      LEU   6 -22.942  -2.286   2.163
   35    HB3  LEU   6           HB3      LEU   6 -21.291  -2.713   2.609
   36    HG   LEU   6           HG       LEU   6 -22.558  -2.347   5.062
   37   HD11  LEU   6          HD11      LEU   6 -24.395  -3.761   3.107
   38   HD12  LEU   6          HD12      LEU   6 -24.758  -2.305   4.033
   39   HD13  LEU   6          HD13      LEU   6 -24.559  -3.849   4.861
   40   HD21  LEU   6          HD21      LEU   6 -20.917  -4.100   4.458
   41   HD22  LEU   6          HD22      LEU   6 -22.147  -4.912   3.488
   42   HD23  LEU   6          HD23      LEU   6 -22.335  -4.800   5.238
   43    H    SER   7           H        SER   7 -20.338   1.242   3.303
   44    HA   SER   7           HA       SER   7 -18.207   1.736   4.172
   45    HB2  SER   7           HB2      SER   7 -19.592   0.010   6.194
   46    HB3  SER   7           HB3      SER   7 -17.901   0.419   6.464
   47    HG   SER   7           HG       SER   7 -18.820   2.157   7.280
   48    H    THR   8           H        THR   8 -18.486  -0.578   2.265
   49    HA   THR   8           HA       THR   8 -16.087  -2.171   3.110
   50    HB   THR   8           HB       THR   8 -18.369  -2.909   1.242
   51    HG1  THR   8           HG1      THR   8 -19.214  -2.907   3.244
   52   HG21  THR   8          HG21      THR   8 -17.433  -5.234   1.635
   53   HG22  THR   8          HG22      THR   8 -16.027  -4.461   2.365
   54   HG23  THR   8          HG23      THR   8 -16.410  -4.172   0.668
   55    H    GLY   9           H        GLY   9 -16.963   0.324   1.101
   56    HA2  GLY   9           HA2      GLY   9 -15.203  -0.567  -1.136
   57    HA3  GLY   9           HA3      GLY   9 -16.379   0.744  -1.239
   58    H    LEU  10           H        LEU  10 -15.920   2.503   0.582
   59    HA   LEU  10           HA       LEU  10 -13.458   3.796  -0.036
   60    HB2  LEU  10           HB2      LEU  10 -15.831   4.215   1.525
   61    HB3  LEU  10           HB3      LEU  10 -14.436   4.631   2.520
   62    HG   LEU  10           HG       LEU  10 -13.843   5.704   0.001
   63   HD11  LEU  10          HD11      LEU  10 -16.050   5.543  -0.847
   64   HD12  LEU  10          HD12      LEU  10 -15.930   7.201  -0.254
   65   HD13  LEU  10          HD13      LEU  10 -16.766   5.980   0.705
   66   HD21  LEU  10          HD21      LEU  10 -13.349   6.675   2.232
   67   HD22  LEU  10          HD22      LEU  10 -15.058   7.064   2.430
   68   HD23  LEU  10          HD23      LEU  10 -14.114   7.853   1.166
   69    H    LEU  11           H        LEU  11 -14.372   1.796   2.794
   70    HA   LEU  11           HA       LEU  11 -11.970   2.128   4.307
   71    HB2  LEU  11           HB2      LEU  11 -14.139   1.134   5.068
   72    HB3  LEU  11           HB3      LEU  11 -13.806  -0.284   4.076
   73    HG   LEU  11           HG       LEU  11 -11.469   0.123   5.595
   74   HD11  LEU  11          HD11      LEU  11 -14.003   0.577   7.181
   75   HD12  LEU  11          HD12      LEU  11 -12.531   1.550   7.177
   76   HD13  LEU  11          HD13      LEU  11 -12.531  -0.047   7.927
   77   HD21  LEU  11          HD21      LEU  11 -11.992  -2.043   6.481
   78   HD22  LEU  11          HD22      LEU  11 -12.651  -2.012   4.846
   79   HD23  LEU  11          HD23      LEU  11 -13.721  -1.800   6.233
   80    H    HIS  12           H        HIS  12 -12.879  -0.457   1.985
   81    HA   HIS  12           HA       HIS  12 -10.377  -1.856   2.064
   82    HB2  HIS  12           HB2      HIS  12 -12.794  -1.697   0.316
   83    HB3  HIS  12           HB3      HIS  12 -11.360  -2.460  -0.370
   84    HD1  HIS  12           HD1      HIS  12 -14.275  -3.461   1.255
   85    HD2  HIS  12           HD2      HIS  12 -10.256  -4.326   1.945
   86    HE1  HIS  12           HE1      HIS  12 -14.225  -5.600   2.612
   87    H    LEU  13           H        LEU  13 -11.583   0.727  -0.107
   88    HA   LEU  13           HA       LEU  13  -9.349   0.815  -1.883
   89    HB2  LEU  13           HB2      LEU  13 -11.697   1.954  -1.928
   90    HB3  LEU  13           HB3      LEU  13 -10.924   3.231  -0.989
   91    HG   LEU  13           HG       LEU  13  -9.101   3.207  -2.830
   92   HD11  LEU  13          HD11      LEU  13 -11.341   1.641  -4.126
   93   HD12  LEU  13          HD12      LEU  13  -9.636   1.206  -4.010
   94   HD13  LEU  13          HD13      LEU  13 -10.140   2.521  -5.071
   95   HD21  LEU  13          HD21      LEU  13 -10.697   5.049  -2.541
   96   HD22  LEU  13          HD22      LEU  13 -11.924   4.148  -3.431
   97   HD23  LEU  13          HD23      LEU  13 -10.474   4.714  -4.258
   98    H    HIS  14           H        HIS  14  -9.966   2.541   1.187
   99    HA   HIS  14           HA       HIS  14  -7.636   4.182   1.230
  100    HB2  HIS  14           HB2      HIS  14  -9.454   4.554   2.756
  101    HB3  HIS  14           HB3      HIS  14  -9.372   2.900   3.361
  102    HD1  HIS  14           HD1      HIS  14  -7.488   6.180   3.475
  103    HD2  HIS  14           HD2      HIS  14  -7.463   2.477   5.387
  104    HE1  HIS  14           HE1      HIS  14  -5.905   6.398   5.443
  105    H    GLN  15           H        GLN  15  -8.162   1.008   2.836
  106    HA   GLN  15           HA       GLN  15  -5.559   0.579   3.832
  107    HB2  GLN  15           HB2      GLN  15  -7.995  -0.849   3.424
  108    HB3  GLN  15           HB3      GLN  15  -6.688  -1.869   2.823
  109    HG2  GLN  15           HG2      GLN  15  -6.854  -2.410   5.126
  110    HG3  GLN  15           HG3      GLN  15  -5.474  -1.318   5.026
  111   HE21  GLN  15          HE21      GLN  15  -5.583   0.615   6.240
  112   HE22  GLN  15          HE22      GLN  15  -6.968   1.133   7.073
  113    H    ASN  16           H        ASN  16  -6.838  -0.024   0.563
  114    HA   ASN  16           HA       ASN  16  -4.550  -1.410  -0.487
  115    HB2  ASN  16           HB2      ASN  16  -6.996  -1.098  -1.348
  116    HB3  ASN  16           HB3      ASN  16  -6.384   0.388  -2.074
  117   HD21  ASN  16          HD21      ASN  16  -4.309   0.053  -3.469
  118   HD22  ASN  16          HD22      ASN  16  -4.229  -1.373  -4.386
  119    H    ILE  17           H        ILE  17  -5.485   2.057  -0.603
  120    HA   ILE  17           HA       ILE  17  -3.098   2.897  -2.033
  121    HB   ILE  17           HB       ILE  17  -5.211   4.317  -0.378
  122   HG12  ILE  17          HG12      ILE  17  -4.804   4.436  -3.367
  123   HG13  ILE  17          HG13      ILE  17  -5.724   3.123  -2.633
  124   HG21  ILE  17          HG21      ILE  17  -3.409   5.836  -0.314
  125   HG22  ILE  17          HG22      ILE  17  -4.317   6.349  -1.737
  126   HG23  ILE  17          HG23      ILE  17  -2.853   5.384  -1.926
  127   HD11  ILE  17          HD11      ILE  17  -7.446   4.620  -2.963
  128   HD12  ILE  17          HD12      ILE  17  -6.390   6.026  -2.828
  129   HD13  ILE  17          HD13      ILE  17  -6.908   5.168  -1.376
  130    H    VAL  18           H        VAL  18  -3.975   2.623   1.391
  131    HA   VAL  18           HA       VAL  18  -1.788   4.127   2.484
  132    HB   VAL  18           HB       VAL  18  -3.582   1.904   3.496
  133   HG11  VAL  18          HG11      VAL  18  -2.489   1.812   5.471
  134   HG12  VAL  18          HG12      VAL  18  -2.314   3.564   5.542
  135   HG13  VAL  18          HG13      VAL  18  -1.143   2.597   4.647
  136   HG21  VAL  18          HG21      VAL  18  -5.034   3.576   3.914
  137   HG22  VAL  18          HG22      VAL  18  -3.967   4.650   3.010
  138   HG23  VAL  18          HG23      VAL  18  -3.798   4.507   4.759
  139    H    ASP  19           H        ASP  19  -2.171   0.604   1.946
  140    HA   ASP  19           HA       ASP  19   0.588   0.060   2.778
  141    HB2  ASP  19           HB2      ASP  19  -1.845  -1.341   2.350
  142    HB3  ASP  19           HB3      ASP  19  -0.654  -2.065   1.272
  143    H    VAL  20           H        VAL  20   0.708   1.964   0.746
  144    HA   VAL  20           HA       VAL  20   1.977   0.419  -1.476
  145    HB   VAL  20           HB       VAL  20   0.029   2.737  -1.611
  146   HG11  VAL  20          HG11      VAL  20   2.018   1.722  -3.633
  147   HG12  VAL  20          HG12      VAL  20   1.609   3.388  -3.221
  148   HG13  VAL  20          HG13      VAL  20   0.486   2.412  -4.167
  149   HG21  VAL  20          HG21      VAL  20  -0.006   0.112  -3.108
  150   HG22  VAL  20          HG22      VAL  20  -1.336   1.245  -2.862
  151   HG23  VAL  20          HG23      VAL  20  -0.733   0.286  -1.511
  152    H    GLN  21           H        GLN  21   1.601   3.624   0.033
  153    HA   GLN  21           HA       GLN  21   4.225   4.512  -0.971
  154    HB2  GLN  21           HB2      GLN  21   2.061   5.697   0.801
  155    HB3  GLN  21           HB3      GLN  21   3.541   6.565   0.379
  156    HG2  GLN  21           HG2      GLN  21   2.920   6.027  -2.077
  157    HG3  GLN  21           HG3      GLN  21   1.315   5.657  -1.445
  158   HE21  GLN  21          HE21      GLN  21   0.201   7.465  -0.219
  159   HE22  GLN  21          HE22      GLN  21   0.576   9.072  -0.620
  160    H    TYR  22           H        TYR  22   2.894   3.085   1.941
  161    HA   TYR  22           HA       TYR  22   5.277   3.803   3.562
  162    HB2  TYR  22           HB2      TYR  22   2.946   2.047   4.363
  163    HB3  TYR  22           HB3      TYR  22   3.969   3.035   5.402
  164    HD1  TYR  22           HD1      TYR  22   3.969   5.559   3.632
  165    HD2  TYR  22           HD2      TYR  22   0.820   2.953   4.956
  166    HE1  TYR  22           HE1      TYR  22   2.337   7.409   3.396
  167    HE2  TYR  22           HE2      TYR  22  -0.810   4.803   4.720
  168    HH   TYR  22           HH       TYR  22  -0.715   7.356   4.741
  169    H    MET  23           H        MET  23   3.771   1.004   1.989
  170    HA   MET  23           HA       MET  23   5.841  -0.830   3.061
  171    HB2  MET  23           HB2      MET  23   3.145  -1.000   2.237
  172    HB3  MET  23           HB3      MET  23   4.062  -1.917   1.041
  173    HG2  MET  23           HG2      MET  23   4.557  -2.287   3.993
  174    HG3  MET  23           HG3      MET  23   3.270  -3.166   3.169
  175    HE1  MET  23           HE1      MET  23   7.118  -2.390   3.278
  176    HE2  MET  23           HE2      MET  23   7.631  -4.074   3.356
  177    HE3  MET  23           HE3      MET  23   6.476  -3.456   4.535
  178    H    TYR  24           H        TYR  24   4.838   0.645  -0.030
  179    HA   TYR  24           HA       TYR  24   7.182  -0.615  -1.388
  180    HB2  TYR  24           HB2      TYR  24   4.467   0.123  -2.067
  181    HB3  TYR  24           HB3      TYR  24   5.594   0.898  -3.177
  182    HD1  TYR  24           HD1      TYR  24   4.458  -2.355  -1.810
  183    HD2  TYR  24           HD2      TYR  24   6.905  -0.384  -4.741
  184    HE1  TYR  24           HE1      TYR  24   4.782  -4.511  -2.992
  185    HE2  TYR  24           HE2      TYR  24   7.227  -2.539  -5.923
  186    HH   TYR  24           HH       TYR  24   6.997  -5.277  -4.841
  187    H    GLY  25           H        GLY  25   7.105   1.923   0.491
  188    HA2  GLY  25           HA2      GLY  25   9.047   3.428  -1.077
  189    HA3  GLY  25           HA3      GLY  25   7.533   4.300  -0.864
  190    H    LEU  26           H        LEU  26   8.929   2.138   1.594
  191    HA   LEU  26           HA       LEU  26   9.898   4.472   3.155
  192    HB2  LEU  26           HB2      LEU  26   7.294   3.537   3.388
  193    HB3  LEU  26           HB3      LEU  26   8.125   2.750   4.729
  194    HG   LEU  26           HG       LEU  26   8.883   5.565   4.427
  195   HD11  LEU  26          HD11      LEU  26   6.509   5.672   3.658
  196   HD12  LEU  26          HD12      LEU  26   6.766   6.509   5.190
  197   HD13  LEU  26          HD13      LEU  26   6.016   4.913   5.172
  198   HD21  LEU  26          HD21      LEU  26   9.350   4.046   6.381
  199   HD22  LEU  26          HD22      LEU  26   7.622   4.045   6.731
  200   HD23  LEU  26          HD23      LEU  26   8.541   5.547   6.832
  201    H    SER  27           H        SER  27  10.799   1.653   2.031
  202    HA   SER  27           HA       SER  27  11.864   0.551   4.596
  203    HB2  SER  27           HB2      SER  27  11.125  -0.543   1.914
  204    HB3  SER  27           HB3      SER  27  12.408  -1.360   2.803
  205    HG   SER  27           HG       SER  27  11.010  -1.891   4.352
  206    HA   PRO  28           HA       PRO  28  15.810   0.930   2.023
  207    HB2  PRO  28           HB2      PRO  28  15.715   1.575  -0.631
  208    HB3  PRO  28           HB3      PRO  28  15.550  -0.089  -0.043
  209    HG2  PRO  28           HG2      PRO  28  13.482   1.775  -1.036
  210    HG3  PRO  28           HG3      PRO  28  13.559   0.012  -1.133
  211    HD2  PRO  28           HD2      PRO  28  12.017   1.481   0.659
  212    HD3  PRO  28           HD3      PRO  28  12.418  -0.242   0.795
  213    H    ALA  29           H        ALA  29  14.990   2.968   3.431
  214    HA   ALA  29           HA       ALA  29  16.122   5.354   2.174
  215    HB1  ALA  29           HB1      ALA  29  13.840   6.574   2.650
  216    HB2  ALA  29           HB2      ALA  29  13.160   4.950   2.550
  217    HB3  ALA  29           HB3      ALA  29  14.016   5.634   1.168
  218    H    ILE  30           H        ILE  30  14.004   4.209   4.833
  219    HA   ILE  30           HA       ILE  30  15.040   6.208   6.710
  220    HB   ILE  30           HB       ILE  30  13.272   3.761   7.038
  221   HG12  ILE  30          HG12      ILE  30  12.343   5.461   5.499
  222   HG13  ILE  30          HG13      ILE  30  11.420   5.398   6.999
  223   HG21  ILE  30          HG21      ILE  30  14.199   4.390   9.188
  224   HG22  ILE  30          HG22      ILE  30  12.525   4.943   9.127
  225   HG23  ILE  30          HG23      ILE  30  13.842   6.092   8.891
  226   HD11  ILE  30          HD11      ILE  30  12.793   7.326   7.850
  227   HD12  ILE  30          HD12      ILE  30  11.806   7.728   6.446
  228   HD13  ILE  30          HD13      ILE  30  13.535   7.440   6.254
  229    H    THR  31           H        THR  31  15.466   2.720   6.151
  230    HA   THR  31           HA       THR  31  17.145   2.256   8.470
  231    HB   THR  31           HB       THR  31  16.879   0.748   5.843
  232    HG1  THR  31           HG1      THR  31  15.288  -0.398   6.951
  233   HG21  THR  31          HG21      THR  31  17.754  -0.207   8.586
  234   HG22  THR  31          HG22      THR  31  18.844   0.104   7.234
  235   HG23  THR  31          HG23      THR  31  17.647  -1.187   7.124
  236    H    LYS  32           H        LYS  32  17.820   2.911   5.020
  237    HA   LYS  32           HA       LYS  32  20.697   2.729   5.245
  238    HB2  LYS  32           HB2      LYS  32  18.634   3.466   3.282
  239    HB3  LYS  32           HB3      LYS  32  20.132   4.374   3.090
  240    HG2  LYS  32           HG2      LYS  32  21.377   2.177   3.174
  241    HG3  LYS  32           HG3      LYS  32  19.814   1.362   3.116
  242    HD2  LYS  32           HD2      LYS  32  19.302   2.360   0.968
  243    HD3  LYS  32           HD3      LYS  32  20.747   3.369   1.045
  244    HE2  LYS  32           HE2      LYS  32  21.817   1.705  -0.076
  245    HE3  LYS  32           HE3      LYS  32  21.703   0.751   1.416
  246    HZ1  LYS  32           HZ1      LYS  32  20.633  -0.429  -0.388
  247    HZ2  LYS  32           HZ2      LYS  32  19.648   0.911  -0.734
  248    HZ3  LYS  32           HZ3      LYS  32  19.459   0.069   0.731
  249    H    TYR  33           H        TYR  33  18.441   5.164   6.195
  250    HA   TYR  33           HA       TYR  33  20.107   7.506   5.889
  251    HB2  TYR  33           HB2      TYR  33  17.504   7.027   6.415
  252    HB3  TYR  33           HB3      TYR  33  18.071   7.305   8.061
  253    HD1  TYR  33           HD1      TYR  33  19.323   9.446   8.588
  254    HD2  TYR  33           HD2      TYR  33  17.242   8.822   4.881
  255    HE1  TYR  33           HE1      TYR  33  19.339  11.889   8.168
  256    HE2  TYR  33           HE2      TYR  33  17.258  11.266   4.462
  257    HH   TYR  33           HH       TYR  33  19.102  13.306   5.559
  258    H    VAL  34           H        VAL  34  19.502   5.265   8.619
  259    HA   VAL  34           HA       VAL  34  21.673   6.624  10.168
  260    HB   VAL  34           HB       VAL  34  19.597   4.568  11.014
  261   HG11  VAL  34          HG11      VAL  34  21.034   4.492  12.790
  262   HG12  VAL  34          HG12      VAL  34  20.238   6.001  13.236
  263   HG13  VAL  34          HG13      VAL  34  21.780   6.037  12.382
  264   HG21  VAL  34          HG21      VAL  34  19.581   7.600  11.192
  265   HG22  VAL  34          HG22      VAL  34  18.428   6.548  12.013
  266   HG23  VAL  34          HG23      VAL  34  18.474   6.598  10.252
  267    H    VAL  35           H        VAL  35  21.820   4.453   7.879
  268    HA   VAL  35           HA       VAL  35  23.091   2.548   7.384
  269    HB   VAL  35           HB       VAL  35  24.594   4.446   8.616
  270   HG11  VAL  35          HG11      VAL  35  25.720   2.116  10.035
  271   HG12  VAL  35          HG12      VAL  35  24.223   2.736  10.728
  272   HG13  VAL  35          HG13      VAL  35  25.614   3.802  10.542
  273   HG21  VAL  35          HG21      VAL  35  25.241   3.093   6.671
  274   HG22  VAL  35          HG22      VAL  35  25.531   1.705   7.721
  275   HG23  VAL  35          HG23      VAL  35  26.550   3.139   7.853
  276    H    ARG  36           H        ARG  36  20.895   2.310   9.517
  277    HA   ARG  36           HA       ARG  36  21.505  -0.453  10.297
  278    HB2  ARG  36           HB2      ARG  36  22.523   1.384  11.946
  279    HB3  ARG  36           HB3      ARG  36  20.873   1.400  12.567
  280    HG2  ARG  36           HG2      ARG  36  21.356  -1.297  12.340
  281    HG3  ARG  36           HG3      ARG  36  22.946  -0.684  12.795
  282    HD2  ARG  36           HD2      ARG  36  21.915  -1.043  14.891
  283    HD3  ARG  36           HD3      ARG  36  21.600   0.680  14.608
  284    HE   ARG  36           HE       ARG  36  19.430  -0.393  13.411
  285   HH11  ARG  36          HH11      ARG  36  19.196   0.682  16.205
  286   HH12  ARG  36          HH12      ARG  36  18.546  -0.675  17.064
  287   HH21  ARG  36          HH21      ARG  36  19.366  -2.967  14.581
  288   HH22  ARG  36          HH22      ARG  36  18.643  -2.752  16.139
  Start of MODEL   31
    1    HA   SER   1           HA       SER   1 -27.574  -0.695  -3.791
    2    HB2  SER   1           HB2      SER   1 -29.336   0.475  -2.260
    3    HB3  SER   1           HB3      SER   1 -29.840  -0.034  -3.868
    4    HG   SER   1           HG       SER   1 -30.786  -0.796  -1.485
    5    H    ASP   2           H        ASP   2 -25.691  -1.197  -2.610
    6    HA   ASP   2           HA       ASP   2 -26.025  -1.588   0.350
    7    HB2  ASP   2           HB2      ASP   2 -23.847  -2.435  -1.588
    8    HB3  ASP   2           HB3      ASP   2 -23.800  -2.721   0.150
    9    H    LEU   3           H        LEU   3 -26.072   0.747   0.692
   10    HA   LEU   3           HA       LEU   3 -23.353   1.967   0.674
   11    HB2  LEU   3           HB2      LEU   3 -24.845   2.472  -1.402
   12    HB3  LEU   3           HB3      LEU   3 -25.768   3.487  -0.296
   13    HG   LEU   3           HG       LEU   3 -23.083   4.138   0.207
   14   HD11  LEU   3          HD11      LEU   3 -22.558   2.953  -1.945
   15   HD12  LEU   3          HD12      LEU   3 -22.155   4.670  -1.973
   16   HD13  LEU   3          HD13      LEU   3 -23.614   4.094  -2.779
   17   HD21  LEU   3          HD21      LEU   3 -23.725   6.308  -0.717
   18   HD22  LEU   3          HD22      LEU   3 -25.083   5.638   0.187
   19   HD23  LEU   3          HD23      LEU   3 -25.078   5.573  -1.575
   20    HA   PRO   4           HA       PRO   4 -26.064   2.923   4.380
   21    HB2  PRO   4           HB2      PRO   4 -24.966   1.221   6.212
   22    HB3  PRO   4           HB3      PRO   4 -26.322   0.770   5.162
   23    HG2  PRO   4           HG2      PRO   4 -23.480   0.001   5.005
   24    HG3  PRO   4           HG3      PRO   4 -24.920  -0.866   4.456
   25    HD2  PRO   4           HD2      PRO   4 -23.131   0.590   2.851
   26    HD3  PRO   4           HD3      PRO   4 -24.723  -0.031   2.365
   27    H    ALA   5           H        ALA   5 -22.599   2.087   4.408
   28    HA   ALA   5           HA       ALA   5 -21.930   4.755   5.489
   29    HB1  ALA   5           HB1      ALA   5 -20.834   3.819   7.466
   30    HB2  ALA   5           HB2      ALA   5 -21.219   2.180   6.936
   31    HB3  ALA   5           HB3      ALA   5 -22.511   3.275   7.428
   32    H    LEU   6           H        LEU   6 -20.666   1.495   4.669
   33    HA   LEU   6           HA       LEU   6 -18.567   2.742   2.999
   34    HB2  LEU   6           HB2      LEU   6 -16.819   1.372   4.291
   35    HB3  LEU   6           HB3      LEU   6 -17.458   2.798   5.101
   36    HG   LEU   6           HG       LEU   6 -19.186   0.618   5.739
   37   HD11  LEU   6          HD11      LEU   6 -16.508  -0.264   5.257
   38   HD12  LEU   6          HD12      LEU   6 -17.861  -1.190   5.907
   39   HD13  LEU   6          HD13      LEU   6 -16.794  -0.305   6.997
   40   HD21  LEU   6          HD21      LEU   6 -18.399   1.122   8.034
   41   HD22  LEU   6          HD22      LEU   6 -18.750   2.598   7.136
   42   HD23  LEU   6          HD23      LEU   6 -17.080   2.080   7.362
   43    H    SER   7           H        SER   7 -19.926  -0.300   4.314
   44    HA   SER   7           HA       SER   7 -20.041  -2.467   3.405
   45    HB2  SER   7           HB2      SER   7 -21.225  -2.436   1.357
   46    HB3  SER   7           HB3      SER   7 -21.591  -0.875   2.081
   47    HG   SER   7           HG       SER   7 -20.594  -1.304  -0.277
   48    H    THR   8           H        THR   8 -17.343  -1.636   3.668
   49    HA   THR   8           HA       THR   8 -15.177  -2.222   2.951
   50    HB   THR   8           HB       THR   8 -16.553  -4.175   1.102
   51    HG1  THR   8           HG1      THR   8 -17.493  -5.051   2.744
   52   HG21  THR   8          HG21      THR   8 -14.645  -5.453   1.364
   53   HG22  THR   8          HG22      THR   8 -14.313  -4.815   2.975
   54   HG23  THR   8          HG23      THR   8 -13.954  -3.841   1.549
   55    H    GLY   9           H        GLY   9 -16.552  -0.062   1.499
   56    HA2  GLY   9           HA2      GLY   9 -15.532  -0.435  -1.280
   57    HA3  GLY   9           HA3      GLY   9 -16.677   0.813  -0.777
   58    H    LEU  10           H        LEU  10 -15.876   2.624   0.447
   59    HA   LEU  10           HA       LEU  10 -13.323   3.640  -0.362
   60    HB2  LEU  10           HB2      LEU  10 -15.627   4.610   0.762
   61    HB3  LEU  10           HB3      LEU  10 -14.535   4.661   2.146
   62    HG   LEU  10           HG       LEU  10 -13.611   5.719  -0.512
   63   HD11  LEU  10          HD11      LEU  10 -15.852   6.740   0.028
   64   HD12  LEU  10          HD12      LEU  10 -14.526   7.902  -0.013
   65   HD13  LEU  10          HD13      LEU  10 -15.157   7.336   1.535
   66   HD21  LEU  10          HD21      LEU  10 -11.889   5.642   1.113
   67   HD22  LEU  10          HD22      LEU  10 -12.970   6.155   2.408
   68   HD23  LEU  10          HD23      LEU  10 -12.455   7.311   1.180
   69    H    LEU  11           H        LEU  11 -14.399   1.963   2.594
   70    HA   LEU  11           HA       LEU  11 -12.064   2.321   4.194
   71    HB2  LEU  11           HB2      LEU  11 -14.493   1.202   4.513
   72    HB3  LEU  11           HB3      LEU  11 -13.559  -0.268   4.238
   73    HG   LEU  11           HG       LEU  11 -12.432   1.731   6.147
   74   HD11  LEU  11          HD11      LEU  11 -14.599  -0.206   6.989
   75   HD12  LEU  11          HD12      LEU  11 -14.927   1.491   6.642
   76   HD13  LEU  11          HD13      LEU  11 -13.838   1.055   7.959
   77   HD21  LEU  11          HD21      LEU  11 -11.456  -0.565   5.407
   78   HD22  LEU  11          HD22      LEU  11 -12.691  -1.262   6.455
   79   HD23  LEU  11          HD23      LEU  11 -11.465  -0.188   7.130
   80    H    HIS  12           H        HIS  12 -12.911  -0.317   1.908
   81    HA   HIS  12           HA       HIS  12 -10.435  -1.767   2.219
   82    HB2  HIS  12           HB2      HIS  12 -12.802  -2.362   1.189
   83    HB3  HIS  12           HB3      HIS  12 -12.072  -1.772  -0.304
   84    HD1  HIS  12           HD1      HIS  12  -9.643  -2.938  -0.880
   85    HD2  HIS  12           HD2      HIS  12 -12.124  -4.981   1.777
   86    HE1  HIS  12           HE1      HIS  12  -8.793  -5.321  -0.792
   87    H    LEU  13           H        LEU  13 -11.567   0.650  -0.167
   88    HA   LEU  13           HA       LEU  13  -9.258   0.677  -1.847
   89    HB2  LEU  13           HB2      LEU  13 -11.715   2.057  -1.527
   90    HB3  LEU  13           HB3      LEU  13 -10.459   3.294  -1.523
   91    HG   LEU  13           HG       LEU  13  -9.708   1.519  -3.564
   92   HD11  LEU  13          HD11      LEU  13 -11.842   1.655  -4.985
   93   HD12  LEU  13          HD12      LEU  13 -12.695   1.983  -3.476
   94   HD13  LEU  13          HD13      LEU  13 -11.835   0.457  -3.690
   95   HD21  LEU  13          HD21      LEU  13 -10.313   3.443  -5.030
   96   HD22  LEU  13          HD22      LEU  13  -9.425   3.953  -3.595
   97   HD23  LEU  13          HD23      LEU  13 -11.173   4.176  -3.676
   98    H    HIS  14           H        HIS  14 -10.016   2.484   1.137
   99    HA   HIS  14           HA       HIS  14  -7.764   4.227   1.183
  100    HB2  HIS  14           HB2      HIS  14  -9.369   4.741   2.773
  101    HB3  HIS  14           HB3      HIS  14  -9.723   3.050   3.111
  102    HD1  HIS  14           HD1      HIS  14  -8.862   2.232   5.297
  103    HD2  HIS  14           HD2      HIS  14  -6.605   5.444   3.891
  104    HE1  HIS  14           HE1      HIS  14  -7.152   2.751   7.094
  105    H    GLN  15           H        GLN  15  -8.156   1.054   2.834
  106    HA   GLN  15           HA       GLN  15  -5.502   0.807   3.804
  107    HB2  GLN  15           HB2      GLN  15  -7.883  -0.699   3.686
  108    HB3  GLN  15           HB3      GLN  15  -6.644  -1.727   2.964
  109    HG2  GLN  15           HG2      GLN  15  -6.509  -0.384   5.682
  110    HG3  GLN  15           HG3      GLN  15  -6.698  -2.111   5.375
  111   HE21  GLN  15          HE21      GLN  15  -4.814  -3.253   4.369
  112   HE22  GLN  15          HE22      GLN  15  -3.255  -2.602   4.531
  113    H    ASN  16           H        ASN  16  -6.862  -0.066   0.626
  114    HA   ASN  16           HA       ASN  16  -4.630  -1.486  -0.437
  115    HB2  ASN  16           HB2      ASN  16  -7.053  -1.083  -1.303
  116    HB3  ASN  16           HB3      ASN  16  -6.396   0.393  -2.013
  117   HD21  ASN  16          HD21      ASN  16  -4.369   0.026  -3.448
  118   HD22  ASN  16          HD22      ASN  16  -4.327  -1.398  -4.372
  119    H    ILE  17           H        ILE  17  -5.306   1.996  -0.217
  120    HA   ILE  17           HA       ILE  17  -2.921   2.756  -1.762
  121    HB   ILE  17           HB       ILE  17  -4.899   4.309  -0.053
  122   HG12  ILE  17          HG12      ILE  17  -5.949   3.204  -1.988
  123   HG13  ILE  17          HG13      ILE  17  -5.882   4.947  -2.241
  124   HG21  ILE  17          HG21      ILE  17  -3.044   5.734  -0.214
  125   HG22  ILE  17          HG22      ILE  17  -4.009   6.207  -1.612
  126   HG23  ILE  17          HG23      ILE  17  -2.612   5.151  -1.822
  127   HD11  ILE  17          HD11      ILE  17  -5.181   3.870  -4.291
  128   HD12  ILE  17          HD12      ILE  17  -4.025   2.861  -3.422
  129   HD13  ILE  17          HD13      ILE  17  -3.756   4.600  -3.550
  130    H    VAL  18           H        VAL  18  -3.897   2.585   1.654
  131    HA   VAL  18           HA       VAL  18  -1.659   3.927   2.811
  132    HB   VAL  18           HB       VAL  18  -3.366   1.642   3.856
  133   HG11  VAL  18          HG11      VAL  18  -1.406   1.979   5.265
  134   HG12  VAL  18          HG12      VAL  18  -2.822   2.637   6.084
  135   HG13  VAL  18          HG13      VAL  18  -1.682   3.721   5.286
  136   HG21  VAL  18          HG21      VAL  18  -4.065   4.282   3.109
  137   HG22  VAL  18          HG22      VAL  18  -4.017   4.263   4.871
  138   HG23  VAL  18          HG23      VAL  18  -5.049   3.127   4.005
  139    H    ASP  19           H        ASP  19  -1.937   0.731   1.426
  140    HA   ASP  19           HA       ASP  19   0.521  -0.270   2.717
  141    HB2  ASP  19           HB2      ASP  19  -1.515  -1.654   2.192
  142    HB3  ASP  19           HB3      ASP  19  -1.182  -1.417   0.476
  143    H    VAL  20           H        VAL  20  -0.362   1.383  -0.243
  144    HA   VAL  20           HA       VAL  20   2.284   0.733  -1.466
  145    HB   VAL  20           HB       VAL  20  -0.170   2.132  -2.589
  146   HG11  VAL  20          HG11      VAL  20   0.885   1.977  -4.717
  147   HG12  VAL  20          HG12      VAL  20   2.119   0.873  -4.111
  148   HG13  VAL  20          HG13      VAL  20   2.142   2.569  -3.632
  149   HG21  VAL  20          HG21      VAL  20  -0.724  -0.172  -2.093
  150   HG22  VAL  20          HG22      VAL  20   0.799  -0.736  -2.781
  151   HG23  VAL  20          HG23      VAL  20  -0.443  -0.053  -3.830
  152    H    GLN  21           H        GLN  21   0.205   3.474  -0.573
  153    HA   GLN  21           HA       GLN  21   1.937   5.607  -1.315
  154    HB2  GLN  21           HB2      GLN  21  -0.539   5.523  -0.517
  155    HB3  GLN  21           HB3      GLN  21   0.136   5.616   1.109
  156    HG2  GLN  21           HG2      GLN  21   1.127   7.737   0.690
  157    HG3  GLN  21           HG3      GLN  21   0.904   7.584  -1.053
  158   HE21  GLN  21          HE21      GLN  21  -0.797   8.865  -1.783
  159   HE22  GLN  21          HE22      GLN  21  -2.210   9.206  -0.907
  160    H    TYR  22           H        TYR  22   1.735   3.762   1.752
  161    HA   TYR  22           HA       TYR  22   3.570   5.311   3.268
  162    HB2  TYR  22           HB2      TYR  22   3.165   3.674   4.809
  163    HB3  TYR  22           HB3      TYR  22   1.995   3.094   3.632
  164    HD1  TYR  22           HD1      TYR  22   5.516   2.701   4.798
  165    HD2  TYR  22           HD2      TYR  22   2.277   1.010   2.548
  166    HE1  TYR  22           HE1      TYR  22   6.771   0.573   4.591
  167    HE2  TYR  22           HE2      TYR  22   3.531  -1.118   2.338
  168    HH   TYR  22           HH       TYR  22   6.348  -1.606   2.468
  169    H    MET  23           H        MET  23   4.215   2.753   0.867
  170    HA   MET  23           HA       MET  23   7.151   3.144   1.331
  171    HB2  MET  23           HB2      MET  23   5.624   0.878   1.272
  172    HB3  MET  23           HB3      MET  23   6.165   0.955  -0.404
  173    HG2  MET  23           HG2      MET  23   8.519   1.413   0.649
  174    HG3  MET  23           HG3      MET  23   7.810   0.704   2.100
  175    HE1  MET  23           HE1      MET  23   9.355  -0.809  -1.642
  176    HE2  MET  23           HE2      MET  23   8.439   0.678  -1.411
  177    HE3  MET  23           HE3      MET  23   7.629  -0.760  -2.028
  178    H    TYR  24           H        TYR  24   5.326   4.922  -0.332
  179    HA   TYR  24           HA       TYR  24   6.044   4.405  -3.120
  180    HB2  TYR  24           HB2      TYR  24   4.190   5.941  -1.665
  181    HB3  TYR  24           HB3      TYR  24   5.214   7.118  -2.486
  182    HD1  TYR  24           HD1      TYR  24   5.618   6.813  -5.005
  183    HD2  TYR  24           HD2      TYR  24   2.527   4.755  -2.850
  184    HE1  TYR  24           HE1      TYR  24   4.431   6.366  -7.134
  185    HE2  TYR  24           HE2      TYR  24   1.341   4.307  -4.979
  186    HH   TYR  24           HH       TYR  24   2.495   4.241  -7.745
  187    H    GLY  25           H        GLY  25   7.821   5.577  -0.504
  188    HA2  GLY  25           HA2      GLY  25  10.189   6.149  -0.890
  189    HA3  GLY  25           HA3      GLY  25   9.689   7.011  -2.345
  190    H    LEU  26           H        LEU  26   7.491   8.430  -1.326
  191    HA   LEU  26           HA       LEU  26   8.289   9.926   1.077
  192    HB2  LEU  26           HB2      LEU  26   9.628  10.597  -1.142
  193    HB3  LEU  26           HB3      LEU  26   8.172  11.546  -1.438
  194    HG   LEU  26           HG       LEU  26   8.604  12.160   1.169
  195   HD11  LEU  26          HD11      LEU  26  11.349  11.797  -0.074
  196   HD12  LEU  26          HD12      LEU  26  10.687  10.816   1.234
  197   HD13  LEU  26          HD13      LEU  26  11.014  12.530   1.494
  198   HD21  LEU  26          HD21      LEU  26   9.974  13.501  -1.186
  199   HD22  LEU  26          HD22      LEU  26   9.553  14.264   0.348
  200   HD23  LEU  26          HD23      LEU  26   8.280  13.723  -0.747
  201    H    SER  27           H        SER  27   5.895   8.502  -0.010
  202    HA   SER  27           HA       SER  27   3.919  10.555  -0.683
  203    HB2  SER  27           HB2      SER  27   4.242   7.742  -0.858
  204    HB3  SER  27           HB3      SER  27   2.801   8.030   0.106
  205    HG   SER  27           HG       SER  27   3.313   8.561  -2.559
  206    HA   PRO  28           HA       PRO  28   2.402   9.544   3.751
  207    HB2  PRO  28           HB2      PRO  28   4.176   8.443   5.519
  208    HB3  PRO  28           HB3      PRO  28   3.112   7.473   4.483
  209    HG2  PRO  28           HG2      PRO  28   6.000   8.061   4.201
  210    HG3  PRO  28           HG3      PRO  28   5.091   6.610   3.765
  211    HD2  PRO  28           HD2      PRO  28   5.939   8.550   1.993
  212    HD3  PRO  28           HD3      PRO  28   4.641   7.382   1.683
  213    H    ALA  29           H        ALA  29   3.223  11.878   3.032
  214    HA   ALA  29           HA       ALA  29   4.276  13.187   5.415
  215    HB1  ALA  29           HB1      ALA  29   6.236  14.154   4.003
  216    HB2  ALA  29           HB2      ALA  29   5.940  12.793   2.922
  217    HB3  ALA  29           HB3      ALA  29   6.399  12.502   4.600
  218    H    ILE  30           H        ILE  30   3.890  13.592   1.872
  219    HA   ILE  30           HA       ILE  30   2.912  16.364   2.252
  220    HB   ILE  30           HB       ILE  30   3.365  14.673  -0.230
  221   HG12  ILE  30          HG12      ILE  30   5.454  14.986   1.015
  222   HG13  ILE  30          HG13      ILE  30   5.473  15.992  -0.430
  223   HG21  ILE  30          HG21      ILE  30   3.643  17.209  -1.072
  224   HG22  ILE  30          HG22      ILE  30   2.500  17.486   0.242
  225   HG23  ILE  30          HG23      ILE  30   2.083  16.386  -1.071
  226   HD11  ILE  30          HD11      ILE  30   6.210  17.480   1.225
  227   HD12  ILE  30          HD12      ILE  30   5.115  16.823   2.440
  228   HD13  ILE  30          HD13      ILE  30   4.485  17.837   1.141
  229    H    THR  31           H        THR  31   1.705  13.161   1.419
  230    HA   THR  31           HA       THR  31  -0.837  13.873   0.327
  231    HB   THR  31           HB       THR  31  -0.099  11.470   2.034
  232    HG1  THR  31           HG1      THR  31   1.305  11.207   0.488
  233   HG21  THR  31          HG21      THR  31  -2.552  12.050   1.195
  234   HG22  THR  31          HG22      THR  31  -1.938  10.398   1.131
  235   HG23  THR  31          HG23      THR  31  -1.939  11.394  -0.324
  236    H    LYS  32           H        LYS  32   0.233  13.425   3.705
  237    HA   LYS  32           HA       LYS  32  -2.395  13.695   4.882
  238    HB2  LYS  32           HB2      LYS  32  -0.124  12.752   5.788
  239    HB3  LYS  32           HB3      LYS  32   0.194  14.428   6.234
  240    HG2  LYS  32           HG2      LYS  32  -0.944  13.947   8.135
  241    HG3  LYS  32           HG3      LYS  32  -2.388  14.072   7.132
  242    HD2  LYS  32           HD2      LYS  32  -0.898  11.466   7.215
  243    HD3  LYS  32           HD3      LYS  32  -1.950  11.892   8.564
  244    HE2  LYS  32           HE2      LYS  32  -2.954  12.087   5.718
  245    HE3  LYS  32           HE3      LYS  32  -3.014  10.553   6.606
  246    HZ1  LYS  32           HZ1      LYS  32  -4.238  13.145   7.376
  247    HZ2  LYS  32           HZ2      LYS  32  -4.050  11.861   8.472
  248    HZ3  LYS  32           HZ3      LYS  32  -5.025  11.670   7.094
  249    H    TYR  33           H        TYR  33   0.041  15.990   3.826
  250    HA   TYR  33           HA       TYR  33  -1.093  18.282   5.248
  251    HB2  TYR  33           HB2      TYR  33   1.134  17.638   3.413
  252    HB3  TYR  33           HB3      TYR  33   0.498  19.274   3.243
  253    HD1  TYR  33           HD1      TYR  33   1.926  16.839   5.665
  254    HD2  TYR  33           HD2      TYR  33   0.853  20.932   4.927
  255    HE1  TYR  33           HE1      TYR  33   3.120  17.524   7.726
  256    HE2  TYR  33           HE2      TYR  33   2.046  21.617   6.990
  257    HH   TYR  33           HH       TYR  33   2.699  19.965   9.368
  258    H    VAL  34           H        VAL  34  -1.826  16.627   2.279
  259    HA   VAL  34           HA       VAL  34  -3.457  18.968   1.343
  260    HB   VAL  34           HB       VAL  34  -2.364  16.603  -0.225
  261   HG11  VAL  34          HG11      VAL  34  -3.826  19.139  -0.940
  262   HG12  VAL  34          HG12      VAL  34  -4.152  17.489  -1.469
  263   HG13  VAL  34          HG13      VAL  34  -2.761  18.361  -2.111
  264   HG21  VAL  34          HG21      VAL  34  -0.404  17.740   0.325
  265   HG22  VAL  34          HG22      VAL  34  -1.220  19.299   0.441
  266   HG23  VAL  34          HG23      VAL  34  -0.880  18.598  -1.140
  267    H    VAL  35           H        VAL  35  -5.587  18.418   0.448
  268    HA   VAL  35           HA       VAL  35  -7.670  17.317   0.485
  269    HB   VAL  35           HB       VAL  35  -5.959  14.827   0.768
  270   HG11  VAL  35          HG11      VAL  35  -7.852  13.987  -0.786
  271   HG12  VAL  35          HG12      VAL  35  -8.725  15.432  -0.278
  272   HG13  VAL  35          HG13      VAL  35  -8.240  14.228   0.917
  273   HG21  VAL  35          HG21      VAL  35  -6.415  16.678  -1.558
  274   HG22  VAL  35          HG22      VAL  35  -6.241  14.949  -1.857
  275   HG23  VAL  35          HG23      VAL  35  -4.940  15.842  -1.073
  276    H    ARG  36           H        ARG  36  -7.799  18.363   2.714
  277    HA   ARG  36           HA       ARG  36  -7.246  16.885   5.121
  278    HB2  ARG  36           HB2      ARG  36  -8.618  18.642   6.157
  279    HB3  ARG  36           HB3      ARG  36  -7.568  19.349   4.931
  280    HG2  ARG  36           HG2      ARG  36  -9.510  19.152   3.306
  281    HG3  ARG  36           HG3      ARG  36 -10.522  18.722   4.683
  282    HD2  ARG  36           HD2      ARG  36 -10.678  20.889   5.344
  283    HD3  ARG  36           HD3      ARG  36  -8.923  21.121   5.210
  284    HE   ARG  36           HE       ARG  36  -9.215  21.822   2.944
  285   HH11  ARG  36          HH11      ARG  36 -11.617  23.264   3.770
  286   HH12  ARG  36          HH12      ARG  36 -12.855  22.621   2.742
  287   HH21  ARG  36          HH21      ARG  36 -11.017  19.807   1.850
  288   HH22  ARG  36          HH22      ARG  36 -12.513  20.657   1.650
  Start of MODEL   32
    1    HA   SER   1           HA       SER   1 -26.917  -3.930  12.564
    2    HB2  SER   1           HB2      SER   1 -28.657  -3.625  14.633
    3    HB3  SER   1           HB3      SER   1 -29.785  -3.595  13.281
    4    HG   SER   1           HG       SER   1 -29.415  -5.723  13.984
    5    H    ASP   2           H        ASP   2 -26.670  -3.284  10.405
    6    HA   ASP   2           HA       ASP   2 -29.163  -2.625   8.940
    7    HB2  ASP   2           HB2      ASP   2 -27.744  -0.757   7.776
    8    HB3  ASP   2           HB3      ASP   2 -28.446  -0.421   9.356
    9    H    LEU   3           H        LEU   3 -29.197  -3.756   7.046
   10    HA   LEU   3           HA       LEU   3 -26.921  -5.411   6.273
   11    HB2  LEU   3           HB2      LEU   3 -29.771  -5.186   5.780
   12    HB3  LEU   3           HB3      LEU   3 -28.906  -5.440   4.267
   13    HG   LEU   3           HG       LEU   3 -29.522  -7.593   5.292
   14   HD11  LEU   3          HD11      LEU   3 -27.436  -8.647   4.998
   15   HD12  LEU   3          HD12      LEU   3 -26.547  -7.278   5.666
   16   HD13  LEU   3          HD13      LEU   3 -27.276  -7.160   4.065
   17   HD21  LEU   3          HD21      LEU   3 -29.481  -6.736   7.657
   18   HD22  LEU   3          HD22      LEU   3 -27.718  -6.757   7.585
   19   HD23  LEU   3          HD23      LEU   3 -28.624  -8.264   7.447
   20    HA   PRO   4           HA       PRO   4 -26.813  -2.601   2.428
   21    HB2  PRO   4           HB2      PRO   4 -28.398  -0.376   2.327
   22    HB3  PRO   4           HB3      PRO   4 -28.939  -1.973   1.776
   23    HG2  PRO   4           HG2      PRO   4 -29.583  -0.517   4.271
   24    HG3  PRO   4           HG3      PRO   4 -30.570  -1.638   3.326
   25    HD2  PRO   4           HD2      PRO   4 -29.240  -2.254   5.679
   26    HD3  PRO   4           HD3      PRO   4 -29.843  -3.434   4.497
   27    H    ALA   5           H        ALA   5 -25.059  -2.321   4.335
   28    HA   ALA   5           HA       ALA   5 -24.823   0.419   5.390
   29    HB1  ALA   5           HB1      ALA   5 -24.145  -1.637   6.628
   30    HB2  ALA   5           HB2      ALA   5 -22.800  -0.514   6.431
   31    HB3  ALA   5           HB3      ALA   5 -22.913  -1.943   5.404
   32    H    LEU   6           H        LEU   6 -23.326  -1.555   2.835
   33    HA   LEU   6           HA       LEU   6 -21.909  -0.965   1.047
   34    HB2  LEU   6           HB2      LEU   6 -23.951   0.797   1.166
   35    HB3  LEU   6           HB3      LEU   6 -22.606   1.910   1.413
   36    HG   LEU   6           HG       LEU   6 -21.684   0.328  -0.651
   37   HD11  LEU   6          HD11      LEU   6 -24.643   0.850  -1.079
   38   HD12  LEU   6          HD12      LEU   6 -23.905  -0.737  -0.865
   39   HD13  LEU   6          HD13      LEU   6 -23.522   0.228  -2.290
   40   HD21  LEU   6          HD21      LEU   6 -22.284   2.320  -2.077
   41   HD22  LEU   6          HD22      LEU   6 -21.464   2.742  -0.573
   42   HD23  LEU   6          HD23      LEU   6 -23.210   2.950  -0.714
   43    H    SER   7           H        SER   7 -20.811  -0.933   3.793
   44    HA   SER   7           HA       SER   7 -18.836   1.302   3.700
   45    HB2  SER   7           HB2      SER   7 -20.330   0.010   5.704
   46    HB3  SER   7           HB3      SER   7 -18.674  -0.535   5.953
   47    HG   SER   7           HG       SER   7 -18.025   1.579   6.119
   48    H    THR   8           H        THR   8 -18.608  -0.885   1.767
   49    HA   THR   8           HA       THR   8 -16.083  -2.199   2.729
   50    HB   THR   8           HB       THR   8 -17.889  -3.264   0.557
   51    HG1  THR   8           HG1      THR   8 -18.153  -3.677   3.355
   52   HG21  THR   8          HG21      THR   8 -15.692  -4.307   0.854
   53   HG22  THR   8          HG22      THR   8 -16.967  -5.422   1.350
   54   HG23  THR   8          HG23      THR   8 -16.027  -4.559   2.567
   55    H    GLY   9           H        GLY   9 -16.901   0.358   0.969
   56    HA2  GLY   9           HA2      GLY   9 -15.277  -0.304  -1.437
   57    HA3  GLY   9           HA3      GLY   9 -16.319   1.109  -1.266
   58    H    LEU  10           H        LEU  10 -15.605   2.797   0.283
   59    HA   LEU  10           HA       LEU  10 -12.881   3.571  -0.071
   60    HB2  LEU  10           HB2      LEU  10 -15.196   4.731   0.770
   61    HB3  LEU  10           HB3      LEU  10 -14.358   4.559   2.311
   62    HG   LEU  10           HG       LEU  10 -12.835   5.646  -0.030
   63   HD11  LEU  10          HD11      LEU  10 -13.622   7.905   0.437
   64   HD12  LEU  10          HD12      LEU  10 -14.681   7.306   1.714
   65   HD13  LEU  10          HD13      LEU  10 -15.004   6.888   0.030
   66   HD21  LEU  10          HD21      LEU  10 -11.532   5.329   1.926
   67   HD22  LEU  10          HD22      LEU  10 -12.813   5.929   2.979
   68   HD23  LEU  10          HD23      LEU  10 -11.925   7.047   1.944
   69    H    LEU  11           H        LEU  11 -14.486   1.789   2.557
   70    HA   LEU  11           HA       LEU  11 -12.460   1.852   4.539
   71    HB2  LEU  11           HB2      LEU  11 -14.866   0.898   4.528
   72    HB3  LEU  11           HB3      LEU  11 -14.151  -0.562   3.847
   73    HG   LEU  11           HG       LEU  11 -12.924   0.630   6.311
   74   HD11  LEU  11          HD11      LEU  11 -15.317   0.563   6.834
   75   HD12  LEU  11          HD12      LEU  11 -14.483  -0.731   7.693
   76   HD13  LEU  11          HD13      LEU  11 -15.420  -1.096   6.244
   77   HD21  LEU  11          HD21      LEU  11 -12.716  -1.922   6.731
   78   HD22  LEU  11          HD22      LEU  11 -11.731  -1.224   5.446
   79   HD23  LEU  11          HD23      LEU  11 -13.208  -2.099   5.047
   80    H    HIS  12           H        HIS  12 -12.888  -0.430   1.808
   81    HA   HIS  12           HA       HIS  12 -10.392  -1.858   2.420
   82    HB2  HIS  12           HB2      HIS  12 -12.544  -1.935   0.308
   83    HB3  HIS  12           HB3      HIS  12 -11.057  -2.856   0.088
   84    HD1  HIS  12           HD1      HIS  12 -10.847  -5.033   1.358
   85    HD2  HIS  12           HD2      HIS  12 -14.012  -2.699   2.745
   86    HE1  HIS  12           HE1      HIS  12 -12.121  -6.464   3.015
   87    H    LEU  13           H        LEU  13 -11.538   0.444  -0.067
   88    HA   LEU  13           HA       LEU  13  -9.221   0.537  -1.704
   89    HB2  LEU  13           HB2      LEU  13 -11.587   1.579  -1.940
   90    HB3  LEU  13           HB3      LEU  13 -10.932   2.930  -1.014
   91    HG   LEU  13           HG       LEU  13  -8.981   2.839  -2.767
   92   HD11  LEU  13          HD11      LEU  13  -9.915   2.139  -5.024
   93   HD12  LEU  13          HD12      LEU  13 -11.232   1.356  -4.150
   94   HD13  LEU  13          HD13      LEU  13  -9.571   0.811  -3.915
   95   HD21  LEU  13          HD21      LEU  13 -10.625   4.688  -2.502
   96   HD22  LEU  13          HD22      LEU  13 -11.748   3.818  -3.546
   97   HD23  LEU  13          HD23      LEU  13 -10.218   4.408  -4.195
   98    H    HIS  14           H        HIS  14  -9.956   2.271   1.328
   99    HA   HIS  14           HA       HIS  14  -7.795   4.114   1.362
  100    HB2  HIS  14           HB2      HIS  14  -9.370   4.427   3.044
  101    HB3  HIS  14           HB3      HIS  14  -9.534   2.701   3.353
  102    HD1  HIS  14           HD1      HIS  14  -8.370   1.860   5.389
  103    HD2  HIS  14           HD2      HIS  14  -6.687   5.428   4.041
  104    HE1  HIS  14           HE1      HIS  14  -6.606   2.508   7.087
  105    H    GLN  15           H        GLN  15  -7.933   0.757   2.617
  106    HA   GLN  15           HA       GLN  15  -5.263   0.590   3.600
  107    HB2  GLN  15           HB2      GLN  15  -7.492  -1.004   3.484
  108    HB3  GLN  15           HB3      GLN  15  -6.430  -1.824   2.340
  109    HG2  GLN  15           HG2      GLN  15  -6.066  -2.733   4.578
  110    HG3  GLN  15           HG3      GLN  15  -4.634  -1.841   4.069
  111   HE21  GLN  15          HE21      GLN  15  -3.832  -0.609   5.780
  112   HE22  GLN  15          HE22      GLN  15  -4.784   0.191   6.935
  113    H    ASN  16           H        ASN  16  -6.568   0.123   0.326
  114    HA   ASN  16           HA       ASN  16  -4.149  -0.954  -0.843
  115    HB2  ASN  16           HB2      ASN  16  -6.425  -1.196  -1.783
  116    HB3  ASN  16           HB3      ASN  16  -6.508   0.547  -2.038
  117   HD21  ASN  16          HD21      ASN  16  -5.481   1.407  -3.913
  118   HD22  ASN  16          HD22      ASN  16  -4.640   0.451  -5.036
  119    H    ILE  17           H        ILE  17  -5.414   2.346  -0.402
  120    HA   ILE  17           HA       ILE  17  -3.271   3.580  -1.994
  121    HB   ILE  17           HB       ILE  17  -5.438   4.651  -0.151
  122   HG12  ILE  17          HG12      ILE  17  -5.376   4.956  -3.139
  123   HG13  ILE  17          HG13      ILE  17  -5.896   3.417  -2.452
  124   HG21  ILE  17          HG21      ILE  17  -3.760   6.346  -0.241
  125   HG22  ILE  17          HG22      ILE  17  -4.961   6.811  -1.446
  126   HG23  ILE  17          HG23      ILE  17  -3.452   6.053  -1.953
  127   HD11  ILE  17          HD11      ILE  17  -7.931   4.493  -2.469
  128   HD12  ILE  17          HD12      ILE  17  -7.204   6.093  -2.315
  129   HD13  ILE  17          HD13      ILE  17  -7.348   5.049  -0.900
  130    H    VAL  18           H        VAL  18  -3.635   2.535   1.290
  131    HA   VAL  18           HA       VAL  18  -1.488   4.357   2.259
  132    HB   VAL  18           HB       VAL  18  -3.425   2.434   3.586
  133   HG11  VAL  18          HG11      VAL  18  -1.012   3.834   4.629
  134   HG12  VAL  18          HG12      VAL  18  -1.756   2.326   5.159
  135   HG13  VAL  18          HG13      VAL  18  -2.452   3.870   5.646
  136   HG21  VAL  18          HG21      VAL  18  -3.487   5.239   2.844
  137   HG22  VAL  18          HG22      VAL  18  -3.658   5.057   4.590
  138   HG23  VAL  18          HG23      VAL  18  -4.778   4.236   3.503
  139    H    ASP  19           H        ASP  19  -2.282   0.871   2.237
  140    HA   ASP  19           HA       ASP  19   0.259  -0.065   3.152
  141    HB2  ASP  19           HB2      ASP  19  -1.984  -1.281   2.939
  142    HB3  ASP  19           HB3      ASP  19  -1.607  -1.475   1.229
  143    H    VAL  20           H        VAL  20  -0.743   1.138   0.023
  144    HA   VAL  20           HA       VAL  20   1.039  -0.112  -1.755
  145    HB   VAL  20           HB       VAL  20  -0.747   1.475  -2.374
  146   HG11  VAL  20          HG11      VAL  20   1.071   3.664  -1.347
  147   HG12  VAL  20          HG12      VAL  20  -0.272   3.020  -0.407
  148   HG13  VAL  20          HG13      VAL  20  -0.578   3.827  -1.945
  149   HG21  VAL  20          HG21      VAL  20   2.024   2.409  -3.186
  150   HG22  VAL  20          HG22      VAL  20   0.530   2.809  -4.032
  151   HG23  VAL  20          HG23      VAL  20   1.089   1.137  -3.972
  152    H    GLN  21           H        GLN  21   1.708   2.394   0.637
  153    HA   GLN  21           HA       GLN  21   4.416   2.932  -0.355
  154    HB2  GLN  21           HB2      GLN  21   2.527   3.909   1.687
  155    HB3  GLN  21           HB3      GLN  21   4.214   3.967   2.198
  156    HG2  GLN  21           HG2      GLN  21   3.949   6.032   1.121
  157    HG3  GLN  21           HG3      GLN  21   4.635   5.025  -0.154
  158   HE21  GLN  21          HE21      GLN  21   1.425   6.079   1.124
  159   HE22  GLN  21          HE22      GLN  21   0.656   6.061  -0.390
  160    H    TYR  22           H        TYR  22   2.943   0.698   1.908
  161    HA   TYR  22           HA       TYR  22   5.598   0.054   3.124
  162    HB2  TYR  22           HB2      TYR  22   2.976  -1.225   3.877
  163    HB3  TYR  22           HB3      TYR  22   4.361  -0.859   4.900
  164    HD1  TYR  22           HD1      TYR  22   4.914   1.959   4.304
  165    HD2  TYR  22           HD2      TYR  22   1.152  -0.059   4.764
  166    HE1  TYR  22           HE1      TYR  22   3.841   4.104   4.926
  167    HE2  TYR  22           HE2      TYR  22   0.080   2.083   5.388
  168    HH   TYR  22           HH       TYR  22   1.272   4.481   6.505
  169    H    MET  23           H        MET  23   2.819  -1.612   1.577
  170    HA   MET  23           HA       MET  23   4.030  -4.187   1.342
  171    HB2  MET  23           HB2      MET  23   1.618  -2.943   0.725
  172    HB3  MET  23           HB3      MET  23   2.252  -3.397  -0.857
  173    HG2  MET  23           HG2      MET  23   2.754  -5.616   0.788
  174    HG3  MET  23           HG3      MET  23   1.128  -5.088   1.218
  175    HE1  MET  23           HE1      MET  23  -0.794  -4.991  -0.108
  176    HE2  MET  23           HE2      MET  23  -0.990  -5.373  -1.816
  177    HE3  MET  23           HE3      MET  23  -0.183  -3.881  -1.340
  178    H    TYR  24           H        TYR  24   4.122  -1.338  -0.813
  179    HA   TYR  24           HA       TYR  24   5.803  -2.776  -2.783
  180    HB2  TYR  24           HB2      TYR  24   3.936  -0.705  -2.839
  181    HB3  TYR  24           HB3      TYR  24   5.475   0.118  -3.087
  182    HD1  TYR  24           HD1      TYR  24   6.929  -0.465  -4.999
  183    HD2  TYR  24           HD2      TYR  24   3.070  -2.277  -4.469
  184    HE1  TYR  24           HE1      TYR  24   6.986  -1.272  -7.343
  185    HE2  TYR  24           HE2      TYR  24   3.128  -3.084  -6.813
  186    HH   TYR  24           HH       TYR  24   4.678  -2.015  -9.087
  187    H    GLY  25           H        GLY  25   6.629  -1.812   0.139
  188    HA2  GLY  25           HA2      GLY  25   8.924  -0.078  -0.533
  189    HA3  GLY  25           HA3      GLY  25   8.430  -0.559   1.089
  190    H    LEU  26           H        LEU  26   8.324  -3.390  -0.564
  191    HA   LEU  26           HA       LEU  26   9.721  -5.280  -0.607
  192    HB2  LEU  26           HB2      LEU  26  11.373  -2.931  -1.458
  193    HB3  LEU  26           HB3      LEU  26  12.185  -4.478  -1.224
  194    HG   LEU  26           HG       LEU  26  10.223  -5.433  -2.677
  195   HD11  LEU  26          HD11      LEU  26  10.172  -2.469  -3.303
  196   HD12  LEU  26          HD12      LEU  26   8.821  -3.486  -2.801
  197   HD13  LEU  26          HD13      LEU  26   9.534  -3.694  -4.401
  198   HD21  LEU  26          HD21      LEU  26  12.465  -3.721  -3.797
  199   HD22  LEU  26          HD22      LEU  26  11.534  -4.882  -4.745
  200   HD23  LEU  26          HD23      LEU  26  12.544  -5.440  -3.412
  201    H    SER  27           H        SER  27   9.208  -4.471   2.009
  202    HA   SER  27           HA       SER  27  11.548  -5.519   3.400
  203    HB2  SER  27           HB2      SER  27  12.431  -3.354   3.299
  204    HB3  SER  27           HB3      SER  27  10.852  -2.592   3.425
  205    HG   SER  27           HG       SER  27  12.590  -3.387   5.379
  206    HA   PRO  28           HA       PRO  28   8.146  -4.890   6.663
  207    HB2  PRO  28           HB2      PRO  28   6.003  -3.275   6.132
  208    HB3  PRO  28           HB3      PRO  28   7.513  -2.676   6.847
  209    HG2  PRO  28           HG2      PRO  28   6.550  -2.508   4.041
  210    HG3  PRO  28           HG3      PRO  28   7.445  -1.322   5.001
  211    HD2  PRO  28           HD2      PRO  28   8.593  -2.922   3.105
  212    HD3  PRO  28           HD3      PRO  28   9.469  -2.248   4.496
  213    H    ALA  29           H        ALA  29   7.232  -5.119   3.312
  214    HA   ALA  29           HA       ALA  29   4.690  -6.476   3.682
  215    HB1  ALA  29           HB1      ALA  29   5.789  -5.187   1.652
  216    HB2  ALA  29           HB2      ALA  29   4.712  -6.549   1.341
  217    HB3  ALA  29           HB3      ALA  29   6.460  -6.772   1.267
  218    H    ILE  30           H        ILE  30   8.023  -7.592   2.963
  219    HA   ILE  30           HA       ILE  30   7.369 -10.399   2.857
  220    HB   ILE  30           HB       ILE  30   9.961  -8.929   3.448
  221   HG12  ILE  30          HG12      ILE  30   9.786 -10.098   0.825
  222   HG13  ILE  30          HG13      ILE  30   8.361  -9.093   1.093
  223   HG21  ILE  30          HG21      ILE  30  10.176 -11.254   4.105
  224   HG22  ILE  30          HG22      ILE  30  11.005 -11.041   2.564
  225   HG23  ILE  30          HG23      ILE  30   9.411 -11.792   2.611
  226   HD11  ILE  30          HD11      ILE  30  11.231  -8.209   1.518
  227   HD12  ILE  30          HD12      ILE  30   9.798  -7.208   1.751
  228   HD13  ILE  30          HD13      ILE  30  10.224  -7.775   0.137
  229    H    THR  31           H        THR  31   8.405  -8.257   5.488
  230    HA   THR  31           HA       THR  31   8.790 -10.358   7.452
  231    HB   THR  31           HB       THR  31   8.658  -8.332   9.015
  232    HG1  THR  31           HG1      THR  31   7.425  -6.898   7.983
  233   HG21  THR  31          HG21      THR  31  10.738  -7.302   8.057
  234   HG22  THR  31          HG22      THR  31  10.493  -8.274   6.606
  235   HG23  THR  31          HG23      THR  31  10.799  -9.062   8.153
  236    H    LYS  32           H        LYS  32   6.018  -8.390   6.438
  237    HA   LYS  32           HA       LYS  32   4.325  -9.418   8.639
  238    HB2  LYS  32           HB2      LYS  32   4.423  -7.043   7.506
  239    HB3  LYS  32           HB3      LYS  32   3.390  -7.790   6.286
  240    HG2  LYS  32           HG2      LYS  32   2.323  -8.579   8.777
  241    HG3  LYS  32           HG3      LYS  32   2.693  -6.862   8.938
  242    HD2  LYS  32           HD2      LYS  32   1.174  -6.239   7.322
  243    HD3  LYS  32           HD3      LYS  32   1.365  -7.738   6.413
  244    HE2  LYS  32           HE2      LYS  32  -0.091  -8.937   7.840
  245    HE3  LYS  32           HE3      LYS  32   0.061  -7.740   9.143
  246    HZ1  LYS  32           HZ1      LYS  32  -2.020  -7.455   7.919
  247    HZ2  LYS  32           HZ2      LYS  32  -1.155  -7.237   6.473
  248    HZ3  LYS  32           HZ3      LYS  32  -1.014  -6.102   7.731
  249    H    TYR  33           H        TYR  33   5.427 -11.080   6.188
  250    HA   TYR  33           HA       TYR  33   2.787 -12.114   5.213
  251    HB2  TYR  33           HB2      TYR  33   5.473 -11.652   4.059
  252    HB3  TYR  33           HB3      TYR  33   4.743 -13.189   3.605
  253    HD1  TYR  33           HD1      TYR  33   3.084  -9.904   4.321
  254    HD2  TYR  33           HD2      TYR  33   4.039 -12.887   1.381
  255    HE1  TYR  33           HE1      TYR  33   1.656  -8.733   2.669
  256    HE2  TYR  33           HE2      TYR  33   2.611 -11.714  -0.271
  257    HH   TYR  33           HH       TYR  33   0.373  -9.397   0.546
  258    H    VAL  34           H        VAL  34   6.078 -13.214   6.146
  259    HA   VAL  34           HA       VAL  34   5.168 -15.977   6.553
  260    HB   VAL  34           HB       VAL  34   7.775 -14.570   7.231
  261   HG11  VAL  34          HG11      VAL  34   8.705 -16.888   7.060
  262   HG12  VAL  34          HG12      VAL  34   7.059 -17.500   6.895
  263   HG13  VAL  34          HG13      VAL  34   7.561 -16.705   8.388
  264   HG21  VAL  34          HG21      VAL  34   6.757 -15.914   4.720
  265   HG22  VAL  34          HG22      VAL  34   8.484 -15.758   5.047
  266   HG23  VAL  34          HG23      VAL  34   7.482 -14.315   4.886
  267    H    VAL  35           H        VAL  35   3.493 -15.400   8.197
  268    HA   VAL  35           HA       VAL  35   4.686 -14.991  10.922
  269    HB   VAL  35           HB       VAL  35   3.308 -13.122   9.858
  270   HG11  VAL  35          HG11      VAL  35   0.900 -13.379   9.775
  271   HG12  VAL  35          HG12      VAL  35   1.007 -15.006  10.447
  272   HG13  VAL  35          HG13      VAL  35   1.623 -14.678   8.827
  273   HG21  VAL  35          HG21      VAL  35   2.110 -14.265  12.394
  274   HG22  VAL  35          HG22      VAL  35   2.229 -12.567  11.932
  275   HG23  VAL  35          HG23      VAL  35   3.685 -13.472  12.346
  276    H    ARG  36           H        ARG  36   3.884 -17.502   9.267
  277    HA   ARG  36           HA       ARG  36   1.801 -18.637  11.085
  278    HB2  ARG  36           HB2      ARG  36   2.673 -18.970   8.291
  279    HB3  ARG  36           HB3      ARG  36   2.376 -20.499   9.118
  280    HG2  ARG  36           HG2      ARG  36   0.145 -20.179   9.084
  281    HG3  ARG  36           HG3      ARG  36   0.306 -18.550   9.740
  282    HD2  ARG  36           HD2      ARG  36  -0.230 -17.726   7.701
  283    HD3  ARG  36           HD3      ARG  36   1.251 -18.453   7.050
  284    HE   ARG  36           HE       ARG  36  -1.394 -19.852   7.179
  285   HH11  ARG  36          HH11      ARG  36  -0.346 -18.955   4.535
  286   HH12  ARG  36          HH12      ARG  36   0.445 -20.377   3.943
  287   HH21  ARG  36          HH21      ARG  36   0.563 -21.922   7.055
  288   HH22  ARG  36          HH22      ARG  36   0.962 -22.064   5.377
  Start of MODEL   33
    1    HA   SER   1           HA       SER   1 -26.878 -12.642  -2.736
    2    HB2  SER   1           HB2      SER   1 -24.810 -14.000  -3.631
    3    HB3  SER   1           HB3      SER   1 -23.968 -12.457  -3.503
    4    HG   SER   1           HG       SER   1 -23.761 -13.521  -1.556
    5    H    ASP   2           H        ASP   2 -27.557 -10.597  -2.176
    6    HA   ASP   2           HA       ASP   2 -25.939  -8.247  -3.095
    7    HB2  ASP   2           HB2      ASP   2 -28.817  -8.667  -2.253
    8    HB3  ASP   2           HB3      ASP   2 -28.122  -7.055  -2.426
    9    H    LEU   3           H        LEU   3 -25.571 -10.132  -0.643
   10    HA   LEU   3           HA       LEU   3 -24.965  -7.987   1.287
   11    HB2  LEU   3           HB2      LEU   3 -27.451  -9.208   1.308
   12    HB3  LEU   3           HB3      LEU   3 -26.550 -10.137   2.504
   13    HG   LEU   3           HG       LEU   3 -26.558  -7.115   2.503
   14   HD11  LEU   3          HD11      LEU   3 -28.891  -7.962   2.693
   15   HD12  LEU   3          HD12      LEU   3 -28.333  -7.205   4.185
   16   HD13  LEU   3          HD13      LEU   3 -28.393  -8.963   4.058
   17   HD21  LEU   3          HD21      LEU   3 -25.912  -9.259   4.551
   18   HD22  LEU   3          HD22      LEU   3 -26.009  -7.539   4.931
   19   HD23  LEU   3          HD23      LEU   3 -24.782  -8.127   3.809
   20    HA   PRO   4           HA       PRO   4 -22.393 -11.928   1.300
   21    HB2  PRO   4           HB2      PRO   4 -20.118 -10.919   0.166
   22    HB3  PRO   4           HB3      PRO   4 -21.432 -11.646  -0.777
   23    HG2  PRO   4           HG2      PRO   4 -20.759  -8.788  -0.360
   24    HG3  PRO   4           HG3      PRO   4 -21.431  -9.596  -1.784
   25    HD2  PRO   4           HD2      PRO   4 -22.891  -8.094   0.013
   26    HD3  PRO   4           HD3      PRO   4 -23.577  -9.326  -1.066
   27    H    ALA   5           H        ALA   5 -21.681  -8.566   2.076
   28    HA   ALA   5           HA       ALA   5 -20.514  -9.394   4.662
   29    HB1  ALA   5           HB1      ALA   5 -19.013  -8.166   2.361
   30    HB2  ALA   5           HB2      ALA   5 -18.508  -9.453   3.454
   31    HB3  ALA   5           HB3      ALA   5 -18.523  -7.780   4.011
   32    H    LEU   6           H        LEU   6 -20.224  -6.360   2.785
   33    HA   LEU   6           HA       LEU   6 -22.397  -5.009   4.171
   34    HB2  LEU   6           HB2      LEU   6 -20.287  -5.393   5.771
   35    HB3  LEU   6           HB3      LEU   6 -19.686  -3.967   4.930
   36    HG   LEU   6           HG       LEU   6 -20.910  -3.372   7.006
   37   HD11  LEU   6          HD11      LEU   6 -22.138  -1.581   6.067
   38   HD12  LEU   6          HD12      LEU   6 -22.571  -2.515   4.635
   39   HD13  LEU   6          HD13      LEU   6 -20.913  -1.953   4.854
   40   HD21  LEU   6          HD21      LEU   6 -22.521  -5.385   6.692
   41   HD22  LEU   6          HD22      LEU   6 -23.434  -4.305   5.638
   42   HD23  LEU   6          HD23      LEU   6 -23.192  -3.885   7.333
   43    H    SER   7           H        SER   7 -19.129  -4.126   2.948
   44    HA   SER   7           HA       SER   7 -20.217  -2.887   0.536
   45    HB2  SER   7           HB2      SER   7 -20.856  -1.180   2.112
   46    HB3  SER   7           HB3      SER   7 -19.288  -1.251   2.911
   47    HG   SER   7           HG       SER   7 -19.893  -0.323   0.296
   48    H    THR   8           H        THR   8 -17.433  -2.250   2.682
   49    HA   THR   8           HA       THR   8 -15.111  -2.379   2.302
   50    HB   THR   8           HB       THR   8 -15.714  -4.389   0.140
   51    HG1  THR   8           HG1      THR   8 -16.604  -5.724   1.513
   52   HG21  THR   8          HG21      THR   8 -13.908  -5.560   1.682
   53   HG22  THR   8          HG22      THR   8 -13.618  -3.907   2.222
   54   HG23  THR   8          HG23      THR   8 -13.430  -4.324   0.519
   55    H    GLY   9           H        GLY   9 -16.389  -0.272   0.929
   56    HA2  GLY   9           HA2      GLY   9 -15.146  -0.307  -1.786
   57    HA3  GLY   9           HA3      GLY   9 -16.439   0.783  -1.285
   58    H    LEU  10           H        LEU  10 -15.852   2.348   0.497
   59    HA   LEU  10           HA       LEU  10 -13.421   3.776  -0.169
   60    HB2  LEU  10           HB2      LEU  10 -15.767   4.019   1.626
   61    HB3  LEU  10           HB3      LEU  10 -14.312   4.823   2.210
   62    HG   LEU  10           HG       LEU  10 -15.713   6.330   0.818
   63   HD11  LEU  10          HD11      LEU  10 -13.188   5.652  -0.695
   64   HD12  LEU  10          HD12      LEU  10 -13.145   6.407   0.899
   65   HD13  LEU  10          HD13      LEU  10 -13.922   7.236  -0.450
   66   HD21  LEU  10          HD21      LEU  10 -16.014   5.902  -1.549
   67   HD22  LEU  10          HD22      LEU  10 -16.592   4.490  -0.665
   68   HD23  LEU  10          HD23      LEU  10 -15.017   4.450  -1.460
   69    H    LEU  11           H        LEU  11 -14.417   1.796   2.637
   70    HA   LEU  11           HA       LEU  11 -12.104   2.113   4.256
   71    HB2  LEU  11           HB2      LEU  11 -14.347   1.041   4.788
   72    HB3  LEU  11           HB3      LEU  11 -13.795  -0.385   3.909
   73    HG   LEU  11           HG       LEU  11 -11.872   0.624   5.908
   74   HD11  LEU  11          HD11      LEU  11 -13.087  -0.124   7.849
   75   HD12  LEU  11          HD12      LEU  11 -14.423  -0.710   6.858
   76   HD13  LEU  11          HD13      LEU  11 -14.124   1.023   7.000
   77   HD21  LEU  11          HD21      LEU  11 -11.953  -1.588   4.499
   78   HD22  LEU  11          HD22      LEU  11 -13.073  -2.132   5.749
   79   HD23  LEU  11          HD23      LEU  11 -11.429  -1.662   6.181
   80    H    HIS  12           H        HIS  12 -12.805  -0.350   1.739
   81    HA   HIS  12           HA       HIS  12 -10.330  -1.784   1.987
   82    HB2  HIS  12           HB2      HIS  12 -12.564  -2.378   0.821
   83    HB3  HIS  12           HB3      HIS  12 -11.950  -1.446  -0.545
   84    HD1  HIS  12           HD1      HIS  12 -10.328  -4.028   1.771
   85    HD2  HIS  12           HD2      HIS  12 -10.787  -3.225  -2.295
   86    HE1  HIS  12           HE1      HIS  12  -9.047  -5.829   0.536
   87    H    LEU  13           H        LEU  13 -11.306   0.962  -0.082
   88    HA   LEU  13           HA       LEU  13  -8.947   1.143  -1.680
   89    HB2  LEU  13           HB2      LEU  13 -11.301   2.350  -1.704
   90    HB3  LEU  13           HB3      LEU  13 -10.468   3.555  -0.722
   91    HG   LEU  13           HG       LEU  13  -8.622   3.343  -2.614
   92   HD11  LEU  13          HD11      LEU  13 -11.184   2.491  -3.998
   93   HD12  LEU  13          HD12      LEU  13  -9.715   1.529  -3.834
   94   HD13  LEU  13          HD13      LEU  13  -9.710   2.984  -4.829
   95   HD21  LEU  13          HD21      LEU  13 -11.227   4.813  -3.127
   96   HD22  LEU  13          HD22      LEU  13  -9.627   5.258  -3.719
   97   HD23  LEU  13          HD23      LEU  13  -9.990   5.364  -1.997
   98    H    HIS  14           H        HIS  14  -9.733   2.555   1.509
   99    HA   HIS  14           HA       HIS  14  -7.406   4.173   1.838
  100    HB2  HIS  14           HB2      HIS  14  -9.315   4.397   3.283
  101    HB3  HIS  14           HB3      HIS  14  -9.258   2.694   3.732
  102    HD1  HIS  14           HD1      HIS  14  -8.155   2.248   5.916
  103    HD2  HIS  14           HD2      HIS  14  -6.734   5.765   4.187
  104    HE1  HIS  14           HE1      HIS  14  -6.536   3.262   7.579
  105    H    GLN  15           H        GLN  15  -8.010   0.896   3.198
  106    HA   GLN  15           HA       GLN  15  -5.347   0.424   4.105
  107    HB2  GLN  15           HB2      GLN  15  -7.856  -0.892   3.966
  108    HB3  GLN  15           HB3      GLN  15  -6.684  -1.987   3.234
  109    HG2  GLN  15           HG2      GLN  15  -6.732  -2.446   5.607
  110    HG3  GLN  15           HG3      GLN  15  -5.209  -1.634   5.247
  111   HE21  GLN  15          HE21      GLN  15  -4.860   0.476   6.154
  112   HE22  GLN  15          HE22      GLN  15  -5.958   1.207   7.220
  113    H    ASN  16           H        ASN  16  -6.762   0.157   0.892
  114    HA   ASN  16           HA       ASN  16  -4.610  -1.485  -0.226
  115    HB2  ASN  16           HB2      ASN  16  -6.808  -1.646  -1.165
  116    HB3  ASN  16           HB3      ASN  16  -6.955   0.105  -1.302
  117   HD21  ASN  16          HD21      ASN  16  -4.417  -2.253  -2.368
  118   HD22  ASN  16          HD22      ASN  16  -4.379  -1.692  -3.969
  119    H    ILE  17           H        ILE  17  -5.548   1.975  -0.449
  120    HA   ILE  17           HA       ILE  17  -3.214   2.680  -2.059
  121    HB   ILE  17           HB       ILE  17  -5.585   3.992  -0.804
  122   HG12  ILE  17          HG12      ILE  17  -5.516   5.098  -3.131
  123   HG13  ILE  17          HG13      ILE  17  -4.202   3.981  -3.495
  124   HG21  ILE  17          HG21      ILE  17  -4.614   6.260  -1.419
  125   HG22  ILE  17          HG22      ILE  17  -3.036   5.478  -1.498
  126   HG23  ILE  17          HG23      ILE  17  -3.924   5.520   0.025
  127   HD11  ILE  17          HD11      ILE  17  -6.435   2.591  -2.260
  128   HD12  ILE  17          HD12      ILE  17  -5.643   2.276  -3.802
  129   HD13  ILE  17          HD13      ILE  17  -6.949   3.457  -3.706
  130    H    VAL  18           H        VAL  18  -4.025   2.773   1.402
  131    HA   VAL  18           HA       VAL  18  -1.741   4.360   2.208
  132    HB   VAL  18           HB       VAL  18  -3.637   2.454   3.606
  133   HG11  VAL  18          HG11      VAL  18  -1.694   2.380   4.978
  134   HG12  VAL  18          HG12      VAL  18  -2.732   3.598   5.717
  135   HG13  VAL  18          HG13      VAL  18  -1.358   4.093   4.727
  136   HG21  VAL  18          HG21      VAL  18  -3.333   5.473   3.561
  137   HG22  VAL  18          HG22      VAL  18  -4.486   4.597   4.567
  138   HG23  VAL  18          HG23      VAL  18  -4.629   4.542   2.811
  139    H    ASP  19           H        ASP  19  -2.242   0.926   1.624
  140    HA   ASP  19           HA       ASP  19   0.346   0.172   2.831
  141    HB2  ASP  19           HB2      ASP  19  -2.076  -1.141   1.711
  142    HB3  ASP  19           HB3      ASP  19  -0.576  -2.053   1.589
  143    H    VAL  20           H        VAL  20  -0.414   1.643  -0.049
  144    HA   VAL  20           HA       VAL  20   1.669   0.125  -1.574
  145    HB   VAL  20           HB       VAL  20  -0.861   0.465  -2.285
  146   HG11  VAL  20          HG11      VAL  20  -0.386   3.051  -2.010
  147   HG12  VAL  20          HG12      VAL  20  -1.419   2.468  -3.313
  148   HG13  VAL  20          HG13      VAL  20   0.262   2.889  -3.640
  149   HG21  VAL  20          HG21      VAL  20   0.828  -0.651  -3.668
  150   HG22  VAL  20          HG22      VAL  20   1.484   0.910  -4.161
  151   HG23  VAL  20          HG23      VAL  20  -0.138   0.436  -4.666
  152    H    GLN  21           H        GLN  21   0.988   3.115  -0.026
  153    HA   GLN  21           HA       GLN  21   3.051   4.578  -1.614
  154    HB2  GLN  21           HB2      GLN  21   0.637   5.223  -0.011
  155    HB3  GLN  21           HB3      GLN  21   1.963   6.378   0.119
  156    HG2  GLN  21           HG2      GLN  21   1.957   6.827  -2.203
  157    HG3  GLN  21           HG3      GLN  21   1.019   5.379  -2.566
  158   HE21  GLN  21          HE21      GLN  21  -1.042   6.023  -3.226
  159   HE22  GLN  21          HE22      GLN  21  -1.959   7.247  -2.487
  160    H    TYR  22           H        TYR  22   2.273   3.490   1.689
  161    HA   TYR  22           HA       TYR  22   4.307   4.831   3.131
  162    HB2  TYR  22           HB2      TYR  22   3.676   3.386   4.849
  163    HB3  TYR  22           HB3      TYR  22   2.287   3.235   3.779
  164    HD1  TYR  22           HD1      TYR  22   5.427   1.614   4.905
  165    HD2  TYR  22           HD2      TYR  22   1.838   1.192   2.588
  166    HE1  TYR  22           HE1      TYR  22   5.839  -0.822   4.705
  167    HE2  TYR  22           HE2      TYR  22   2.248  -1.245   2.396
  168    HH   TYR  22           HH       TYR  22   4.237  -2.790   2.503
  169    H    MET  23           H        MET  23   4.507   1.904   1.128
  170    HA   MET  23           HA       MET  23   7.197   1.170   1.963
  171    HB2  MET  23           HB2      MET  23   5.244  -0.183   0.847
  172    HB3  MET  23           HB3      MET  23   5.907   0.445  -0.663
  173    HG2  MET  23           HG2      MET  23   8.159  -0.427   0.719
  174    HG3  MET  23           HG3      MET  23   6.948  -1.655   1.085
  175    HE1  MET  23           HE1      MET  23   9.612  -1.745  -0.263
  176    HE2  MET  23           HE2      MET  23   9.607  -2.356  -1.916
  177    HE3  MET  23           HE3      MET  23   8.929  -3.338  -0.620
  178    H    TYR  24           H        TYR  24   5.822   3.077  -0.713
  179    HA   TYR  24           HA       TYR  24   8.337   3.441  -2.114
  180    HB2  TYR  24           HB2      TYR  24   5.521   4.337  -2.260
  181    HB3  TYR  24           HB3      TYR  24   6.694   5.460  -2.947
  182    HD1  TYR  24           HD1      TYR  24   8.381   4.568  -4.649
  183    HD2  TYR  24           HD2      TYR  24   4.905   2.366  -3.420
  184    HE1  TYR  24           HE1      TYR  24   8.572   3.140  -6.668
  185    HE2  TYR  24           HE2      TYR  24   5.095   0.938  -5.438
  186    HH   TYR  24           HH       TYR  24   6.499   1.596  -8.027
  187    H    GLY  25           H        GLY  25   7.106   4.825   0.764
  188    HA2  GLY  25           HA2      GLY  25   8.545   7.385   0.404
  189    HA3  GLY  25           HA3      GLY  25   7.525   6.960   1.777
  190    H    LEU  26           H        LEU  26   9.656   4.416   0.984
  191    HA   LEU  26           HA       LEU  26  11.826   5.403   2.764
  192    HB2  LEU  26           HB2      LEU  26   9.643   3.872   3.642
  193    HB3  LEU  26           HB3      LEU  26  10.963   2.714   3.478
  194    HG   LEU  26           HG       LEU  26  11.491   5.347   4.818
  195   HD11  LEU  26          HD11      LEU  26  10.838   4.354   6.982
  196   HD12  LEU  26          HD12      LEU  26  10.246   2.918   6.144
  197   HD13  LEU  26          HD13      LEU  26   9.451   4.473   5.899
  198   HD21  LEU  26          HD21      LEU  26  13.413   3.964   4.433
  199   HD22  LEU  26          HD22      LEU  26  12.570   2.522   4.997
  200   HD23  LEU  26          HD23      LEU  26  13.018   3.786   6.142
  201    H    SER  27           H        SER  27  11.483   4.495  -0.156
  202    HA   SER  27           HA       SER  27  13.017   1.984  -0.294
  203    HB2  SER  27           HB2      SER  27  12.845   3.350  -2.810
  204    HB3  SER  27           HB3      SER  27  11.970   1.915  -2.291
  205    HG   SER  27           HG       SER  27  10.301   3.141  -1.674
  206    HA   PRO  28           HA       PRO  28  16.402   4.899  -1.912
  207    HB2  PRO  28           HB2      PRO  28  15.965   7.594  -2.001
  208    HB3  PRO  28           HB3      PRO  28  15.545   6.505  -3.338
  209    HG2  PRO  28           HG2      PRO  28  13.799   7.765  -1.305
  210    HG3  PRO  28           HG3      PRO  28  13.462   7.361  -2.994
  211    HD2  PRO  28           HD2      PRO  28  12.615   5.902  -0.799
  212    HD3  PRO  28           HD3      PRO  28  12.713   5.290  -2.462
  213    H    ALA  29           H        ALA  29  14.499   5.620   0.851
  214    HA   ALA  29           HA       ALA  29  16.501   7.239   2.263
  215    HB1  ALA  29           HB1      ALA  29  14.140   7.584   2.678
  216    HB2  ALA  29           HB2      ALA  29  14.834   6.881   4.139
  217    HB3  ALA  29           HB3      ALA  29  13.903   5.872   3.033
  218    H    ILE  30           H        ILE  30  15.279   3.872   2.442
  219    HA   ILE  30           HA       ILE  30  16.933   3.048   4.636
  220    HB   ILE  30           HB       ILE  30  14.849   1.956   3.657
  221   HG12  ILE  30          HG12      ILE  30  15.939  -0.431   3.900
  222   HG13  ILE  30          HG13      ILE  30  17.370   0.486   4.372
  223   HG21  ILE  30          HG21      ILE  30  16.750   0.575   1.770
  224   HG22  ILE  30          HG22      ILE  30  15.900   2.040   1.284
  225   HG23  ILE  30          HG23      ILE  30  14.987   0.602   1.737
  226   HD11  ILE  30          HD11      ILE  30  16.012  -0.108   6.346
  227   HD12  ILE  30          HD12      ILE  30  14.625   0.726   5.644
  228   HD13  ILE  30          HD13      ILE  30  16.058   1.640   6.116
  229    H    THR  31           H        THR  31  17.541   3.262   1.172
  230    HA   THR  31           HA       THR  31  19.979   1.684   1.163
  231    HB   THR  31           HB       THR  31  20.238   2.972  -1.070
  232    HG1  THR  31           HG1      THR  31  19.010   4.758  -0.645
  233   HG21  THR  31          HG21      THR  31  18.411   1.690  -2.110
  234   HG22  THR  31          HG22      THR  31  17.681   1.439  -0.524
  235   HG23  THR  31          HG23      THR  31  19.249   0.720  -0.897
  236    H    LYS  32           H        LYS  32  19.210   5.035   1.906
  237    HA   LYS  32           HA       LYS  32  22.091   5.795   1.901
  238    HB2  LYS  32           HB2      LYS  32  19.899   7.058   0.984
  239    HB3  LYS  32           HB3      LYS  32  19.879   7.660   2.642
  240    HG2  LYS  32           HG2      LYS  32  22.104   8.561   2.422
  241    HG3  LYS  32           HG3      LYS  32  22.327   7.773   0.860
  242    HD2  LYS  32           HD2      LYS  32  21.195   9.392  -0.251
  243    HD3  LYS  32           HD3      LYS  32  19.934   9.478   0.979
  244    HE2  LYS  32           HE2      LYS  32  22.674  10.591   1.576
  245    HE3  LYS  32           HE3      LYS  32  21.501  11.555   0.659
  246    HZ1  LYS  32           HZ1      LYS  32  19.853  10.956   2.447
  247    HZ2  LYS  32           HZ2      LYS  32  21.093  12.013   2.931
  248    HZ3  LYS  32           HZ3      LYS  32  21.158  10.370   3.360
  249    H    TYR  33           H        TYR  33  20.424   4.101   4.022
  250    HA   TYR  33           HA       TYR  33  21.100   5.760   6.425
  251    HB2  TYR  33           HB2      TYR  33  18.878   4.107   5.594
  252    HB3  TYR  33           HB3      TYR  33  19.556   3.476   7.095
  253    HD1  TYR  33           HD1      TYR  33  18.468   6.683   5.490
  254    HD2  TYR  33           HD2      TYR  33  19.017   4.487   9.141
  255    HE1  TYR  33           HE1      TYR  33  17.378   8.516   6.757
  256    HE2  TYR  33           HE2      TYR  33  17.928   6.319  10.407
  257    HH   TYR  33           HH       TYR  33  17.660   9.174   9.641
  258    H    VAL  34           H        VAL  34  21.458   2.511   4.988
  259    HA   VAL  34           HA       VAL  34  23.045   1.478   7.219
  260    HB   VAL  34           HB       VAL  34  22.608   0.475   4.381
  261   HG11  VAL  34          HG11      VAL  34  23.667  -1.463   4.969
  262   HG12  VAL  34          HG12      VAL  34  23.089  -1.395   6.633
  263   HG13  VAL  34          HG13      VAL  34  24.479  -0.426   6.141
  264   HG21  VAL  34          HG21      VAL  34  20.905  -1.005   5.539
  265   HG22  VAL  34          HG22      VAL  34  20.472   0.703   5.483
  266   HG23  VAL  34          HG23      VAL  34  21.105   0.002   6.973
  267    H    VAL  35           H        VAL  35  23.754   2.528   3.869
  268    HA   VAL  35           HA       VAL  35  25.738   3.257   2.859
  269    HB   VAL  35           HB       VAL  35  25.526   4.373   5.400
  270   HG11  VAL  35          HG11      VAL  35  27.596   4.337   6.491
  271   HG12  VAL  35          HG12      VAL  35  28.449   3.744   5.067
  272   HG13  VAL  35          HG13      VAL  35  27.412   2.658   5.989
  273   HG21  VAL  35          HG21      VAL  35  27.154   4.883   2.947
  274   HG22  VAL  35          HG22      VAL  35  27.496   5.845   4.385
  275   HG23  VAL  35          HG23      VAL  35  25.881   5.864   3.675
  276    H    ARG  36           H        ARG  36  25.458   0.365   4.117
  277    HA   ARG  36           HA       ARG  36  26.756  -1.593   4.130
  278    HB2  ARG  36           HB2      ARG  36  28.601   0.167   2.474
  279    HB3  ARG  36           HB3      ARG  36  28.590  -1.595   2.494
  280    HG2  ARG  36           HG2      ARG  36  26.183  -1.500   1.725
  281    HG3  ARG  36           HG3      ARG  36  26.389   0.236   1.502
  282    HD2  ARG  36           HD2      ARG  36  28.087  -1.896   0.148
  283    HD3  ARG  36           HD3      ARG  36  26.775  -0.989  -0.628
  284    HE   ARG  36           HE       ARG  36  29.427   0.049  -0.055
  285   HH11  ARG  36          HH11      ARG  36  27.293   0.900  -2.153
  286   HH12  ARG  36          HH12      ARG  36  27.009   2.534  -1.655
  287   HH21  ARG  36          HH21      ARG  36  28.542   2.134   1.440
  288   HH22  ARG  36          HH22      ARG  36  27.726   3.238   0.383
  Start of MODEL   34
    1    HA   SER   1           HA       SER   1 -34.151   1.967   5.632
    2    HB2  SER   1           HB2      SER   1 -35.625   0.969   3.173
    3    HB3  SER   1           HB3      SER   1 -34.949  -0.037   4.451
    4    HG   SER   1           HG       SER   1 -37.135   0.298   4.848
    5    H    ASP   2           H        ASP   2 -31.995   1.607   5.278
    6    HA   ASP   2           HA       ASP   2 -30.974   1.372   2.491
    7    HB2  ASP   2           HB2      ASP   2 -29.247   3.072   2.967
    8    HB3  ASP   2           HB3      ASP   2 -30.857   3.760   3.159
    9    H    LEU   3           H        LEU   3 -28.878   0.314   2.412
   10    HA   LEU   3           HA       LEU   3 -27.612  -0.639   4.879
   11    HB2  LEU   3           HB2      LEU   3 -29.709  -2.131   3.548
   12    HB3  LEU   3           HB3      LEU   3 -28.203  -3.047   3.523
   13    HG   LEU   3           HG       LEU   3 -28.689  -1.756   6.107
   14   HD11  LEU   3          HD11      LEU   3 -30.656  -3.823   5.078
   15   HD12  LEU   3          HD12      LEU   3 -31.032  -2.166   5.554
   16   HD13  LEU   3          HD13      LEU   3 -30.504  -3.333   6.766
   17   HD21  LEU   3          HD21      LEU   3 -28.262  -4.637   5.246
   18   HD22  LEU   3          HD22      LEU   3 -28.144  -4.032   6.899
   19   HD23  LEU   3          HD23      LEU   3 -26.986  -3.500   5.681
   20    HA   PRO   4           HA       PRO   4 -25.047  -2.225   1.225
   21    HB2  PRO   4           HB2      PRO   4 -26.120  -2.367  -1.284
   22    HB3  PRO   4           HB3      PRO   4 -26.282  -3.670  -0.091
   23    HG2  PRO   4           HG2      PRO   4 -28.260  -1.653  -0.965
   24    HG3  PRO   4           HG3      PRO   4 -28.502  -3.317  -0.422
   25    HD2  PRO   4           HD2      PRO   4 -28.941  -1.038   1.104
   26    HD3  PRO   4           HD3      PRO   4 -28.757  -2.688   1.733
   27    H    ALA   5           H        ALA   5 -24.870   0.296   1.933
   28    HA   ALA   5           HA       ALA   5 -25.089   2.124  -0.400
   29    HB1  ALA   5           HB1      ALA   5 -24.141   2.618   2.442
   30    HB2  ALA   5           HB2      ALA   5 -25.831   2.703   1.941
   31    HB3  ALA   5           HB3      ALA   5 -24.655   3.835   1.273
   32    H    LEU   6           H        LEU   6 -22.593   0.792   1.790
   33    HA   LEU   6           HA       LEU   6 -20.501   1.699  -0.166
   34    HB2  LEU   6           HB2      LEU   6 -20.787   1.800   2.784
   35    HB3  LEU   6           HB3      LEU   6 -19.189   1.335   2.201
   36    HG   LEU   6           HG       LEU   6 -20.525   3.666   0.892
   37   HD11  LEU   6          HD11      LEU   6 -19.217   3.741   3.628
   38   HD12  LEU   6          HD12      LEU   6 -20.894   4.141   3.257
   39   HD13  LEU   6          HD13      LEU   6 -19.591   5.166   2.657
   40   HD21  LEU   6          HD21      LEU   6 -17.673   3.059   1.740
   41   HD22  LEU   6          HD22      LEU   6 -18.185   4.436   0.764
   42   HD23  LEU   6          HD23      LEU   6 -18.334   2.799   0.126
   43    H    SER   7           H        SER   7 -21.092  -0.766   2.385
   44    HA   SER   7           HA       SER   7 -20.493  -3.039   2.499
   45    HB2  SER   7           HB2      SER   7 -21.822  -2.652   0.226
   46    HB3  SER   7           HB3      SER   7 -20.266  -3.052  -0.493
   47    HG   SER   7           HG       SER   7 -22.055  -4.716   0.423
   48    H    THR   8           H        THR   8 -18.346  -1.719   3.179
   49    HA   THR   8           HA       THR   8 -15.989  -1.689   3.211
   50    HB   THR   8           HB       THR   8 -16.272  -4.206   1.548
   51    HG1  THR   8           HG1      THR   8 -16.554  -3.969   4.360
   52   HG21  THR   8          HG21      THR   8 -14.417  -3.639   3.862
   53   HG22  THR   8          HG22      THR   8 -13.995  -3.223   2.202
   54   HG23  THR   8          HG23      THR   8 -14.284  -4.906   2.643
   55    H    GLY   9           H        GLY   9 -16.810   0.094   1.356
   56    HA2  GLY   9           HA2      GLY   9 -15.369  -0.537  -1.179
   57    HA3  GLY   9           HA3      GLY   9 -16.548   0.760  -0.981
   58    H    LEU  10           H        LEU  10 -15.879   2.497   0.640
   59    HA   LEU  10           HA       LEU  10 -13.379   3.668  -0.109
   60    HB2  LEU  10           HB2      LEU  10 -15.717   4.361   1.274
   61    HB3  LEU  10           HB3      LEU  10 -14.437   4.539   2.472
   62    HG   LEU  10           HG       LEU  10 -14.778   6.640   1.225
   63   HD11  LEU  10          HD11      LEU  10 -12.508   7.107   0.893
   64   HD12  LEU  10          HD12      LEU  10 -12.174   5.508   0.228
   65   HD13  LEU  10          HD13      LEU  10 -12.446   5.704   1.959
   66   HD21  LEU  10          HD21      LEU  10 -13.833   5.135  -1.230
   67   HD22  LEU  10          HD22      LEU  10 -14.448   6.786  -1.144
   68   HD23  LEU  10          HD23      LEU  10 -15.539   5.425  -0.889
   69    H    LEU  11           H        LEU  11 -14.329   1.775   2.765
   70    HA   LEU  11           HA       LEU  11 -11.963   2.093   4.312
   71    HB2  LEU  11           HB2      LEU  11 -14.219   1.024   4.888
   72    HB3  LEU  11           HB3      LEU  11 -13.634  -0.423   4.065
   73    HG   LEU  11           HG       LEU  11 -11.565  -0.236   5.599
   74   HD11  LEU  11          HD11      LEU  11 -11.847   1.986   6.460
   75   HD12  LEU  11          HD12      LEU  11 -12.162   0.888   7.804
   76   HD13  LEU  11          HD13      LEU  11 -13.507   1.652   6.955
   77   HD21  LEU  11          HD21      LEU  11 -12.650  -1.541   7.306
   78   HD22  LEU  11          HD22      LEU  11 -13.491  -1.887   5.794
   79   HD23  LEU  11          HD23      LEU  11 -14.210  -0.789   6.973
   80    H    HIS  12           H        HIS  12 -12.784  -0.507   1.965
   81    HA   HIS  12           HA       HIS  12 -10.234  -1.833   2.095
   82    HB2  HIS  12           HB2      HIS  12 -12.731  -1.922   0.568
   83    HB3  HIS  12           HB3      HIS  12 -11.332  -2.292  -0.439
   84    HD1  HIS  12           HD1      HIS  12 -12.322  -4.804  -0.453
   85    HD2  HIS  12           HD2      HIS  12 -10.905  -3.450   3.229
   86    HE1  HIS  12           HE1      HIS  12 -12.024  -6.856   0.999
   87    H    LEU  13           H        LEU  13 -11.539   0.655  -0.127
   88    HA   LEU  13           HA       LEU  13  -9.292   0.837  -1.884
   89    HB2  LEU  13           HB2      LEU  13 -11.782   2.113  -1.423
   90    HB3  LEU  13           HB3      LEU  13 -10.569   3.391  -1.404
   91    HG   LEU  13           HG       LEU  13  -9.841   1.714  -3.545
   92   HD11  LEU  13          HD11      LEU  13 -12.821   2.068  -3.273
   93   HD12  LEU  13          HD12      LEU  13 -11.917   0.631  -3.751
   94   HD13  LEU  13          HD13      LEU  13 -12.073   1.986  -4.868
   95   HD21  LEU  13          HD21      LEU  13 -11.279   4.382  -3.416
   96   HD22  LEU  13          HD22      LEU  13 -10.596   3.711  -4.897
   97   HD23  LEU  13          HD23      LEU  13  -9.540   4.115  -3.542
   98    H    HIS  14           H        HIS  14 -10.006   2.472   1.206
   99    HA   HIS  14           HA       HIS  14  -7.826   4.305   1.262
  100    HB2  HIS  14           HB2      HIS  14  -9.562   4.560   2.854
  101    HB3  HIS  14           HB3      HIS  14  -9.510   2.861   3.315
  102    HD1  HIS  14           HD1      HIS  14  -8.824   2.930   5.739
  103    HD2  HIS  14           HD2      HIS  14  -6.425   5.388   3.375
  104    HE1  HIS  14           HE1      HIS  14  -6.957   3.766   7.232
  105    H    GLN  15           H        GLN  15  -8.042   1.037   2.752
  106    HA   GLN  15           HA       GLN  15  -5.360   0.867   3.665
  107    HB2  GLN  15           HB2      GLN  15  -7.565  -0.660   3.841
  108    HB3  GLN  15           HB3      GLN  15  -6.724  -1.557   2.575
  109    HG2  GLN  15           HG2      GLN  15  -5.840  -2.572   4.469
  110    HG3  GLN  15           HG3      GLN  15  -4.653  -1.297   4.202
  111   HE21  GLN  15          HE21      GLN  15  -4.696   0.574   5.659
  112   HE22  GLN  15          HE22      GLN  15  -5.568   0.533   7.115
  113    H    ASN  16           H        ASN  16  -6.753  -0.215   0.540
  114    HA   ASN  16           HA       ASN  16  -4.516  -1.352  -0.693
  115    HB2  ASN  16           HB2      ASN  16  -6.964  -0.951  -1.473
  116    HB3  ASN  16           HB3      ASN  16  -6.364   0.585  -2.097
  117   HD21  ASN  16          HD21      ASN  16  -4.287   0.321  -3.549
  118   HD22  ASN  16          HD22      ASN  16  -4.276  -1.015  -4.596
  119    H    ILE  17           H        ILE  17  -5.354   2.135  -0.580
  120    HA   ILE  17           HA       ILE  17  -2.970   2.989  -2.015
  121    HB   ILE  17           HB       ILE  17  -5.098   4.328  -0.321
  122   HG12  ILE  17          HG12      ILE  17  -5.782   3.470  -2.535
  123   HG13  ILE  17          HG13      ILE  17  -5.808   5.233  -2.511
  124   HG21  ILE  17          HG21      ILE  17  -2.615   5.479  -1.564
  125   HG22  ILE  17          HG22      ILE  17  -3.356   5.851  -0.007
  126   HG23  ILE  17          HG23      ILE  17  -4.084   6.452  -1.497
  127   HD11  ILE  17          HD11      ILE  17  -3.809   3.400  -3.827
  128   HD12  ILE  17          HD12      ILE  17  -3.377   5.061  -3.423
  129   HD13  ILE  17          HD13      ILE  17  -4.707   4.743  -4.534
  130    H    VAL  18           H        VAL  18  -3.911   2.879   1.431
  131    HA   VAL  18           HA       VAL  18  -1.524   4.089   2.475
  132    HB   VAL  18           HB       VAL  18  -3.673   2.257   3.558
  133   HG11  VAL  18          HG11      VAL  18  -2.769   2.983   5.834
  134   HG12  VAL  18          HG12      VAL  18  -1.299   3.469   4.990
  135   HG13  VAL  18          HG13      VAL  18  -1.807   1.780   4.974
  136   HG21  VAL  18          HG21      VAL  18  -3.045   5.204   3.646
  137   HG22  VAL  18          HG22      VAL  18  -4.094   4.469   4.857
  138   HG23  VAL  18          HG23      VAL  18  -4.540   4.410   3.152
  139    H    ASP  19           H        ASP  19  -2.356   0.741   1.676
  140    HA   ASP  19           HA       ASP  19  -0.055  -0.509   2.892
  141    HB2  ASP  19           HB2      ASP  19  -1.972  -1.250   0.662
  142    HB3  ASP  19           HB3      ASP  19  -0.715  -2.349   1.223
  143    H    VAL  20           H        VAL  20  -0.412   1.402   0.020
  144    HA   VAL  20           HA       VAL  20   2.152   0.359  -1.099
  145    HB   VAL  20           HB       VAL  20   0.005   2.186  -2.234
  146   HG11  VAL  20          HG11      VAL  20   1.160   1.983  -4.343
  147   HG12  VAL  20          HG12      VAL  20   2.295   0.813  -3.668
  148   HG13  VAL  20          HG13      VAL  20   2.347   2.496  -3.144
  149   HG21  VAL  20          HG21      VAL  20  -0.732   0.278  -3.499
  150   HG22  VAL  20          HG22      VAL  20  -0.602  -0.257  -1.824
  151   HG23  VAL  20          HG23      VAL  20   0.658  -0.678  -2.984
  152    H    GLN  21           H        GLN  21   0.528   3.291   0.042
  153    HA   GLN  21           HA       GLN  21   2.681   5.129  -0.493
  154    HB2  GLN  21           HB2      GLN  21   0.203   5.044   1.202
  155    HB3  GLN  21           HB3      GLN  21   1.338   6.378   1.408
  156    HG2  GLN  21           HG2      GLN  21   1.233   6.590  -1.178
  157    HG3  GLN  21           HG3      GLN  21  -0.229   5.611  -1.051
  158   HE21  GLN  21          HE21      GLN  21   0.918   8.815  -0.922
  159   HE22  GLN  21          HE22      GLN  21  -0.435   9.524  -0.181
  160    H    TYR  22           H        TYR  22   1.872   3.122   2.364
  161    HA   TYR  22           HA       TYR  22   3.756   4.293   4.169
  162    HB2  TYR  22           HB2      TYR  22   2.992   2.642   5.563
  163    HB3  TYR  22           HB3      TYR  22   1.793   2.421   4.298
  164    HD1  TYR  22           HD1      TYR  22   4.992   1.140   5.683
  165    HD2  TYR  22           HD2      TYR  22   1.779   0.463   2.920
  166    HE1  TYR  22           HE1      TYR  22   5.768  -1.193   5.349
  167    HE2  TYR  22           HE2      TYR  22   2.555  -1.865   2.583
  168    HH   TYR  22           HH       TYR  22   3.925  -3.568   4.012
  169    H    MET  23           H        MET  23   4.187   1.932   1.572
  170    HA   MET  23           HA       MET  23   7.045   1.541   2.363
  171    HB2  MET  23           HB2      MET  23   5.281  -0.312   1.822
  172    HB3  MET  23           HB3      MET  23   5.571   0.133   0.142
  173    HG2  MET  23           HG2      MET  23   7.162  -1.543   0.443
  174    HG3  MET  23           HG3      MET  23   8.107  -0.103   0.822
  175    HE1  MET  23           HE1      MET  23   8.744   0.604   3.528
  176    HE2  MET  23           HE2      MET  23   9.635  -0.238   2.263
  177    HE3  MET  23           HE3      MET  23   9.649  -0.867   3.909
  178    H    TYR  24           H        TYR  24   5.666   3.938   0.824
  179    HA   TYR  24           HA       TYR  24   7.302   3.822  -1.676
  180    HB2  TYR  24           HB2      TYR  24   4.677   4.707  -0.964
  181    HB3  TYR  24           HB3      TYR  24   5.590   6.113  -1.508
  182    HD1  TYR  24           HD1      TYR  24   5.274   2.488  -2.471
  183    HD2  TYR  24           HD2      TYR  24   5.448   6.577  -3.780
  184    HE1  TYR  24           HE1      TYR  24   5.022   1.747  -4.824
  185    HE2  TYR  24           HE2      TYR  24   5.195   5.834  -6.132
  186    HH   TYR  24           HH       TYR  24   5.831   3.185  -7.300
  187    H    GLY  25           H        GLY  25   8.046   4.680   1.309
  188    HA2  GLY  25           HA2      GLY  25   9.565   6.197   2.245
  189    HA3  GLY  25           HA3      GLY  25  10.053   6.580   0.596
  190    H    LEU  26           H        LEU  26   6.753   7.006   1.796
  191    HA   LEU  26           HA       LEU  26   6.941   9.898   1.155
  192    HB2  LEU  26           HB2      LEU  26   4.963   7.787   1.090
  193    HB3  LEU  26           HB3      LEU  26   4.345   9.160   2.007
  194    HG   LEU  26           HG       LEU  26   5.467  10.468  -0.086
  195   HD11  LEU  26          HD11      LEU  26   4.244   8.036  -1.384
  196   HD12  LEU  26          HD12      LEU  26   5.972   8.101  -1.035
  197   HD13  LEU  26          HD13      LEU  26   5.245   9.290  -2.116
  198   HD21  LEU  26          HD21      LEU  26   3.090  10.343  -1.091
  199   HD22  LEU  26          HD22      LEU  26   3.234  10.934   0.564
  200   HD23  LEU  26          HD23      LEU  26   2.712   9.276   0.262
  201    H    SER  27           H        SER  27   6.052   7.771   3.862
  202    HA   SER  27           HA       SER  27   5.329   9.735   5.771
  203    HB2  SER  27           HB2      SER  27   6.744   7.077   6.159
  204    HB3  SER  27           HB3      SER  27   5.850   7.950   7.398
  205    HG   SER  27           HG       SER  27   4.538   6.382   6.424
  206    HA   PRO  28           HA       PRO  28   9.928   9.896   7.170
  207    HB2  PRO  28           HB2      PRO  28  11.833   8.914   5.471
  208    HB3  PRO  28           HB3      PRO  28  11.058   7.931   6.730
  209    HG2  PRO  28           HG2      PRO  28  10.488   8.057   3.810
  210    HG3  PRO  28           HG3      PRO  28  10.529   6.657   4.893
  211    HD2  PRO  28           HD2      PRO  28   8.225   7.834   4.070
  212    HD3  PRO  28           HD3      PRO  28   8.388   6.996   5.628
  213    H    ALA  29           H        ALA  29   8.718  10.642   4.067
  214    HA   ALA  29           HA       ALA  29  10.835  12.649   3.479
  215    HB1  ALA  29           HB1      ALA  29  10.106  11.198   1.669
  216    HB2  ALA  29           HB2      ALA  29   9.510  12.825   1.337
  217    HB3  ALA  29           HB3      ALA  29   8.416  11.598   1.977
  218    H    ILE  30           H        ILE  30   7.335  12.430   4.176
  219    HA   ILE  30           HA       ILE  30   6.889  15.302   3.972
  220    HB   ILE  30           HB       ILE  30   5.292  13.014   5.169
  221   HG12  ILE  30          HG12      ILE  30   4.709  14.449   2.585
  222   HG13  ILE  30          HG13      ILE  30   5.917  13.164   2.619
  223   HG21  ILE  30          HG21      ILE  30   4.567  15.901   4.599
  224   HG22  ILE  30          HG22      ILE  30   4.454  15.045   6.138
  225   HG23  ILE  30          HG23      ILE  30   3.357  14.635   4.818
  226   HD11  ILE  30          HD11      ILE  30   3.736  12.136   4.054
  227   HD12  ILE  30          HD12      ILE  30   4.226  11.689   2.420
  228   HD13  ILE  30          HD13      ILE  30   3.021  12.954   2.664
  229    H    THR  31           H        THR  31   7.548  13.047   6.625
  230    HA   THR  31           HA       THR  31   6.990  14.779   8.827
  231    HB   THR  31           HB       THR  31   8.737  13.223   9.943
  232    HG1  THR  31           HG1      THR  31   8.495  11.581   7.721
  233   HG21  THR  31          HG21      THR  31   7.176  11.212   9.585
  234   HG22  THR  31          HG22      THR  31   6.262  12.263   8.504
  235   HG23  THR  31          HG23      THR  31   6.441  12.690  10.205
  236    H    LYS  32           H        LYS  32   9.922  14.390   6.837
  237    HA   LYS  32           HA       LYS  32  11.394  16.402   8.436
  238    HB2  LYS  32           HB2      LYS  32  11.945  14.489   6.186
  239    HB3  LYS  32           HB3      LYS  32  13.055  15.835   6.446
  240    HG2  LYS  32           HG2      LYS  32  13.105  15.105   8.910
  241    HG3  LYS  32           HG3      LYS  32  12.339  13.613   8.363
  242    HD2  LYS  32           HD2      LYS  32  14.256  13.504   6.624
  243    HD3  LYS  32           HD3      LYS  32  15.061  14.696   7.644
  244    HE2  LYS  32           HE2      LYS  32  15.454  13.182   9.331
  245    HE3  LYS  32           HE3      LYS  32  13.929  12.322   9.049
  246    HZ1  LYS  32           HZ1      LYS  32  14.826  11.384   7.037
  247    HZ2  LYS  32           HZ2      LYS  32  15.887  11.036   8.318
  248    HZ3  LYS  32           HZ3      LYS  32  16.265  12.266   7.208
  249    H    TYR  33           H        TYR  33   8.942  16.846   6.416
  250    HA   TYR  33           HA       TYR  33  10.223  18.990   4.767
  251    HB2  TYR  33           HB2      TYR  33   8.485  16.899   4.164
  252    HB3  TYR  33           HB3      TYR  33   7.417  18.300   4.254
  253    HD1  TYR  33           HD1      TYR  33   7.775  20.257   2.780
  254    HD2  TYR  33           HD2      TYR  33  10.174  16.708   2.442
  255    HE1  TYR  33           HE1      TYR  33   8.572  21.007   0.556
  256    HE2  TYR  33           HE2      TYR  33  10.969  17.460   0.217
  257    HH   TYR  33           HH       TYR  33   9.663  19.352  -1.658
  258    H    VAL  34           H        VAL  34   7.321  18.334   6.778
  259    HA   VAL  34           HA       VAL  34   6.620  21.185   6.930
  260    HB   VAL  34           HB       VAL  34   5.594  18.783   8.488
  261   HG11  VAL  34          HG11      VAL  34   4.573  21.578   7.989
  262   HG12  VAL  34          HG12      VAL  34   4.748  20.728   9.525
  263   HG13  VAL  34          HG13      VAL  34   3.469  20.265   8.402
  264   HG21  VAL  34          HG21      VAL  34   4.817  19.902   5.779
  265   HG22  VAL  34          HG22      VAL  34   3.774  18.822   6.705
  266   HG23  VAL  34          HG23      VAL  34   5.351  18.263   6.151
  267    H    VAL  35           H        VAL  35   8.897  21.675   7.816
  268    HA   VAL  35           HA       VAL  35   8.922  21.375  10.804
  269    HB   VAL  35           HB       VAL  35  11.288  21.472   8.898
  270   HG11  VAL  35          HG11      VAL  35  12.119  22.119  10.980
  271   HG12  VAL  35          HG12      VAL  35  12.311  20.367  11.059
  272   HG13  VAL  35          HG13      VAL  35  10.947  21.142  11.864
  273   HG21  VAL  35          HG21      VAL  35  11.460  18.997   9.586
  274   HG22  VAL  35          HG22      VAL  35  10.192  19.406   8.430
  275   HG23  VAL  35          HG23      VAL  35   9.788  19.149  10.127
  276    H    ARG  36           H        ARG  36   7.636  23.546  10.179
  277    HA   ARG  36           HA       ARG  36   9.631  25.791  10.118
  278    HB2  ARG  36           HB2      ARG  36   7.422  25.152   8.430
  279    HB3  ARG  36           HB3      ARG  36   6.982  26.597   9.340
  280    HG2  ARG  36           HG2      ARG  36   9.747  26.577   8.283
  281    HG3  ARG  36           HG3      ARG  36   8.479  26.638   7.060
  282    HD2  ARG  36           HD2      ARG  36   8.710  28.915   7.509
  283    HD3  ARG  36           HD3      ARG  36   7.482  28.496   8.721
  284    HE   ARG  36           HE       ARG  36  10.227  28.076   9.655
  285   HH11  ARG  36          HH11      ARG  36  10.059  30.978   8.882
  286   HH12  ARG  36          HH12      ARG  36   9.484  31.707  10.344
  287   HH21  ARG  36          HH21      ARG  36   8.424  28.699  11.734
  288   HH22  ARG  36          HH22      ARG  36   8.553  30.413  11.964
  Start of MODEL   35
    1    HA   SER   1           HA       SER   1 -20.846  -8.199  -9.124
    2    HB2  SER   1           HB2      SER   1 -23.243  -8.802  -8.592
    3    HB3  SER   1           HB3      SER   1 -22.631 -10.086  -7.553
    4    HG   SER   1           HG       SER   1 -22.782  -8.425  -6.186
    5    H    ASP   2           H        ASP   2 -19.561  -8.155  -7.099
    6    HA   ASP   2           HA       ASP   2 -18.430 -10.712  -6.135
    7    HB2  ASP   2           HB2      ASP   2 -16.182 -10.173  -6.836
    8    HB3  ASP   2           HB3      ASP   2 -17.217  -9.994  -8.251
    9    H    LEU   3           H        LEU   3 -16.934 -10.305  -4.268
   10    HA   LEU   3           HA       LEU   3 -16.558  -9.339  -2.146
   11    HB2  LEU   3           HB2      LEU   3 -15.462  -7.851  -4.001
   12    HB3  LEU   3           HB3      LEU   3 -16.730  -6.703  -3.578
   13    HG   LEU   3           HG       LEU   3 -15.682  -7.621  -1.123
   14   HD11  LEU   3          HD11      LEU   3 -13.279  -7.046  -1.369
   15   HD12  LEU   3          HD12      LEU   3 -13.508  -6.892  -3.111
   16   HD13  LEU   3          HD13      LEU   3 -13.715  -8.460  -2.330
   17   HD21  LEU   3          HD21      LEU   3 -15.467  -5.075  -2.735
   18   HD22  LEU   3          HD22      LEU   3 -14.728  -5.211  -1.139
   19   HD23  LEU   3          HD23      LEU   3 -16.473  -5.396  -1.322
   20    HA   PRO   4           HA       PRO   4 -20.977  -7.799  -1.859
   21    HB2  PRO   4           HB2      PRO   4 -22.211 -10.086  -1.016
   22    HB3  PRO   4           HB3      PRO   4 -22.021  -9.665  -2.727
   23    HG2  PRO   4           HG2      PRO   4 -20.582 -11.665  -1.112
   24    HG3  PRO   4           HG3      PRO   4 -20.906 -11.633  -2.849
   25    HD2  PRO   4           HD2      PRO   4 -18.484 -10.974  -1.579
   26    HD3  PRO   4           HD3      PRO   4 -18.901 -10.689  -3.281
   27    H    ALA   5           H        ALA   5 -19.137  -7.136  -0.043
   28    HA   ALA   5           HA       ALA   5 -19.654  -8.417   2.574
   29    HB1  ALA   5           HB1      ALA   5 -17.826  -7.014   3.298
   30    HB2  ALA   5           HB2      ALA   5 -17.989  -5.978   1.880
   31    HB3  ALA   5           HB3      ALA   5 -17.400  -7.631   1.701
   32    H    LEU   6           H        LEU   6 -20.596  -5.526   0.794
   33    HA   LEU   6           HA       LEU   6 -22.086  -3.780   1.308
   34    HB2  LEU   6           HB2      LEU   6 -22.954  -6.170   2.890
   35    HB3  LEU   6           HB3      LEU   6 -23.751  -4.632   3.216
   36    HG   LEU   6           HG       LEU   6 -23.430  -5.240   0.348
   37   HD11  LEU   6          HD11      LEU   6 -25.147  -6.967   2.151
   38   HD12  LEU   6          HD12      LEU   6 -23.881  -7.504   1.047
   39   HD13  LEU   6          HD13      LEU   6 -25.386  -6.842   0.409
   40   HD21  LEU   6          HD21      LEU   6 -25.746  -4.422   0.309
   41   HD22  LEU   6          HD22      LEU   6 -24.742  -3.339   1.274
   42   HD23  LEU   6          HD23      LEU   6 -25.816  -4.490   2.071
   43    H    SER   7           H        SER   7 -19.478  -3.977   2.821
   44    HA   SER   7           HA       SER   7 -20.001  -1.867   4.766
   45    HB2  SER   7           HB2      SER   7 -19.860  -4.719   5.536
   46    HB3  SER   7           HB3      SER   7 -18.833  -3.659   6.495
   47    HG   SER   7           HG       SER   7 -21.623  -3.387   6.005
   48    H    THR   8           H        THR   8 -18.279  -2.047   2.495
   49    HA   THR   8           HA       THR   8 -15.630  -1.721   3.820
   50    HB   THR   8           HB       THR   8 -16.217  -3.402   1.354
   51    HG1  THR   8           HG1      THR   8 -15.466  -4.004   4.015
   52   HG21  THR   8          HG21      THR   8 -14.086  -2.482   0.962
   53   HG22  THR   8          HG22      THR   8 -13.726  -4.017   1.751
   54   HG23  THR   8          HG23      THR   8 -13.655  -2.515   2.672
   55    H    GLY   9           H        GLY   9 -16.015  -1.818   0.335
   56    HA2  GLY   9           HA2      GLY   9 -15.762  -0.148  -1.290
   57    HA3  GLY   9           HA3      GLY   9 -16.748   0.850  -0.224
   58    H    LEU  10           H        LEU  10 -15.771   2.530   0.829
   59    HA   LEU  10           HA       LEU  10 -13.181   3.465   0.119
   60    HB2  LEU  10           HB2      LEU  10 -15.203   4.686   1.110
   61    HB3  LEU  10           HB3      LEU  10 -14.683   4.072   2.679
   62    HG   LEU  10           HG       LEU  10 -12.362   5.087   2.034
   63   HD11  LEU  10          HD11      LEU  10 -14.259   6.543   0.170
   64   HD12  LEU  10          HD12      LEU  10 -12.829   5.615  -0.283
   65   HD13  LEU  10          HD13      LEU  10 -12.654   7.136   0.595
   66   HD21  LEU  10          HD21      LEU  10 -14.822   6.666   2.818
   67   HD22  LEU  10          HD22      LEU  10 -13.209   7.377   2.827
   68   HD23  LEU  10          HD23      LEU  10 -13.573   6.005   3.874
   69    H    LEU  11           H        LEU  11 -14.230   1.371   2.782
   70    HA   LEU  11           HA       LEU  11 -11.952   1.483   4.471
   71    HB2  LEU  11           HB2      LEU  11 -14.188  -0.367   3.860
   72    HB3  LEU  11           HB3      LEU  11 -12.792  -1.117   4.632
   73    HG   LEU  11           HG       LEU  11 -12.884   0.793   6.333
   74   HD11  LEU  11          HD11      LEU  11 -15.587   1.139   5.001
   75   HD12  LEU  11          HD12      LEU  11 -14.296   2.337   5.090
   76   HD13  LEU  11          HD13      LEU  11 -15.148   1.848   6.554
   77   HD21  LEU  11          HD21      LEU  11 -14.705  -0.300   7.615
   78   HD22  LEU  11          HD22      LEU  11 -13.652  -1.490   6.851
   79   HD23  LEU  11          HD23      LEU  11 -15.229  -1.128   6.148
   80    H    HIS  12           H        HIS  12 -12.552  -0.527   1.573
   81    HA   HIS  12           HA       HIS  12  -9.936  -1.848   1.740
   82    HB2  HIS  12           HB2      HIS  12 -12.368  -2.393   0.590
   83    HB3  HIS  12           HB3      HIS  12 -11.446  -1.841  -0.806
   84    HD1  HIS  12           HD1      HIS  12  -8.742  -2.956  -0.490
   85    HD2  HIS  12           HD2      HIS  12 -12.091  -5.129   0.710
   86    HE1  HIS  12           HE1      HIS  12  -8.035  -5.385  -0.423
   87    H    LEU  13           H        LEU  13 -11.421   0.749  -0.200
   88    HA   LEU  13           HA       LEU  13  -9.284   1.217  -2.027
   89    HB2  LEU  13           HB2      LEU  13 -11.684   2.092  -2.003
   90    HB3  LEU  13           HB3      LEU  13 -11.148   3.277  -0.812
   91    HG   LEU  13           HG       LEU  13  -9.368   3.142  -3.132
   92   HD11  LEU  13          HD11      LEU  13 -11.577   2.598  -4.203
   93   HD12  LEU  13          HD12      LEU  13 -10.885   4.125  -4.748
   94   HD13  LEU  13          HD13      LEU  13 -12.203   4.123  -3.576
   95   HD21  LEU  13          HD21      LEU  13 -10.996   5.508  -2.222
   96   HD22  LEU  13          HD22      LEU  13  -9.355   5.476  -2.863
   97   HD23  LEU  13          HD23      LEU  13  -9.671   4.909  -1.223
   98    H    HIS  14           H        HIS  14  -9.907   2.596   1.219
   99    HA   HIS  14           HA       HIS  14  -7.748   4.467   1.273
  100    HB2  HIS  14           HB2      HIS  14  -9.629   4.436   2.853
  101    HB3  HIS  14           HB3      HIS  14  -9.105   2.871   3.474
  102    HD1  HIS  14           HD1      HIS  14  -7.765   6.430   3.150
  103    HD2  HIS  14           HD2      HIS  14  -7.286   3.059   5.556
  104    HE1  HIS  14           HE1      HIS  14  -6.209   7.106   5.029
  105    H    GLN  15           H        GLN  15  -7.886   1.111   2.574
  106    HA   GLN  15           HA       GLN  15  -5.147   0.984   3.397
  107    HB2  GLN  15           HB2      GLN  15  -7.364  -0.574   3.628
  108    HB3  GLN  15           HB3      GLN  15  -6.482  -1.475   2.395
  109    HG2  GLN  15           HG2      GLN  15  -5.842  -2.294   4.608
  110    HG3  GLN  15           HG3      GLN  15  -4.471  -1.466   3.869
  111   HE21  GLN  15          HE21      GLN  15  -3.439  -0.069   5.309
  112   HE22  GLN  15          HE22      GLN  15  -4.205   0.767   6.573
  113    H    ASN  16           H        ASN  16  -6.697   0.486   0.256
  114    HA   ASN  16           HA       ASN  16  -4.490  -0.817  -1.058
  115    HB2  ASN  16           HB2      ASN  16  -7.044  -0.376  -1.668
  116    HB3  ASN  16           HB3      ASN  16  -6.376   1.044  -2.472
  117   HD21  ASN  16          HD21      ASN  16  -5.291  -2.403  -2.168
  118   HD22  ASN  16          HD22      ASN  16  -5.035  -2.611  -3.832
  119    H    ILE  17           H        ILE  17  -5.133   2.537  -0.225
  120    HA   ILE  17           HA       ILE  17  -2.884   3.475  -1.950
  121    HB   ILE  17           HB       ILE  17  -5.122   4.826  -0.403
  122   HG12  ILE  17          HG12      ILE  17  -4.544   4.972  -3.364
  123   HG13  ILE  17          HG13      ILE  17  -5.467   3.631  -2.684
  124   HG21  ILE  17          HG21      ILE  17  -2.966   6.132  -2.095
  125   HG22  ILE  17          HG22      ILE  17  -3.047   6.205  -0.334
  126   HG23  ILE  17          HG23      ILE  17  -4.313   6.953  -1.306
  127   HD11  ILE  17          HD11      ILE  17  -7.197   5.055  -1.925
  128   HD12  ILE  17          HD12      ILE  17  -6.797   5.682  -3.525
  129   HD13  ILE  17          HD13      ILE  17  -6.195   6.497  -2.081
  130    H    VAL  18           H        VAL  18  -3.820   3.015   1.427
  131    HA   VAL  18           HA       VAL  18  -1.416   4.461   2.401
  132    HB   VAL  18           HB       VAL  18  -3.777   3.126   3.765
  133   HG11  VAL  18          HG11      VAL  18  -2.966   4.462   5.763
  134   HG12  VAL  18          HG12      VAL  18  -1.470   4.748   4.873
  135   HG13  VAL  18          HG13      VAL  18  -1.933   3.105   5.314
  136   HG21  VAL  18          HG21      VAL  18  -4.657   5.038   2.766
  137   HG22  VAL  18          HG22      VAL  18  -3.133   5.919   2.869
  138   HG23  VAL  18          HG23      VAL  18  -4.120   5.692   4.313
  139    H    ASP  19           H        ASP  19  -2.345   1.243   1.613
  140    HA   ASP  19           HA       ASP  19  -0.071   0.154   3.249
  141    HB2  ASP  19           HB2      ASP  19  -2.813  -0.486   3.202
  142    HB3  ASP  19           HB3      ASP  19  -2.026  -1.795   2.323
  143    H    VAL  20           H        VAL  20   0.233   1.290   0.584
  144    HA   VAL  20           HA       VAL  20   1.166  -1.152  -0.864
  145    HB   VAL  20           HB       VAL  20  -0.616   1.092  -1.851
  146   HG11  VAL  20          HG11      VAL  20  -0.347  -0.029  -4.120
  147   HG12  VAL  20          HG12      VAL  20   1.048  -0.873  -3.449
  148   HG13  VAL  20          HG13      VAL  20   1.055   0.887  -3.567
  149   HG21  VAL  20          HG21      VAL  20  -0.792  -1.932  -1.787
  150   HG22  VAL  20          HG22      VAL  20  -1.923  -0.915  -2.678
  151   HG23  VAL  20          HG23      VAL  20  -1.812  -0.780  -0.923
  152    H    GLN  21           H        GLN  21   1.106   2.410  -1.097
  153    HA   GLN  21           HA       GLN  21   3.635   2.675  -2.444
  154    HB2  GLN  21           HB2      GLN  21   1.811   4.447  -0.813
  155    HB3  GLN  21           HB3      GLN  21   3.351   5.063  -1.417
  156    HG2  GLN  21           HG2      GLN  21   2.132   3.706  -3.587
  157    HG3  GLN  21           HG3      GLN  21   0.875   4.699  -2.849
  158   HE21  GLN  21          HE21      GLN  21   1.757   7.064  -2.270
  159   HE22  GLN  21          HE22      GLN  21   2.701   7.791  -3.479
  160    H    TYR  22           H        TYR  22   2.864   1.923   0.830
  161    HA   TYR  22           HA       TYR  22   5.500   2.860   1.855
  162    HB2  TYR  22           HB2      TYR  22   3.123   1.683   3.333
  163    HB3  TYR  22           HB3      TYR  22   4.437   2.641   4.017
  164    HD1  TYR  22           HD1      TYR  22   4.578   5.074   3.599
  165    HD2  TYR  22           HD2      TYR  22   1.335   2.718   2.059
  166    HE1  TYR  22           HE1      TYR  22   3.309   7.143   3.093
  167    HE2  TYR  22           HE2      TYR  22   0.070   4.784   1.556
  168    HH   TYR  22           HH       TYR  22   0.559   7.598   2.838
  169    H    MET  23           H        MET  23   3.730  -0.038   0.999
  170    HA   MET  23           HA       MET  23   5.685  -1.794   2.393
  171    HB2  MET  23           HB2      MET  23   4.073  -3.546   1.833
  172    HB3  MET  23           HB3      MET  23   3.214  -2.173   2.522
  173    HG2  MET  23           HG2      MET  23   1.922  -2.147   0.681
  174    HG3  MET  23           HG3      MET  23   3.340  -1.680  -0.253
  175    HE1  MET  23           HE1      MET  23   0.966  -5.423  -0.242
  176    HE2  MET  23           HE2      MET  23   0.752  -3.901   0.618
  177    HE3  MET  23           HE3      MET  23   1.741  -5.173   1.328
  178    H    TYR  24           H        TYR  24   5.026  -0.504  -0.780
  179    HA   TYR  24           HA       TYR  24   6.898  -2.508  -2.000
  180    HB2  TYR  24           HB2      TYR  24   4.284  -1.586  -2.673
  181    HB3  TYR  24           HB3      TYR  24   5.381  -0.987  -3.916
  182    HD1  TYR  24           HD1      TYR  24   7.262  -2.819  -4.610
  183    HD2  TYR  24           HD2      TYR  24   3.361  -3.690  -3.037
  184    HE1  TYR  24           HE1      TYR  24   7.360  -5.080  -5.621
  185    HE2  TYR  24           HE2      TYR  24   3.459  -5.953  -4.048
  186    HH   TYR  24           HH       TYR  24   5.073  -6.874  -6.335
  187    H    GLY  25           H        GLY  25   7.667   0.026  -0.566
  188    HA2  GLY  25           HA2      GLY  25   9.819   0.975  -1.872
  189    HA3  GLY  25           HA3      GLY  25   8.542   1.807  -2.758
  190    H    LEU  26           H        LEU  26   9.822   1.324   0.530
  191    HA   LEU  26           HA       LEU  26   8.507   3.865   1.386
  192    HB2  LEU  26           HB2      LEU  26   9.009   3.019   3.653
  193    HB3  LEU  26           HB3      LEU  26   8.135   1.816   2.707
  194    HG   LEU  26           HG       LEU  26  10.937   1.456   2.235
  195   HD11  LEU  26          HD11      LEU  26  11.682   2.326   4.239
  196   HD12  LEU  26          HD12      LEU  26  11.274   0.694   4.769
  197   HD13  LEU  26          HD13      LEU  26  10.153   2.024   5.062
  198   HD21  LEU  26          HD21      LEU  26  10.447  -0.782   3.150
  199   HD22  LEU  26          HD22      LEU  26   9.160  -0.262   2.063
  200   HD23  LEU  26          HD23      LEU  26   8.924  -0.184   3.809
  201    H    SER  27           H        SER  27  11.469   2.900   0.147
  202    HA   SER  27           HA       SER  27  13.360   4.239   1.836
  203    HB2  SER  27           HB2      SER  27  13.237   3.349  -1.036
  204    HB3  SER  27           HB3      SER  27  14.621   4.279  -0.469
  205    HG   SER  27           HG       SER  27  15.143   2.196  -0.070
  206    HA   PRO  28           HA       PRO  28  12.809   8.037  -1.052
  207    HB2  PRO  28           HB2      PRO  28  10.633   8.097  -2.710
  208    HB3  PRO  28           HB3      PRO  28  12.205   7.437  -3.201
  209    HG2  PRO  28           HG2      PRO  28   9.750   6.009  -2.310
  210    HG3  PRO  28           HG3      PRO  28  10.908   5.581  -3.579
  211    HD2  PRO  28           HD2      PRO  28  10.887   4.424  -1.119
  212    HD3  PRO  28           HD3      PRO  28  12.353   4.588  -2.110
  213    H    ALA  29           H        ALA  29  10.160   6.416   0.486
  214    HA   ALA  29           HA       ALA  29   8.484   8.766   0.924
  215    HB1  ALA  29           HB1      ALA  29   7.212   7.205   2.302
  216    HB2  ALA  29           HB2      ALA  29   8.578   6.091   2.360
  217    HB3  ALA  29           HB3      ALA  29   7.730   6.366   0.839
  218    H    ILE  30           H        ILE  30  11.160   7.199   2.623
  219    HA   ILE  30           HA       ILE  30  10.724   8.797   5.071
  220    HB   ILE  30           HB       ILE  30  12.775   6.737   4.202
  221   HG12  ILE  30          HG12      ILE  30  10.639   6.534   6.340
  222   HG13  ILE  30          HG13      ILE  30  10.337   6.073   4.665
  223   HG21  ILE  30          HG21      ILE  30  13.163   6.753   6.805
  224   HG22  ILE  30          HG22      ILE  30  12.527   8.394   6.700
  225   HG23  ILE  30          HG23      ILE  30  13.977   7.950   5.799
  226   HD11  ILE  30          HD11      ILE  30  11.977   4.720   6.731
  227   HD12  ILE  30          HD12      ILE  30  12.671   4.756   5.109
  228   HD13  ILE  30          HD13      ILE  30  11.083   4.035   5.374
  229    H    THR  31           H        THR  31  12.809   8.797   2.224
  230    HA   THR  31           HA       THR  31  14.840  10.585   3.202
  231    HB   THR  31           HB       THR  31  15.191  10.955   0.716
  232    HG1  THR  31           HG1      THR  31  13.655  10.415  -0.590
  233   HG21  THR  31          HG21      THR  31  16.465   9.167   1.378
  234   HG22  THR  31          HG22      THR  31  15.334   8.298   0.341
  235   HG23  THR  31          HG23      THR  31  15.092   8.317   2.088
  236    H    LYS  32           H        LYS  32  11.887  11.236   1.255
  237    HA   LYS  32           HA       LYS  32  12.179  14.107   1.288
  238    HB2  LYS  32           HB2      LYS  32  10.440  12.097   0.227
  239    HB3  LYS  32           HB3      LYS  32   9.440  13.290   1.053
  240    HG2  LYS  32           HG2      LYS  32  11.578  13.977  -0.986
  241    HG3  LYS  32           HG3      LYS  32   9.859  13.855  -1.353
  242    HD2  LYS  32           HD2      LYS  32  10.517  15.574   0.964
  243    HD3  LYS  32           HD3      LYS  32  11.092  16.170  -0.592
  244    HE2  LYS  32           HE2      LYS  32   8.860  16.127  -1.523
  245    HE3  LYS  32           HE3      LYS  32   8.229  15.282  -0.096
  246    HZ1  LYS  32           HZ1      LYS  32   9.537  17.955  -0.048
  247    HZ2  LYS  32           HZ2      LYS  32   8.865  17.143   1.283
  248    HZ3  LYS  32           HZ3      LYS  32   7.862  17.700   0.030
  249    H    TYR  33           H        TYR  33  11.098  11.853   3.675
  250    HA   TYR  33           HA       TYR  33   9.398  13.732   5.155
  251    HB2  TYR  33           HB2      TYR  33   9.030  11.285   5.105
  252    HB3  TYR  33           HB3      TYR  33  10.609  11.031   5.847
  253    HD1  TYR  33           HD1      TYR  33   7.219  12.442   6.382
  254    HD2  TYR  33           HD2      TYR  33  10.959  11.363   8.198
  255    HE1  TYR  33           HE1      TYR  33   6.216  12.745   8.629
  256    HE2  TYR  33           HE2      TYR  33   9.956  11.665  10.444
  257    HH   TYR  33           HH       TYR  33   7.103  11.550  11.212
  258    H    VAL  34           H        VAL  34  12.741  12.525   5.326
  259    HA   VAL  34           HA       VAL  34  13.309  13.912   7.856
  260    HB   VAL  34           HB       VAL  34  15.015  12.439   5.815
  261   HG11  VAL  34          HG11      VAL  34  16.656  12.321   7.742
  262   HG12  VAL  34          HG12      VAL  34  15.669  13.525   8.570
  263   HG13  VAL  34          HG13      VAL  34  16.459  13.929   7.045
  264   HG21  VAL  34          HG21      VAL  34  13.130  11.325   7.345
  265   HG22  VAL  34          HG22      VAL  34  14.398  11.429   8.566
  266   HG23  VAL  34          HG23      VAL  34  14.678  10.525   7.078
  267    H    VAL  35           H        VAL  35  14.111  14.360   4.391
  268    HA   VAL  35           HA       VAL  35  15.519  16.893   5.007
  269    HB   VAL  35           HB       VAL  35  16.190  15.004   3.338
  270   HG11  VAL  35          HG11      VAL  35  15.174  14.930   1.248
  271   HG12  VAL  35          HG12      VAL  35  14.562  16.579   1.372
  272   HG13  VAL  35          HG13      VAL  35  13.783  15.278   2.274
  273   HG21  VAL  35          HG21      VAL  35  17.330  17.198   3.548
  274   HG22  VAL  35          HG22      VAL  35  16.157  17.901   2.432
  275   HG23  VAL  35          HG23      VAL  35  17.271  16.654   1.870
  276    H    ARG  36           H        ARG  36  12.340  15.916   4.230
  277    HA   ARG  36           HA       ARG  36  10.391  17.150   3.758
  278    HB2  ARG  36           HB2      ARG  36  12.019  18.706   5.320
  279    HB3  ARG  36           HB3      ARG  36  11.783  19.755   3.921
  280    HG2  ARG  36           HG2      ARG  36   9.386  19.652   4.153
  281    HG3  ARG  36           HG3      ARG  36   9.506  18.394   5.385
  282    HD2  ARG  36           HD2      ARG  36   9.129  20.454   6.575
  283    HD3  ARG  36           HD3      ARG  36  10.857  20.096   6.768
  284    HE   ARG  36           HE       ARG  36  11.352  21.759   5.051
  285   HH11  ARG  36          HH11      ARG  36   9.705  23.411   6.869
  286   HH12  ARG  36          HH12      ARG  36   8.515  24.088   5.808
  287   HH21  ARG  36          HH21      ARG  36   9.099  21.786   3.265
  288   HH22  ARG  36          HH22      ARG  36   8.170  23.163   3.757
  Start of MODEL   36
    1    HA   SER   1           HA       SER   1 -30.141 -13.975   3.151
    2    HB2  SER   1           HB2      SER   1 -27.646 -14.633   4.755
    3    HB3  SER   1           HB3      SER   1 -28.408 -13.047   4.655
    4    HG   SER   1           HG       SER   1 -29.176 -14.056   6.484
    5    H    ASP   2           H        ASP   2 -29.514 -12.853   1.347
    6    HA   ASP   2           HA       ASP   2 -26.778 -13.358   0.226
    7    HB2  ASP   2           HB2      ASP   2 -28.760 -14.497  -0.928
    8    HB3  ASP   2           HB3      ASP   2 -29.311 -12.880  -1.366
    9    H    LEU   3           H        LEU   3 -25.998 -11.531  -1.119
   10    HA   LEU   3           HA       LEU   3 -25.544  -9.241  -1.449
   11    HB2  LEU   3           HB2      LEU   3 -28.118  -9.749  -2.125
   12    HB3  LEU   3           HB3      LEU   3 -28.372  -8.542  -0.867
   13    HG   LEU   3           HG       LEU   3 -26.315  -8.046  -3.000
   14   HD11  LEU   3          HD11      LEU   3 -28.432  -8.699  -4.151
   15   HD12  LEU   3          HD12      LEU   3 -28.012  -7.007  -4.414
   16   HD13  LEU   3          HD13      LEU   3 -29.274  -7.433  -3.259
   17   HD21  LEU   3          HD21      LEU   3 -26.190  -6.289  -1.527
   18   HD22  LEU   3          HD22      LEU   3 -27.843  -6.516  -0.955
   19   HD23  LEU   3          HD23      LEU   3 -27.544  -5.690  -2.484
   20    HA   PRO   4           HA       PRO   4 -25.686  -8.309   3.037
   21    HB2  PRO   4           HB2      PRO   4 -23.036  -8.775   3.561
   22    HB3  PRO   4           HB3      PRO   4 -24.267 -10.050   3.586
   23    HG2  PRO   4           HG2      PRO   4 -22.124  -9.596   1.671
   24    HG3  PRO   4           HG3      PRO   4 -23.125 -11.031   1.917
   25    HD2  PRO   4           HD2      PRO   4 -23.379  -8.963  -0.094
   26    HD3  PRO   4           HD3      PRO   4 -24.266 -10.499   0.037
   27    H    ALA   5           H        ALA   5 -23.478  -6.950   4.107
   28    HA   ALA   5           HA       ALA   5 -22.424  -4.922   2.304
   29    HB1  ALA   5           HB1      ALA   5 -24.872  -4.351   2.545
   30    HB2  ALA   5           HB2      ALA   5 -23.789  -3.077   3.109
   31    HB3  ALA   5           HB3      ALA   5 -24.594  -4.129   4.273
   32    H    LEU   6           H        LEU   6 -20.499  -5.651   3.449
   33    HA   LEU   6           HA       LEU   6 -20.343  -5.038   6.360
   34    HB2  LEU   6           HB2      LEU   6 -19.439  -7.099   4.769
   35    HB3  LEU   6           HB3      LEU   6 -17.989  -6.109   4.944
   36    HG   LEU   6           HG       LEU   6 -18.875  -6.080   7.503
   37   HD11  LEU   6          HD11      LEU   6 -20.775  -7.592   6.894
   38   HD12  LEU   6          HD12      LEU   6 -19.704  -8.288   8.110
   39   HD13  LEU   6          HD13      LEU   6 -19.601  -8.823   6.432
   40   HD21  LEU   6          HD21      LEU   6 -16.614  -6.674   6.861
   41   HD22  LEU   6          HD22      LEU   6 -17.169  -8.178   6.128
   42   HD23  LEU   6          HD23      LEU   6 -17.246  -7.969   7.878
   43    H    SER   7           H        SER   7 -20.351  -2.904   4.158
   44    HA   SER   7           HA       SER   7 -19.172  -0.932   3.605
   45    HB2  SER   7           HB2      SER   7 -18.220  -1.532   6.423
   46    HB3  SER   7           HB3      SER   7 -18.043   0.027   5.625
   47    HG   SER   7           HG       SER   7 -20.225  -1.105   6.803
   48    H    THR   8           H        THR   8 -17.915  -2.834   2.233
   49    HA   THR   8           HA       THR   8 -15.003  -2.691   2.943
   50    HB   THR   8           HB       THR   8 -14.936  -4.693   1.357
   51    HG1  THR   8           HG1      THR   8 -16.704  -5.166   0.359
   52   HG21  THR   8          HG21      THR   8 -15.001  -4.907   3.834
   53   HG22  THR   8          HG22      THR   8 -15.834  -6.236   3.026
   54   HG23  THR   8          HG23      THR   8 -16.764  -4.931   3.763
   55    H    GLY   9           H        GLY   9 -16.567  -0.564   1.494
   56    HA2  GLY   9           HA2      GLY   9 -15.396  -0.749  -1.239
   57    HA3  GLY   9           HA3      GLY   9 -16.656   0.385  -0.746
   58    H    LEU  10           H        LEU  10 -16.049   2.226   0.548
   59    HA   LEU  10           HA       LEU  10 -13.616   3.518  -0.163
   60    HB2  LEU  10           HB2      LEU  10 -15.892   3.896   1.679
   61    HB3  LEU  10           HB3      LEU  10 -14.409   4.684   2.213
   62    HG   LEU  10           HG       LEU  10 -14.288   5.481  -0.305
   63   HD11  LEU  10          HD11      LEU  10 -16.208   4.181  -1.085
   64   HD12  LEU  10          HD12      LEU  10 -16.578   5.902  -1.196
   65   HD13  LEU  10          HD13      LEU  10 -17.243   4.941   0.124
   66   HD21  LEU  10          HD21      LEU  10 -14.443   7.064   1.494
   67   HD22  LEU  10          HD22      LEU  10 -16.105   6.594   1.849
   68   HD23  LEU  10          HD23      LEU  10 -15.735   7.471   0.364
   69    H    LEU  11           H        LEU  11 -14.452   1.554   2.686
   70    HA   LEU  11           HA       LEU  11 -12.158   2.008   4.294
   71    HB2  LEU  11           HB2      LEU  11 -14.390   0.182   4.078
   72    HB3  LEU  11           HB3      LEU  11 -12.936  -0.726   4.484
   73    HG   LEU  11           HG       LEU  11 -14.093   0.048   6.522
   74   HD11  LEU  11          HD11      LEU  11 -11.629   1.758   6.283
   75   HD12  LEU  11          HD12      LEU  11 -11.494   0.001   6.209
   76   HD13  LEU  11          HD13      LEU  11 -12.172   0.774   7.642
   77   HD21  LEU  11          HD21      LEU  11 -13.388   2.890   5.906
   78   HD22  LEU  11          HD22      LEU  11 -14.686   2.249   6.914
   79   HD23  LEU  11          HD23      LEU  11 -14.840   2.221   5.158
   80    H    HIS  12           H        HIS  12 -12.689  -0.398   1.697
   81    HA   HIS  12           HA       HIS  12 -10.092  -1.643   1.882
   82    HB2  HIS  12           HB2      HIS  12 -12.341  -1.480  -0.112
   83    HB3  HIS  12           HB3      HIS  12 -10.824  -2.243  -0.585
   84    HD1  HIS  12           HD1      HIS  12 -11.565  -4.673  -0.560
   85    HD2  HIS  12           HD2      HIS  12 -12.446  -2.700   3.006
   86    HE1  HIS  12           HE1      HIS  12 -12.344  -6.449   1.070
   87    H    LEU  13           H        LEU  13 -11.390   0.954  -0.220
   88    HA   LEU  13           HA       LEU  13  -9.148   1.374  -1.890
   89    HB2  LEU  13           HB2      LEU  13 -11.470   2.389  -1.993
   90    HB3  LEU  13           HB3      LEU  13 -10.973   3.493  -0.712
   91    HG   LEU  13           HG       LEU  13  -8.986   3.435  -2.825
   92   HD11  LEU  13          HD11      LEU  13 -11.000   2.840  -4.199
   93   HD12  LEU  13          HD12      LEU  13 -10.305   4.405  -4.622
   94   HD13  LEU  13          HD13      LEU  13 -11.768   4.327  -3.641
   95   HD21  LEU  13          HD21      LEU  13 -10.819   5.702  -2.014
   96   HD22  LEU  13          HD22      LEU  13  -9.169   5.806  -2.626
   97   HD23  LEU  13          HD23      LEU  13  -9.471   5.180  -1.004
   98    H    HIS  14           H        HIS  14  -9.839   2.805   1.326
   99    HA   HIS  14           HA       HIS  14  -7.540   4.493   1.501
  100    HB2  HIS  14           HB2      HIS  14  -9.151   4.894   3.128
  101    HB3  HIS  14           HB3      HIS  14  -9.498   3.183   3.354
  102    HD1  HIS  14           HD1      HIS  14  -8.449   2.093   5.347
  103    HD2  HIS  14           HD2      HIS  14  -6.514   5.647   4.346
  104    HE1  HIS  14           HE1      HIS  14  -6.729   2.509   7.159
  105    H    GLN  15           H        GLN  15  -8.031   1.147   2.710
  106    HA   GLN  15           HA       GLN  15  -5.349   0.764   3.670
  107    HB2  GLN  15           HB2      GLN  15  -7.715  -0.925   2.925
  108    HB3  GLN  15           HB3      GLN  15  -6.171  -1.731   3.198
  109    HG2  GLN  15           HG2      GLN  15  -7.580   0.117   5.150
  110    HG3  GLN  15           HG3      GLN  15  -7.461  -1.637   5.288
  111   HE21  GLN  15          HE21      GLN  15  -4.827  -2.221   4.795
  112   HE22  GLN  15          HE22      GLN  15  -3.800  -1.382   5.855
  113    H    ASN  16           H        ASN  16  -6.874   0.225   0.509
  114    HA   ASN  16           HA       ASN  16  -4.773  -1.240  -0.757
  115    HB2  ASN  16           HB2      ASN  16  -7.248  -0.588  -1.416
  116    HB3  ASN  16           HB3      ASN  16  -6.468   0.794  -2.184
  117   HD21  ASN  16          HD21      ASN  16  -4.423   0.063  -3.586
  118   HD22  ASN  16          HD22      ASN  16  -4.671  -1.313  -4.548
  119    H    ILE  17           H        ILE  17  -5.296   2.271  -0.379
  120    HA   ILE  17           HA       ILE  17  -2.941   2.960  -2.002
  121    HB   ILE  17           HB       ILE  17  -4.929   4.482  -0.287
  122   HG12  ILE  17          HG12      ILE  17  -5.775   3.558  -2.419
  123   HG13  ILE  17          HG13      ILE  17  -5.707   5.317  -2.478
  124   HG21  ILE  17          HG21      ILE  17  -2.467   5.429  -1.735
  125   HG22  ILE  17          HG22      ILE  17  -3.064   5.891  -0.142
  126   HG23  ILE  17          HG23      ILE  17  -3.868   6.489  -1.593
  127   HD11  ILE  17          HD11      ILE  17  -3.240   4.761  -3.419
  128   HD12  ILE  17          HD12      ILE  17  -4.648   4.897  -4.471
  129   HD13  ILE  17          HD13      ILE  17  -4.083   3.308  -3.955
  130    H    VAL  18           H        VAL  18  -3.828   3.087   1.467
  131    HA   VAL  18           HA       VAL  18  -1.358   4.169   2.425
  132    HB   VAL  18           HB       VAL  18  -3.510   2.424   3.658
  133   HG11  VAL  18          HG11      VAL  18  -1.854   2.068   5.225
  134   HG12  VAL  18          HG12      VAL  18  -2.447   3.627   5.798
  135   HG13  VAL  18          HG13      VAL  18  -0.991   3.548   4.806
  136   HG21  VAL  18          HG21      VAL  18  -4.045   4.770   2.822
  137   HG22  VAL  18          HG22      VAL  18  -2.926   5.371   4.045
  138   HG23  VAL  18          HG23      VAL  18  -4.371   4.487   4.530
  139    H    ASP  19           H        ASP  19  -2.375   0.832   1.795
  140    HA   ASP  19           HA       ASP  19  -0.102  -0.453   3.033
  141    HB2  ASP  19           HB2      ASP  19  -2.358  -1.441   2.422
  142    HB3  ASP  19           HB3      ASP  19  -1.833  -1.431   0.738
  143    H    VAL  20           H        VAL  20  -0.574   1.069  -0.107
  144    HA   VAL  20           HA       VAL  20   1.950  -0.120  -1.139
  145    HB   VAL  20           HB       VAL  20  -0.096   1.731  -2.412
  146   HG11  VAL  20          HG11      VAL  20   2.051   0.012  -3.693
  147   HG12  VAL  20          HG12      VAL  20   2.216   1.745  -3.408
  148   HG13  VAL  20          HG13      VAL  20   0.976   1.148  -4.510
  149   HG21  VAL  20          HG21      VAL  20   0.284  -1.268  -2.713
  150   HG22  VAL  20          HG22      VAL  20  -0.942  -0.286  -3.514
  151   HG23  VAL  20          HG23      VAL  20  -0.998  -0.513  -1.767
  152    H    GLN  21           H        GLN  21   0.523   2.980  -0.196
  153    HA   GLN  21           HA       GLN  21   2.678   4.694  -0.982
  154    HB2  GLN  21           HB2      GLN  21   0.196   5.056  -0.072
  155    HB3  GLN  21           HB3      GLN  21   1.036   5.220   1.470
  156    HG2  GLN  21           HG2      GLN  21   1.537   7.343   0.919
  157    HG3  GLN  21           HG3      GLN  21   2.530   6.727  -0.402
  158   HE21  GLN  21          HE21      GLN  21   1.946   7.766  -2.316
  159   HE22  GLN  21          HE22      GLN  21   0.356   8.143  -2.775
  160    H    TYR  22           H        TYR  22   2.077   2.892   2.056
  161    HA   TYR  22           HA       TYR  22   4.297   4.005   3.516
  162    HB2  TYR  22           HB2      TYR  22   3.451   2.667   5.166
  163    HB3  TYR  22           HB3      TYR  22   2.129   2.400   4.038
  164    HD1  TYR  22           HD1      TYR  22   5.435   1.030   5.132
  165    HD2  TYR  22           HD2      TYR  22   1.697   0.255   3.169
  166    HE1  TYR  22           HE1      TYR  22   5.972  -1.389   5.062
  167    HE2  TYR  22           HE2      TYR  22   2.230  -2.164   3.102
  168    HH   TYR  22           HH       TYR  22   5.270  -3.395   3.594
  169    H    MET  23           H        MET  23   4.038   1.331   1.213
  170    HA   MET  23           HA       MET  23   6.797   0.412   1.762
  171    HB2  MET  23           HB2      MET  23   4.528  -0.859   1.085
  172    HB3  MET  23           HB3      MET  23   5.155  -0.559  -0.536
  173    HG2  MET  23           HG2      MET  23   7.381  -1.438   0.914
  174    HG3  MET  23           HG3      MET  23   6.062  -2.472   1.463
  175    HE1  MET  23           HE1      MET  23   8.384  -1.331  -1.224
  176    HE2  MET  23           HE2      MET  23   6.937  -0.685  -1.993
  177    HE3  MET  23           HE3      MET  23   7.802  -2.023  -2.744
  178    H    TYR  24           H        TYR  24   5.030   2.265  -0.704
  179    HA   TYR  24           HA       TYR  24   7.507   2.446  -2.368
  180    HB2  TYR  24           HB2      TYR  24   4.554   2.889  -2.774
  181    HB3  TYR  24           HB3      TYR  24   5.714   3.567  -3.914
  182    HD1  TYR  24           HD1      TYR  24   7.214   2.089  -5.221
  183    HD2  TYR  24           HD2      TYR  24   4.177   0.504  -2.629
  184    HE1  TYR  24           HE1      TYR  24   7.434  -0.125  -6.315
  185    HE2  TYR  24           HE2      TYR  24   4.397  -1.708  -3.724
  186    HH   TYR  24           HH       TYR  24   6.608  -2.842  -5.142
  187    H    GLY  25           H        GLY  25   6.973   4.005   0.238
  188    HA2  GLY  25           HA2      GLY  25   7.872   6.597  -0.797
  189    HA3  GLY  25           HA3      GLY  25   6.298   6.647  -0.002
  190    H    LEU  26           H        LEU  26   9.306   4.847   0.769
  191    HA   LEU  26           HA       LEU  26   9.293   6.198   3.452
  192    HB2  LEU  26           HB2      LEU  26   8.619   3.584   2.906
  193    HB3  LEU  26           HB3      LEU  26  10.334   3.441   3.291
  194    HG   LEU  26           HG       LEU  26   9.658   5.051   5.302
  195   HD11  LEU  26          HD11      LEU  26   7.126   3.437   5.012
  196   HD12  LEU  26          HD12      LEU  26   7.251   5.054   4.321
  197   HD13  LEU  26          HD13      LEU  26   7.436   4.822   6.059
  198   HD21  LEU  26          HD21      LEU  26   9.208   2.960   6.656
  199   HD22  LEU  26          HD22      LEU  26  10.655   2.881   5.652
  200   HD23  LEU  26          HD23      LEU  26   9.180   2.061   5.138
  201    H    SER  27           H        SER  27  10.884   6.729   0.942
  202    HA   SER  27           HA       SER  27  13.608   5.790   1.561
  203    HB2  SER  27           HB2      SER  27  12.978   7.904  -0.469
  204    HB3  SER  27           HB3      SER  27  14.111   6.564  -0.571
  205    HG   SER  27           HG       SER  27  12.433   5.181  -0.939
  206    HA   PRO  28           HA       PRO  28  14.236  10.429   2.480
  207    HB2  PRO  28           HB2      PRO  28  12.065  12.085   2.629
  208    HB3  PRO  28           HB3      PRO  28  12.934  11.764   1.116
  209    HG2  PRO  28           HG2      PRO  28  10.343  10.697   2.069
  210    HG3  PRO  28           HG3      PRO  28  10.884  11.060   0.427
  211    HD2  PRO  28           HD2      PRO  28  10.754   8.533   1.554
  212    HD3  PRO  28           HD3      PRO  28  11.702   8.972   0.120
  213    H    ALA  29           H        ALA  29  14.124   8.678   4.372
  214    HA   ALA  29           HA       ALA  29  13.198  10.069   6.767
  215    HB1  ALA  29           HB1      ALA  29  11.069   9.179   6.233
  216    HB2  ALA  29           HB2      ALA  29  11.727   7.996   7.364
  217    HB3  ALA  29           HB3      ALA  29  11.754   7.669   5.630
  218    H    ILE  30           H        ILE  30  14.053   6.826   5.495
  219    HA   ILE  30           HA       ILE  30  15.514   6.082   7.918
  220    HB   ILE  30           HB       ILE  30  15.403   4.839   5.148
  221   HG12  ILE  30          HG12      ILE  30  13.151   5.050   6.084
  222   HG13  ILE  30          HG13      ILE  30  13.657   3.363   6.161
  223   HG21  ILE  30          HG21      ILE  30  17.257   3.962   6.468
  224   HG22  ILE  30          HG22      ILE  30  15.981   2.748   6.386
  225   HG23  ILE  30          HG23      ILE  30  16.192   3.707   7.850
  226   HD11  ILE  30          HD11      ILE  30  12.697   3.847   8.295
  227   HD12  ILE  30          HD12      ILE  30  13.568   5.376   8.420
  228   HD13  ILE  30          HD13      ILE  30  14.441   3.849   8.547
  229    H    THR  31           H        THR  31  16.353   7.191   4.650
  230    HA   THR  31           HA       THR  31  19.202   6.850   4.861
  231    HB   THR  31           HB       THR  31  19.168   8.561   2.983
  232    HG1  THR  31           HG1      THR  31  16.412   8.399   2.861
  233   HG21  THR  31          HG21      THR  31  17.556   7.056   1.551
  234   HG22  THR  31          HG22      THR  31  17.503   6.063   3.007
  235   HG23  THR  31          HG23      THR  31  19.042   6.368   2.205
  236    H    LYS  32           H        LYS  32  17.084   9.669   5.490
  237    HA   LYS  32           HA       LYS  32  19.166  11.485   6.266
  238    HB2  LYS  32           HB2      LYS  32  16.194  11.242   6.655
  239    HB3  LYS  32           HB3      LYS  32  17.075  12.511   7.506
  240    HG2  LYS  32           HG2      LYS  32  17.446  12.099   4.543
  241    HG3  LYS  32           HG3      LYS  32  16.106  13.065   5.161
  242    HD2  LYS  32           HD2      LYS  32  17.502  14.714   6.012
  243    HD3  LYS  32           HD3      LYS  32  18.865  13.611   6.198
  244    HE2  LYS  32           HE2      LYS  32  18.958  13.484   3.645
  245    HE3  LYS  32           HE3      LYS  32  17.825  14.851   3.633
  246    HZ1  LYS  32           HZ1      LYS  32  20.468  14.765   5.000
  247    HZ2  LYS  32           HZ2      LYS  32  19.356  16.046   5.118
  248    HZ3  LYS  32           HZ3      LYS  32  20.079  15.679   3.626
  249    H    TYR  33           H        TYR  33  17.469   8.944   7.990
  250    HA   TYR  33           HA       TYR  33  18.159   9.764  10.676
  251    HB2  TYR  33           HB2      TYR  33  16.626   7.800   9.404
  252    HB3  TYR  33           HB3      TYR  33  17.895   6.885  10.220
  253    HD1  TYR  33           HD1      TYR  33  18.409   7.611  12.701
  254    HD2  TYR  33           HD2      TYR  33  14.750   8.477  10.624
  255    HE1  TYR  33           HE1      TYR  33  17.257   7.947  14.871
  256    HE2  TYR  33           HE2      TYR  33  13.598   8.812  12.794
  257    HH   TYR  33           HH       TYR  33  14.335   7.749  15.450
  258    H    VAL  34           H        VAL  34  19.749   7.763   8.214
  259    HA   VAL  34           HA       VAL  34  21.952   6.985  10.013
  260    HB   VAL  34           HB       VAL  34  21.620   6.677   7.004
  261   HG11  VAL  34          HG11      VAL  34  23.430   5.485   9.085
  262   HG12  VAL  34          HG12      VAL  34  23.827   6.078   7.472
  263   HG13  VAL  34          HG13      VAL  34  22.998   4.534   7.664
  264   HG21  VAL  34          HG21      VAL  34  20.122   5.497   9.178
  265   HG22  VAL  34          HG22      VAL  34  21.053   4.248   8.351
  266   HG23  VAL  34          HG23      VAL  34  19.925   5.253   7.442
  267    H    VAL  35           H        VAL  35  24.241   7.518   9.331
  268    HA   VAL  35           HA       VAL  35  25.932   9.090   8.854
  269    HB   VAL  35           HB       VAL  35  23.943  10.107   6.798
  270   HG11  VAL  35          HG11      VAL  35  26.972   9.994   6.914
  271   HG12  VAL  35          HG12      VAL  35  25.970  11.443   6.989
  272   HG13  VAL  35          HG13      VAL  35  26.047  10.502   5.501
  273   HG21  VAL  35          HG21      VAL  35  25.283   8.359   5.347
  274   HG22  VAL  35          HG22      VAL  35  23.916   7.816   6.319
  275   HG23  VAL  35          HG23      VAL  35  25.564   7.575   6.901
  276    H    ARG  36           H        ARG  36  24.980   9.900  11.076
  277    HA   ARG  36           HA       ARG  36  24.290  12.797  10.755
  278    HB2  ARG  36           HB2      ARG  36  22.783  10.594  11.949
  279    HB3  ARG  36           HB3      ARG  36  23.039  11.912  13.093
  280    HG2  ARG  36           HG2      ARG  36  22.173  12.575  10.301
  281    HG3  ARG  36           HG3      ARG  36  20.974  11.966  11.441
  282    HD2  ARG  36           HD2      ARG  36  22.308  13.847  12.967
  283    HD3  ARG  36           HD3      ARG  36  22.289  14.597  11.358
  284    HE   ARG  36           HE       ARG  36  19.840  14.340  11.335
  285   HH11  ARG  36          HH11      ARG  36  20.158  15.995  13.731
  286   HH12  ARG  36          HH12      ARG  36  19.319  15.100  14.953
  287   HH21  ARG  36          HH21      ARG  36  19.322  12.130  13.144
  288   HH22  ARG  36          HH22      ARG  36  18.844  12.900  14.620