*HEADER    MEMBRANE PROTEIN                        02-MAY-11   2LCO              
*TITLE     1H AND 15N ASSIGNMENTS OF WALP19-P8 PEPTIDE IN SDS MICELLES           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: WALP19-P8 PEPTIDE;                                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE AUTHOR STATES THAT THE SEQUENCE IS SYNTHETIC,     
*SOURCE   4 THERE IS NO NATURAL SOURCE.                                          
*KEYWDS    PROLINE DISTORTION, TRANSMEMBRANE, MEMBRANE PROTEIN                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    V.V.VOSTRIKOV, J.M.COURTNEY, J.F.HINTON, R.E.KOEPPE II                
*REVDAT   2   15-NOV-23 2LCO    1                                                
*REVDAT   1   11-APR-12 2LCO    0                                                


! st 2.2 0.4 0.6 | st mt 2.2 0.4 1.1
! md 2.6 0.8 0.9 | md mt 2.6 0.8 1.4
! wk 3.4 1.6 2.1 | wk mt 3.4 1.6 2.6
! vw 3.4 1.6 2.6 | vw mt 3.4 1.6 3.1
assign (residue 1 and name HA1) (residue 1 and name HA2) 2.2 0.4 0.6
assign (residue 1 and name HA1) (residue 1 and name HT#) 2.2 0.4 0.6
assign (residue 1 and name HA2) (residue 1 and name HT#) 2.2 0.4 0.6
assign (residue 1 and name HA1) (residue 2 and name HN) 2.2 0.4 0.6
assign (residue 1 and name HA2) (residue 2 and name HN) 2.2 0.4 0.6
assign (residue 1 and name HT#) (residue 2 and name HN) 2.6 0.8 0.9
assign (residue 2 and name HA) (residue 2 and name HN) 2.2 0.4 0.6
assign (residue 2 and name HB#) (residue 2 and name HD1) 2.2 0.4 0.6
assign (residue 2 and name HB#) (residue 2 and name HN) 2.2 0.4 0.6
assign (residue 2 and name HD1) (residue 2 and name HE1) 2.2 0.4 0.6
assign (residue 2 and name HD1) (residue 2 and name HN) 2.2 0.4 0.6
assign (residue 2 and name HZ2) (residue 2 and name HE1) 2.2 0.4 0.6
assign (residue 3 and name HA) (residue 3 and name HN) 2.2 0.4 0.6
assign (residue 3 and name HB1) (residue 3 and name HA) 2.2 0.4 0.6
assign (residue 3 and name HB2) (residue 3 and name HA) 2.2 0.4 0.6
assign (residue 3 and name HB1) (residue 3 and name HB2) 2.2 0.4 0.6
assign (residue 3 and name HB#) (residue 3 and name HD1) 2.2 0.4 0.6
assign (residue 3 and name HB#) (residue 3 and name HN) 2.2 0.4 0.6
assign (residue 3 and name HB#) (residue 3 and name HN) 2.2 0.4 0.6
assign (residue 3 and name HD1) (residue 3 and name HE1) 2.2 0.4 0.6
assign (residue 3 and name HN) (residue 4 and name HN) 2.2 0.4 0.6
assign (residue 3 and name HZ2) (residue 3 and name HE1) 2.2 0.4 0.6
assign (residue 3 and name HZ3) (residue 3 and name HE3) 2.2 0.4 0.6
assign (residue 4 and name HA) (residue 4 and name HN) 2.2 0.4 0.6
assign (residue 4 and name HG) (residue 1 and name HT#) 2.6 0.8 0.9
assign (residue 4 and name HG) (residue 4 and name HN) 2.2 0.4 0.6
assign (residue 4 and name HN) (residue 5 and name HN) 2.2 0.4 0.6
assign (residue 5 and name HA) (residue 5 and name HN) 2.2 0.4 0.6
assign (residue 6 and name HA) (residue 6 and name HN) 2.2 0.4 0.6
assign (residue 6 and name HB1) (residue 6 and name HN) 2.6 0.8 0.9
assign (residue 6 and name HB2) (residue 6 and name HN) 2.2 0.4 0.6
assign (residue 6 and name HG) (residue 6 and name HN) 2.2 0.4 0.6
assign (residue 6 and name HN) (residue 7 and name HN) 2.2 0.4 0.6
assign (residue 7 and name HA) (residue 7 and name HN) 2.2 0.4 0.6
assign (residue 8 and name HB1) (residue 8 and name HB2) 2.2 0.4 0.6
assign (residue 9 and name HA) (residue 9 and name HN) 2.2 0.4 0.6
assign (residue 9 and name HN) (residue 10 and name HN) 2.2 0.4 0.6
assign (residue 10 and name HA) (residue 10 and name HN) 2.2 0.4 0.6
assign (residue 10 and name HA) (residue 11 and name HN) 2.2 0.4 0.6
assign (residue 10 and name HB#) (residue 10 and name HN) 2.2 0.4 0.6
assign (residue 10 and name HG) (residue 10 and name HB#) 2.2 0.4 0.6
assign (residue 11 and name HA) (residue 11 and name HN) 2.2 0.4 0.6
assign (residue 12 and name HA) (residue 12 and name HN) 2.2 0.4 0.6
assign (residue 12 and name HB#) (residue 12 and name HN) 2.2 0.4 0.6
assign (residue 12 and name HN) (residue 11 and name HN) 2.2 0.4 0.6
assign (residue 12 and name HN) (residue 13 and name HN) 2.2 0.4 0.6
assign (residue 13 and name HA) (residue 13 and name HN) 2.2 0.4 0.6
assign (residue 13 and name HN) (residue 14 and name HN) 2.2 0.4 0.6
assign (residue 14 and name HA) (residue 14 and name HN) 2.2 0.4 0.6
assign (residue 14 and name HB1) (residue 14 and name HN) 2.2 0.4 0.6
assign (residue 14 and name HB2) (residue 14 and name HN) 2.2 0.4 0.6
assign (residue 15 and name HA) (residue 15 and name HN) 2.2 0.4 0.6
assign (residue 16 and name HA) (residue 16 and name HN) 2.2 0.4 0.6
assign (residue 16 and name HB1) (residue 16 and name HN) 2.2 0.4 0.6
assign (residue 16 and name HB2) (residue 16 and name HN) 2.2 0.4 0.6
assign (residue 17 and name HA) (residue 17 and name HN) 2.2 0.4 0.6
assign (residue 17 and name HB1) (residue 17 and name HN) 2.2 0.4 0.6
assign (residue 17 and name HB2) (residue 17 and name HN) 2.6 0.8 0.9
assign (residue 17 and name HD1) (residue 17 and name HE1) 2.2 0.4 0.6
assign (residue 17 and name HN) (residue 18 and name HN) 2.2 0.4 0.6
assign (residue 17 and name HZ2) (residue 17 and name HE1) 2.2 0.4 0.6
assign (residue 18 and name HA) (residue 18 and name HN) 2.2 0.4 0.6
assign (residue 18 and name HB1) (residue 18 and name HN) 2.6 0.8 0.9
assign (residue 18 and name HB2) (residue 18 and name HN) 2.6 0.8 0.9
assign (residue 18 and name HB1) (residue 19 and name HN) 2.2 0.4 0.6
assign (residue 18 and name HB2) (residue 19 and name HN) 2.6 0.8 0.9
assign (residue 18 and name HD1) (residue 18 and name HE1) 2.2 0.4 0.6
assign (residue 18 and name HZ2) (residue 18 and name HE1) 2.2 0.4 0.6
assign (residue 19 and name HA) (residue 19 and name HN) 2.2 0.4 0.6
assign (residue 19 and name HN) (residue 18 and name HN) 2.2 0.4 0.6
assign (residue 2 and name HA) (residue 2 and name HD1) 2.6 0.8 0.9
assign (residue 2 and name HA) (residue 3 and name HN) 2.6 0.8 0.9
assign (residue 2 and name HB#) (residue 2 and name HA) 2.6 0.8 0.9
assign (residue 3 and name HA) (residue 2 and name HD1) 2.6 0.8 0.9
assign (residue 3 and name HA) (residue 4 and name HN) 2.6 0.8 0.9
assign (residue 3 and name HB#) (residue 3 and name HD1) 2.6 0.8 0.9
assign (residue 3 and name HN) (residue 2 and name HN) 2.6 0.8 0.9
assign (residue 3 and name HZ3) (residue 2 and name HD1) 2.6 0.8 0.9
assign (residue 3 and name HZ3) (residue 3 and name HZ2) 3.4 1.6 2.1
assign (residue 4 and name HA) (residue 5 and name HN) 2.6 0.8 0.9
assign (residue 4 and name HA) (residue 7 and name HN) 2.6 0.8 0.9
assign (residue 4 and name HB1) (residue 4 and name HB2) 2.6 0.8 0.9
assign (residue 4 and name HG) (residue 4 and name HB1) 2.6 0.8 0.9
assign (residue 4 and name HG) (residue 4 and name HB2) 2.6 0.8 0.9
assign (residue 4 and name HG) (residue 4 and name HA) 2.6 0.8 0.9
assign (residue 5 and name HA) (residue 6 and name HN) 2.6 0.8 0.9
assign (residue 6 and name HB1) (residue 6 and name HB2) 2.6 0.8 0.9
assign (residue 6 and name HN) (residue 5 and name HN) 2.6 0.8 0.9
assign (residue 7 and name HA) (residue 10 and name HN) 3.4 1.6 2.1
assign (residue 8 and name HA) (residue 7 and name HN) 3.4 1.6 2.1
assign (residue 8 and name HB1) (residue 8 and name HA) 2.6 0.8 0.9
assign (residue 8 and name HB1) (residue 9 and name HN) 2.6 0.8 0.9
assign (residue 8 and name HB2) (residue 8 and name HA) 2.6 0.8 0.9
assign (residue 8 and name HB2) (residue 9 and name HN) 2.6 0.8 0.9
assign (residue 10 and name HB#) (residue 10 and name HA) 2.6 0.8 0.9
assign (residue 10 and name HB#) (residue 11 and name HN) 2.6 0.8 0.9
assign (residue 10 and name HG) (residue 10 and name HA) 2.6 0.8 0.9
assign (residue 10 and name HG) (residue 10 and name HN) 2.6 0.8 0.9
assign (residue 10 and name HG) (residue 11 and name HN) 2.6 0.8 0.9
assign (residue 10 and name HG) (residue 14 and name HN) 2.6 0.8 0.9
assign (residue 11 and name HA) (residue 14 and name HN) 2.6 0.8 0.9
assign (residue 12 and name HA) (residue 15 and name HN) 2.6 0.8 0.9
assign (residue 12 and name HB#) (residue 12 and name HA) 2.6 0.8 0.9
assign (residue 12 and name HB#) (residue 13 and name HN) 2.6 0.8 0.9
assign (residue 13 and name HA) (residue 14 and name HN) 2.6 0.8 0.9
assign (residue 13 and name HA) (residue 16 and name HN) 2.6 0.8 0.9
assign (residue 14 and name HA) (residue 17 and name HN) 2.6 0.8 0.9
assign (residue 14 and name HN) (residue 15 and name HN) 2.6 0.8 0.9
assign (residue 15 and name HA) (residue 16 and name HN) 2.6 0.8 0.9
assign (residue 15 and name HA) (residue 18 and name HN) 3.4 1.6 2.1
assign (residue 15 and name HA) (residue 19 and name HN) 3.4 1.6 2.1
assign (residue 15 and name HN) (residue 16 and name HN) 2.6 0.8 0.9
assign (residue 16 and name HA) (residue 17 and name HN) 2.6 0.8 0.9
assign (residue 16 and name HA) (residue 19 and name HN) 3.4 1.6 2.1
assign (residue 16 and name HN) (residue 17 and name HN) 2.6 0.8 0.9
assign (residue 17 and name HA) (residue 17 and name HD1) 3.4 1.6 2.1
assign (residue 17 and name HB1) (residue 17 and name HB2) 2.6 0.8 0.9
assign (residue 17 and name HB1) (residue 17 and name HD1) 2.6 0.8 0.9
assign (residue 17 and name HB2) (residue 17 and name HD1) 3.4 1.6 2.1
assign (residue 17 and name HE3) (residue 18 and name HN) 3.4 1.6 2.1
assign (residue 18 and name HA) (residue 18 and name HD1) 2.6 0.8 0.9
assign (residue 18 and name HB1) (residue 18 and name HA) 2.6 0.8 0.9
assign (residue 18 and name HB2) (residue 18 and name HA) 2.6 0.8 0.9
assign (residue 2 and name HA) (residue 3 and name HE3) 3.4 1.6 2.1
assign (residue 2 and name HA) (residue 4 and name HN) 3.4 1.6 2.1
assign (residue 2 and name HA) (residue 5 and name HN) 3.4 1.6 2.1
assign (residue 2 and name HB#) (residue 2 and name HE1) 3.4 1.6 2.1
assign (residue 2 and name HB#) (residue 3 and name HN) 3.4 1.6 2.1
assign (residue 3 and name HA) (residue 3 and name HD1) 3.4 1.6 2.1
assign (residue 3 and name HA) (residue 3 and name HZ3) 3.4 1.6 2.1
assign (residue 3 and name HA) (residue 5 and name HN) 3.4 1.6 2.1
assign (residue 3 and name HA) (residue 6 and name HN) 3.4 1.6 2.1
assign (residue 3 and name HB#) (residue 3 and name HE3) 3.4 1.6 2.1
assign (residue 3 and name HB1) (residue 4 and name HN) 3.4 1.6 2.1
assign (residue 3 and name HB2) (residue 4 and name HN) 3.4 1.6 2.1
assign (residue 3 and name HD1) (residue 2 and name HE1) 3.4 1.6 2.1
assign (residue 3 and name HE3) (residue 2 and name HE1) 3.4 1.6 2.1
assign (residue 3 and name HE3) (residue 3 and name HE1) 3.4 1.6 2.1
assign (residue 3 and name HN) (residue 3 and name HE1) 3.4 1.6 2.1
assign (residue 3 and name HN) (residue 5 and name HN) 3.4 1.6 2.1
assign (residue 4 and name HA) (residue 6 and name HN) 3.4 1.6 2.1
assign (residue 4 and name HB1) (residue 5 and name HN) 3.4 1.6 2.1
assign (residue 4 and name HB2) (residue 5 and name HN) 3.4 1.6 2.1
assign (residue 4 and name HN) (residue 2 and name HN) 3.4 1.6 2.1
assign (residue 6 and name HA) (residue 9 and name HN) 3.4 1.6 2.1
assign (residue 6 and name HG) (residue 6 and name HA) 3.4 1.6 2.1
assign (residue 6 and name HG) (residue 6 and name HB2) 3.4 1.6 2.1
assign (residue 6 and name HG) (residue 7 and name HN) 3.4 1.6 2.1
!assign (residue 8 and name HB2) (residue 10 and name HA) 3.4 1.6 2.1
assign (residue 9 and name HN) (residue 11 and name HN) 3.4 1.6 2.1
assign (residue 11 and name HA) (residue 15 and name HN) 3.4 1.6 2.1
assign (residue 12 and name HN) (residue 14 and name HN) 3.4 1.6 2.1
assign (residue 13 and name HA) (residue 17 and name HN) 3.4 1.6 2.1
assign (residue 13 and name HN) (residue 15 and name HN) 3.4 1.6 2.1
assign (residue 14 and name HA) (residue 17 and name HE3) 3.4 1.6 2.1
assign (residue 17 and name HA) (residue 17 and name HE3) 3.4 1.6 2.1
assign (residue 17 and name HA) (residue 18 and name HN) 3.4 1.6 2.1
assign (residue 17 and name HB1) (residue 17 and name HA) 3.4 1.6 2.1
assign (residue 17 and name HB2) (residue 17 and name HA) 3.4 1.6 2.1
assign (residue 14 and name HA) (residue 17 and name HB1) 3.4 1.6 2.1
assign (residue 14 and name HA) (residue 17 and name HB2) 3.4 1.6 2.1
assign (residue 17 and name HE3) (residue 17 and name HN) 3.4 1.6 2.1
assign (residue 17 and name HE3) (residue 14 and name HD1#) 3.4 1.6 2.6
assign (residue 17 and name HE3) (residue 14 and name HD2#) 3.4 1.6 2.6
assign (residue 17 and name HZ2) (residue 18 and name HN) 3.4 1.6 2.1
assign (residue 18 and name HA) (residue 17 and name HE3) 3.4 1.6 2.1
assign (residue 18 and name HB#) (residue 17 and name HE3) 3.4 1.6 2.1
assign (residue 18 and name HB1) (residue 18 and name HD1) 3.4 1.6 2.1
assign (residue 18 and name HB2) (residue 18 and name HD1) 3.4 1.6 2.1
assign (residue 18 and name HB#) (residue 18 and name HE3) 2.6 0.8 0.9
assign (residue 19 and name HA) (residue 18 and name HE3) 2.6 0.8 0.9
assign (residue 15 and name HA) (residue 18 and name HE3) 3.4 1.6 2.1
!assign (residue 15 and name HB#) (residue 18 and name HE3) 3.4 1.6 3.1
assign (residue 18 and name HD1) (residue 19 and name HN) 3.4 1.6 2.1
assign (residue 1 and name HA1) (residue 2 and name HD1) 3.4 1.6 2.6
assign (residue 1 and name HA2) (residue 2 and name HD1) 3.4 1.6 2.6
assign (residue 1 and name HA1) (residue 4 and name HN) 3.4 1.6 2.6
assign (residue 1 and name HA2) (residue 4 and name HN) 3.4 1.6 2.6
assign (residue 3 and name HB#) (residue 2 and name HD1) 3.4 1.6 2.6
assign (residue 3 and name HB#) (residue 3 and name HZ3) 3.4 1.6 2.6
assign (residue 3 and name HN) (residue 2 and name HE1) 3.4 1.6 2.6
assign (residue 3 and name HZ3) (residue 2 and name HE1) 3.4 1.6 2.6
assign (residue 4 and name HA) (residue 3 and name HD1) 3.4 1.6 2.6
!assign (residue 4 and name HA) (residue 3 and name HZ3) 3.4 1.6 2.6
assign (residue 4 and name HG) (residue 3 and name HD1) 3.4 1.6 2.6
!assign (residue 4 and name HG) (residue 3 and name HE3) 3.4 1.6 2.6
!assign (residue 8 and name HB2) (residue 7 and name HN) 3.4 1.6 2.6
!assign (residue 13 and name HB#) (residue 10 and name HA) 3.4 1.6 2.6
!assign (residue 17 and name HZ2) (residue 17 and name HN) 3.4 1.6 2.6
assign (residue 17 and name HD1) (residue 17 and name HN) 3.4 1.6 2.6
assign (residue 18 and name HD1) (residue 18 and name HN) 3.4 1.6 2.6
assign (residue 5 and name HB#) (residue 5 and name HA) 2.2 0.4 1.1
assign (residue 5 and name HB#) (residue 5 and name HN) 2.2 0.4 1.1
assign (residue 7 and name HB#) (residue 7 and name HN) 2.2 0.4 1.1
assign (residue 9 and name HB#) (residue 9 and name HA) 2.2 0.4 1.1
assign (residue 9 and name HB#) (residue 9 and name HN) 2.2 0.4 1.1
assign (residue 9 and name HB#) (residue 10 and name HN) 2.6 0.8 1.4
assign (residue 11 and name HB#) (residue 11 and name HN) 2.2 0.4 1.1
assign (residue 13 and name HB#) (residue 13 and name HA) 2.2 0.4 1.1
assign (residue 13 and name HB#) (residue 13 and name HN) 2.2 0.4 1.1
assign (residue 15 and name HB#) (residue 15 and name HN) 2.2 0.4 1.1
!assign (residue 19 and name HB#) (residue 17 and name HZ2) 2.6 0.8 1.4
assign (residue 19 and name HB#) (residue 19 and name HA) 2.2 0.4 1.1
assign (residue 19 and name HB#) (residue 19 and name HN) 2.2 0.4 1.1
assign (residue 4 and name HG) (residue 4 and name HA) 2.6 0.8 1.4
assign (residue 5 and name HB#) (residue 2 and name HD1) 3.4 1.6 2.6
assign (residue 11 and name HB#) (residue 11 and name HA) 2.6 0.8 1.4
assign (residue 11 and name HB#) (residue 12 and name HN) 2.6 0.8 1.4
assign (residue 13 and name HB#) (residue 14 and name HN) 2.6 0.8 1.4
assign (residue 13 and name HB#) (residue 17 and name HN) 2.6 0.8 1.4
assign (residue 15 and name HB#) (residue 15 and name HA) 2.6 0.8 1.4
assign (residue 15 and name HB#) (residue 16 and name HN) 2.6 0.8 1.4
assign (residue 4 and name HD1#) (residue 4 and name HG) 3.4 1.6 2.6
assign (residue 4 and name HD2#) (residue 4 and name HG) 3.4 1.6 2.6
assign (residue 4 and name HD1#) (residue 4 and name HN) 3.4 1.6 2.6
assign (residue 4 and name HD2#) (residue 4 and name HN) 3.4 1.6 2.6
assign (residue 5 and name HB#) (residue 4 and name HN) 3.4 1.6 2.6
assign (residue 6 and name HD1#) (residue 3 and name HZ3) 3.4 1.6 2.6
assign (residue 6 and name HD2#) (residue 3 and name HZ3) 3.4 1.6 2.6
assign (residue 6 and name HD2#) (residue 6 and name HG) 3.4 1.6 2.6
assign (residue 6 and name HD1#) (residue 6 and name HG) 3.4 1.6 2.6
assign (residue 6 and name HD1#) (residue 6 and name HN) 3.4 1.6 2.6
assign (residue 6 and name HD2#) (residue 6 and name HN) 3.4 1.6 2.6
assign (residue 7 and name HB#) (residue 4 and name HA) 3.4 1.6 2.6
assign (residue 10 and name HD1#) (residue 10 and name HA) 3.4 1.6 2.6
assign (residue 10 and name HD2#) (residue 10 and name HA) 3.4 1.6 2.6
assign (residue 10 and name HD1#) (residue 10 and name HB#) 3.4 1.6 2.6
assign (residue 10 and name HD2#) (residue 10 and name HB#) 3.4 1.6 2.6
assign (residue 10 and name HD1#) (residue 10 and name HG) 3.4 1.6 2.6
assign (residue 10 and name HD2#) (residue 10 and name HG) 3.4 1.6 2.6
assign (residue 10 and name HD1#) (residue 10 and name HN) 3.4 1.6 2.6
assign (residue 10 and name HD2#) (residue 10 and name HN) 3.4 1.6 2.6
assign (residue 12 and name HD#) (residue 12 and name HA) 3.4 1.6 2.6
assign (residue 12 and name HD#) (residue 12 and name HB#) 3.4 1.6 2.6
assign (residue 12 and name HD#) (residue 12 and name HN) 3.4 1.6 2.6
assign (residue 12 and name HD#) (residue 13 and name HN) 3.4 1.6 2.6
assign (residue 14 and name HD1#) (residue 14 and name HN) 3.4 1.6 2.6
assign (residue 14 and name HD2#) (residue 14 and name HN) 3.4 1.6 2.6
assign (residue 15 and name HB#) (residue 12 and name HA) 3.4 1.6 2.6
!assign (residue 15 and name HB#) (residue 17 and name HZ2) 3.4 1.6 2.6
assign (residue 15 and name HB#) (residue 18 and name HN) 3.4 1.6 2.6
assign (residue 16 and name HD#) (residue 16 and name HA) 3.4 1.6 2.6
assign (residue 16 and name HD#) (residue 16 and name HN) 3.4 1.6 2.6
!assign (residue 16 and name HD#) (residue 17 and name HN) 3.4 1.6 2.6
assign (residue 19 and name HB#) (residue 18 and name HN) 3.4 1.6 2.6
assign (residue 5 and name HB#) (residue 6 and name HN) 2.6 0.8 1.4
!assign (residue 9 and name HB#) (residue 6 and name HA) 3.4 1.6 3.1
assign (residue 5 and name HB#) (residue 3 and name HZ3) 3.4 1.6 3.1
assign (residue 6 and name HD1#) (residue 2 and name HD1) 3.4 1.6 3.1
assign (residue 6 and name HD2#) (residue 2 and name HD1) 3.4 1.6 3.1
!assign (residue 16 and name HD#) (residue 17 and name HZ2) 3.4 1.6 3.1
assign (residue 16 and name HD#) (residue 18 and name HN) 3.4 1.6 3.1
assign (residue 7 and name HN) (residue 9 and name HN) 3.4 1.6 2.1
assign (residue 8 and name HD#) (residue 9 and name HN) 3.4 1.6 2.1
! st 2.2 0.4 0.6 | st mt 2.2 0.4 1.1
! md 2.6 0.8 0.9 | md mt 2.6 0.8 1.4
! wk 3.4 1.6 2.1 | wk mt 3.4 1.6 2.6
! vw 3.4 1.6 2.6 | vw mt 3.4 1.6 3.1
!
! Modifications
!
assign (residue 1 and name HT#) ((residue 4 and name HB1) OR (residue 4 and name HB2)) 3.4 1.6 2.6
assign (residue 4 and name HD#) ((residue 4 and name HB1) OR (residue 4 and name HB2)) 3.4 1.6 2.6
assign (residue 4 and name HD#) ((residue 4 and name HB1) OR (residue 4 and name HB2)) 2.6 0.8 1.4
assign (residue 4 and name HN) ((residue 4 and name HB1) OR (residue 4 and name HB2)) 2.6 0.8 0.9
assign (residue 4 and name HN) ((residue 4 and name HB1) OR (residue 4 and name HB2)) 2.2 0.4 0.6
assign (residue 4 and name HA) ((residue 4 and name HB1) OR (residue 4 and name HB2)) 2.6 0.8 0.9
assign (residue 6 and name HB2) ((residue 6 and name HD1#) OR (residue 6 and name HD2#)) 3.4 1.6 3.1
assign (residue 6 and name HB1) (residue 6 and name HD1#) 2.6 0.8 1.4
assign (residue 6 and name HB1) (residue 6 and name HD2#) 2.6 0.8 1.4
assign (residue 6 and name HB2) ((residue 6 and name HD1#) OR (residue 6 and name HD2#)) 3.4 1.6 2.6
assign (residue 3 and name HA) ((residue 6 and name HD1#) OR (residue 6 and name HD2#)) 3.4 1.6 2.6
assign (residue 3 and name HE3) ((residue 6 and name HD1#) OR (residue 6 and name HD2#)) 3.4 1.6 2.6
assign (residue 3 and name HE3) ((residue 6 and name HD1#) OR (residue 6 and name HD2#)) 3.4 1.6 3.1
assign (residue 6 and name HA) ((residue 6 and name HD1#) OR (residue 6 and name HD2#)) 3.4 1.6 3.1
assign (residue 8 and name HB2) ((residue 8 and name HD1) OR (residue 8 and name HD2)) 2.6 0.8 0.9
assign (residue 7 and name HN) ((residue 8 and name HD1) OR (residue 8 and name HD2)) 2.2 0.4 0.6
assign (residue 8 and name HB1) ((residue 8 and name HD1) OR (residue 8 and name HD2)) 2.6 0.8 0.9
assign (residue 8 and name HG#) ((residue 8 and name HD1) OR (residue 8 and name HD2)) 2.6 0.8 0.9
assign (residue 7 and name HB#) ((residue 8 and name HD1) OR (residue 8 and name HD2)) 2.6 0.8 1.4
assign (residue 8 and name HB1) ((residue 8 and name HG1) OR (residue 8 and name HG2)) 2.2 0.4 0.6
assign (residue 8 and name HB2) ((residue 8 and name HG1) OR (residue 8 and name HG2)) 2.6 0.8 0.9
assign (residue 8 and name HA) ((residue 8 and name HG1) OR (residue 8 and name HG2)) 3.4 1.6 2.1
!assign (residue 11 and name HN) ((residue 10 and name HD1#) OR (residue 10 and name HD2#)) 3.4 1.6 3.1
assign (residue 14 and name HA) ((residue 14 and name HD1#) OR (residue 14 and name HD2#)) 3.4 1.6 2.6
assign (residue 14 and name HD1#) (residue 14 and name HB1) 3.4 1.6 2.6
assign (residue 14 and name HD2#) (residue 14 and name HB1) 3.4 1.6 2.6
assign (residue 14 and name HD1#) (residue 14 and name HB2) 3.4 1.6 2.6
assign (residue 14 and name HD2#) (residue 14 and name HB2) 3.4 1.6 2.6
assign (residue 15 and name HN) ((residue 14 and name HD1#) OR (residue 14 and name HD2#)) 3.4 1.6 3.1
!
!Resolved
!
assign (residue 17 and name HB2) (residue 18 and name HN) 2.6 0.8 0.9
assign (residue 17 and name HB1) (residue 18 and name HN) 2.6 0.8 1.4
assign (residue 17 and name HB2) (residue 17 and name HE3) 2.2 0.4 0.6
assign (residue 17 and name HB1) (residue 17 and name HE3) 3.4 1.6 2.1
!assign (residue 18 and name HB2) (residue 15 and name HA) 3.4 1.6 2.1
!assign (residue 3 and name HD1) ((residue 1 and name HA1) OR (residue 1 and name HA2)) 3.4 1.6 2.1
assign (residue 3 and name HD1) (residue 1 and name HA1) 3.4 1.6 2.1
assign (residue 3 and name HD1) ((residue 1 and name HA1) OR (residue 1 and name HA2)) 3.4 1.6 2.6
assign (residue 3 and name HD1) (residue 1 and name HA2) 3.4 1.6 2.6
!assign (residue 3 and name HE1) ((residue 1 and name HA1) OR (residue 1 and name HA2)) 2.6 0.8 0.9
assign (residue 3 and name HE1) (residue 1 and name HA1) 2.6 0.8 0.9
!assign (residue 3 and name HE1) ((residue 1 and name HA1) OR (residue 1 and name HA2)) 3.4 1.6 2.6
assign (residue 3 and name HE1) (residue 1 and name HA2) 3.4 1.6 2.6
!assign (residue 7 and name HN) ((residue 6 and name HB1) OR (residue 6 and name HB2)) 2.6 0.8 0.9
assign (residue 7 and name HN) (residue 6 and name HB2) 2.6 0.8 0.9
!assign (residue 6 and name HA) ((residue 6 and name HB1) OR (residue 6 and name HB2)) 2.6 0.8 0.9
assign (residue 6 and name HA) (residue 6 and name HB2) 2.6 0.8 0.9
!assign (residue 3 and name HA) ((residue 6 and name HB1) OR (residue 6 and name HB2)) 3.4 1.6 2.1
assign (residue 3 and name HA) (residue 6 and name HB2) 3.4 1.6 2.1
!assign (residue 6 and name HG) ((residue 6 and name HB1) OR (residue 6 and name HB2)) 2.2 0.4 0.6
assign (residue 6 and name HG) (residue 6 and name HB2) 2.2 0.4 0.6
!assign (residue 11 and name HA) ((residue 14 and name HB1) OR (residue 14 and name HB2)) 2.6 0.8 0.9
assign (residue 11 and name HA) (residue 14 and name HB1) 2.6 0.8 0.9
!assign (residue 14 and name HA) ((residue 14 and name HB1) OR (residue 14 and name HB2)) 2.6 0.8 0.9
assign (residue 14 and name HA) (residue 14 and name HB1) 2.6 0.8 0.9
!assign (residue 15 and name HN) ((residue 14 and name HB1) OR (residue 14 and name HB2)) 2.6 0.8 0.9
assign (residue 15 and name HN) (residue 14 and name HB1) 2.6 0.8 0.9
!assign (residue 15 and name HN) ((residue 14 and name HB1) OR (residue 14 and name HB2)) 3.4 1.6 2.6
assign (residue 15 and name HN) (residue 14 and name HB2) 3.4 1.6 2.6
!assign (residue 17 and name HN) ((residue 16 and name HB1) OR (residue 16 and name HB2)) 2.6 0.8 0.9
assign (residue 17 and name HN) (residue 16 and name HB1) 2.6 0.8 0.9
!assign (residue 17 and name HN) ((residue 16 and name HB1) OR (residue 16 and name HB2)) 3.4 1.6 2.1
assign (residue 17 and name HN) (residue 16 and name HB2) 3.4 1.6 2.1
!assign (residue 16 and name HA) ((residue 16 and name HB1) OR (residue 16 and name HB2)) 2.6 0.8 0.9
assign (residue 16 and name HA) (residue 16 and name HB1) 2.6 0.8 0.9
!assign (residue 16 and name HA) ((residue 16 and name HB1) OR (residue 16 and name HB2)) 3.4 1.6 2.1
assign (residue 16 and name HA) (residue 16 and name HB2) 3.4 1.6 2.1
!assign (residue 16 and name HD#) ((residue 16 and name HB1) OR (residue 16 and name HB2))3.4 1.6 2.6
assign (residue 16 and name HD#) (residue 16 and name HB1) 3.4 1.6 2.6
!assign (residue 1 and name HT#) ((residue 4 and name HD1#) OR (residue 4 and name HD2#)) 2.6 0.8 1.4
assign (residue 1 and name HT#) (residue 4 and name HD2#) 2.6 0.8 1.4
!assign (residue 3 and name HD1) ((residue 4 and name HD1#) OR (residue 4 and name HD2#)) 3.4 1.6 2.6
assign (residue 3 and name HD1) (residue 4 and name HD1#) 3.4 1.6 2.6
!assign (residue 3 and name HE3) ((residue 4 and name HD1#) OR (residue 4 and name HD2#)) 3.4 1.6 2.6
assign (residue 3 and name HE3) (residue 4 and name HD1#) 3.4 1.6 2.6
!assign (residue 3 and name HZ3) ((residue 4 and name HD1#) OR (residue 4 and name HD2#)) 3.4 1.6 2.6
!assign (residue 3 and name HZ3) (residue 4 and name HD1#) 3.4 1.6 2.6
!assign (residue 3 and name HE1) ((residue 4 and name HD1#) OR (residue 4 and name HD2#)) 3.4 1.6 2.6
assign (residue 3 and name HE1) (residue 4 and name HD1#) 3.4 1.6 2.6
!assign (residue 5 and name HN) ((residue 4 and name HD1#) OR (residue 4 and name HD2#)) 3.4 1.6 3.1
assign (residue 5 and name HN) (residue 4 and name HD1#) 3.4 1.6 3.1
!assign (residue 4 and name HA) ((residue 4 and name HD1#) OR (residue 4 and name HD2#)) 2.6 0.8 1.4
assign (residue 4 and name HA) (residue 4 and name HD1#) 2.6 0.8 1.4
!assign (residue 4 and name HA) ((residue 4 and name HD1#) OR (residue 4 and name HD2#)) 3.4 1.6 3.1
assign (residue 4 and name HA) (residue 4 and name HD2#) 3.4 1.6 3.1
!assign (residue 1 and name HA#) ((residue 4 and name HD1#) OR (residue 4 and name HD2#)) 3.4 1.6 3.1
assign (residue 1 and name HA#) (residue 4 and name HD2#) 3.4 1.6 3.1
!
assign (residue 0 and name HA#) (residue 1 and name HN) 2.2 0.4 1.1
assign (residue 0 and name HA#) (residue 3 and name HD1) 3.4 1.6 3.1
assign (residue 0 and name HA#) (residue 3 and name HE1) 3.4 1.6 3.1
assign (residue 0 and name HA#) (residue 3 and name HZ2) 3.4 1.6 3.1
assign (residue 20 and name HN) (residue 19 and name HA) 2.2 0.4 0.6
assign (residue 20 and name HN) (residue 19 and name HN) 2.2 0.4 0.6
assign (residue 20 and name HN) (residue 16 and name HA) 3.4 1.6 2.1
assign (residue 20 and name HN) (residue 17 and name HB1) 3.4 1.6 2.1
!
assign (residue 20 and name HN) (residue 20 and name HA#) 2.6 0.8 0.9
assign (residue 20 and name HN) (residue 20 and name HG) 3.4 1.6 2.1
assign (residue 18 and name HB#) (residue 15 and name HB#) 3.4 1.6 2.6
assign (residue 18 and name HB#) (residue 19 and name HB#) 3.4 1.6 2.6
assign (residue 18 and name HB#) ((residue 14 and name HD1#) OR (residue 14 and name HD2#)) 3.4 1.6 3.1
assign (residue 17 and name HB1) (residue 13 and name HB#) 3.4 1.6 3.1
assign (residue 17 and name HB#) ((residue 14 and name HD1#) OR (residue 14 and name HD2#)) 3.4 1.6 3.1
assign (residue 5 and name HB#) ((residue 2 and name HB1) OR (residue 14 and name HB2)) 3.4 1.6 2.6
! 1. W 2 Phi -62.00 +/- 6.00 (-68.00 to -56.00)

assign (resid   1 and name  C) (resid   2 and name  N) 
       (resid   2 and name CA) (resid   2 and name  C) 1.0   -62.00     6.00 2

! 2. W 3 Phi -70.00 +/- 30.00 (-100.00 to -40.00)

assign (resid   2 and name  C) (resid   3 and name  N) 
       (resid   3 and name CA) (resid   3 and name  C) 1.0   -70.00    30.00 2

! 3. L 4 Phi -63.00 +/- 8.00 (-71.00 to -55.00)

assign (resid   3 and name  C) (resid   4 and name  N) 
       (resid   4 and name CA) (resid   4 and name  C) 1.0   -63.00     8.00 2

! 4. A 5 Phi -75.00 +/- 22.00 (-97.00 to -53.00)

assign (resid   4 and name  C) (resid   5 and name  N) 
       (resid   5 and name CA) (resid   5 and name  C) 1.0   -75.00    22.00 2

! 5. L 6 Phi -95.00 +/- 34.00 (-129.00 to -61.00)

assign (resid   5 and name  C) (resid   6 and name  N) 
       (resid   6 and name CA) (resid   6 and name  C) 1.0   -95.00    34.00 2

! 6. P 8 Phi -56.00 +/- 14.00 (-70.00 to -42.00)

assign (resid   7 and name  C) (resid   8 and name  N) 
       (resid   8 and name CA) (resid   8 and name  C) 1.0   -56.00    14.00 2

! 7. A 9 Phi -67.00 +/- 10.00 (-77.00 to -57.00)

assign (resid   8 and name  C) (resid   9 and name  N) 
       (resid   9 and name CA) (resid   9 and name  C) 1.0   -67.00    10.00 2

! 8. L 10 Phi -69.00 +/- 20.00 (-89.00 to -49.00)

assign (resid   9 and name  C) (resid  10 and name  N) 
       (resid  10 and name CA) (resid  10 and name  C) 1.0   -69.00    20.00 2

! 9. A 11 Phi -64.00 +/- 16.00 (-80.00 to -48.00)

assign (resid  10 and name  C) (resid  11 and name  N) 
       (resid  11 and name CA) (resid  11 and name  C) 1.0   -64.00    16.00 2

! 10. L 12 Phi -65.00 +/- 14.00 (-79.00 to -51.00)

assign (resid  11 and name  C) (resid  12 and name  N) 
       (resid  12 and name CA) (resid  12 and name  C) 1.0   -65.00    14.00 2

! 11. A 13 Phi -65.00 +/- 12.00 (-77.00 to -53.00)

assign (resid  12 and name  C) (resid  13 and name  N) 
       (resid  13 and name CA) (resid  13 and name  C) 1.0   -65.00    12.00 2

! 12. L 14 Phi -70.00 +/- 26.00 (-96.00 to -44.00)

assign (resid  13 and name  C) (resid  14 and name  N) 
       (resid  14 and name CA) (resid  14 and name  C) 1.0   -70.00    26.00 2

! 13. A 15 Phi -65.00 +/- 12.00 (-77.00 to -53.00)

assign (resid  14 and name  C) (resid  15 and name  N) 
       (resid  15 and name CA) (resid  15 and name  C) 1.0   -65.00    12.00 2

! 14. L 16 Phi -64.00 +/- 12.00 (-76.00 to -52.00)

assign (resid  15 and name  C) (resid  16 and name  N) 
       (resid  16 and name CA) (resid  16 and name  C) 1.0   -64.00    12.00 2

! 15. W 17 Phi -64.00 +/- 10.00 (-74.00 to -54.00)

assign (resid  16 and name  C) (resid  17 and name  N) 
       (resid  17 and name CA) (resid  17 and name  C) 1.0   -64.00    10.00 2

! 16. W 18 Phi -61.00 +/- 8.00 (-69.00 to -53.00)

assign (resid  17 and name  C) (resid  18 and name  N) 
       (resid  18 and name CA) (resid  18 and name  C) 1.0   -61.00     8.00 2


! 17. W 2 Psi -42.00 +/- 10.00 (-52.00 to -32.00)

!assign (resid   2 and name  N) (resid   2 and name CA) 
!       (resid   2 and name  C) (resid   3 and name  N) 1.0   -42.00    10.00 2

! 18. W 3 Psi -38.00 +/- 22.00 (-60.00 to -16.00)

assign (resid   3 and name  N) (resid   3 and name CA) 
       (resid   3 and name  C) (resid   4 and name  N) 1.0   -38.00    22.00 2

! 19. L 4 Psi -41.00 +/- 10.00 (-51.00 to -31.00)

assign (resid   4 and name  N) (resid   4 and name CA) 
       (resid   4 and name  C) (resid   5 and name  N) 1.0   -41.00    10.00 2

! 20. A 5 Psi -30.00 +/- 28.00 (-58.00 to -2.00)

assign (resid   5 and name  N) (resid   5 and name CA) 
       (resid   5 and name  C) (resid   6 and name  N) 1.0   -30.00    28.00 2

! 21. L 6 Psi -22.00 +/- 38.00 (-60.00 to 16.00)

assign (resid   6 and name  N) (resid   6 and name CA) 
       (resid   6 and name  C) (resid   7 and name  N) 1.0   -22.00    38.00 2

! 22. P 8 Psi -31.00 +/- 18.00 (-49.00 to -13.00)

assign (resid   8 and name  N) (resid   8 and name CA) 
       (resid   8 and name  C) (resid   9 and name  N) 1.0   -31.00    18.00 2

! 23. A 9 Psi -25.00 +/- 20.00 (-45.00 to -5.00)

assign (resid   9 and name  N) (resid   9 and name CA) 
       (resid   9 and name  C) (resid  10 and name  N) 1.0   -25.00    20.00 2

! 24. L 10 Psi -35.00 +/- 22.00 (-57.00 to -13.00)

assign (resid  10 and name  N) (resid  10 and name CA) 
       (resid  10 and name  C) (resid  11 and name  N) 1.0   -35.00    22.00 2

! 25. A 11 Psi -38.00 +/- 20.00 (-58.00 to -18.00)

assign (resid  11 and name  N) (resid  11 and name CA) 
       (resid  11 and name  C) (resid  12 and name  N) 1.0   -38.00    20.00 2

! 26. L 12 Psi -38.00 +/- 28.00 (-66.00 to -10.00)

assign (resid  12 and name  N) (resid  12 and name CA) 
       (resid  12 and name  C) (resid  13 and name  N) 1.0   -38.00    28.00 2

! 27. A 13 Psi -38.00 +/- 18.00 (-56.00 to -20.00)

assign (resid  13 and name  N) (resid  13 and name CA) 
       (resid  13 and name  C) (resid  14 and name  N) 1.0   -38.00    18.00 2

! 28. L 14 Psi -36.00 +/- 22.00 (-58.00 to -14.00)

assign (resid  14 and name  N) (resid  14 and name CA) 
       (resid  14 and name  C) (resid  15 and name  N) 1.0   -36.00    22.00 2

! 29. A 15 Psi -40.00 +/- 12.00 (-52.00 to -28.00)

assign (resid  15 and name  N) (resid  15 and name CA) 
       (resid  15 and name  C) (resid  16 and name  N) 1.0   -40.00    12.00 2

! 30. L 16 Psi -41.00 +/- 12.00 (-53.00 to -29.00)

!assign (resid  16 and name  N) (resid  16 and name CA) 
!       (resid  16 and name  C) (resid  17 and name  N) 1.0   -41.00    12.00 2

! 31. W 17 Psi -44.00 +/- 8.00 (-52.00 to -36.00)

assign (resid  17 and name  N) (resid  17 and name CA) 
       (resid  17 and name  C) (resid  18 and name  N) 1.0   -44.00     8.00 2

! 32. W 18 Psi -43.00 +/- 10.00 (-53.00 to -33.00)

assign (resid  18 and name  N) (resid  18 and name CA) 
       (resid  18 and name  C) (resid  19 and name  N) 1.0   -43.00    10.00 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ACE   0           HA2      ACE   0  23.741  -6.747  -8.422
    2    H2   ACE   0           HA3      ACE   0  23.224  -5.704  -7.099
    3    H3   ACE   0           HA1      ACE   0  24.796  -5.454  -7.857
    4    H    GLY   1           HN       GLY   1  22.139  -3.834  -7.573
    5    HA2  GLY   1           HA2      GLY   1  22.347  -2.492 -10.088
    6    HA3  GLY   1           HA1      GLY   1  20.851  -3.411  -9.928
    7    H    TRP   2           HN       TRP   2  19.391  -1.980  -9.591
    8    HA   TRP   2           HA       TRP   2  19.737   0.386  -8.043
    9    HB2  TRP   2           HB2      TRP   2  17.041   0.288  -8.276
   10    HB3  TRP   2           HB1      TRP   2  18.072   0.834  -9.594
   11    HD1  TRP   2           HD1      TRP   2  17.732  -2.698  -8.434
   12    HE1  TRP   2           HE1      TRP   2  16.773  -4.167 -10.338
   13    HE3  TRP   2           HE3      TRP   2  16.717   0.919 -11.830
   14    HZ2  TRP   2           HZ2      TRP   2  15.708  -3.814 -12.964
   15    HZ3  TRP   2           HZ3      TRP   2  15.728   0.349 -14.032
   16    HH2  TRP   2           HH2      TRP   2  15.222  -2.011 -14.605
   17    H    TRP   3           HN       TRP   3  19.912  -2.561  -6.992
   18    HA   TRP   3           HA       TRP   3  18.029  -2.527  -4.818
   19    HB2  TRP   3           HB2      TRP   3  20.428  -4.319  -4.858
   20    HB3  TRP   3           HB1      TRP   3  18.822  -4.642  -4.217
   21    HD1  TRP   3           HD1      TRP   3  20.871  -5.797  -6.822
   22    HE1  TRP   3           HE1      TRP   3  19.557  -6.606  -8.880
   23    HE3  TRP   3           HE3      TRP   3  16.346  -3.643  -5.884
   24    HZ2  TRP   3           HZ2      TRP   3  16.943  -6.376  -9.977
   25    HZ3  TRP   3           HZ3      TRP   3  14.479  -3.942  -7.438
   26    HH2  TRP   3           HH2      TRP   3  14.751  -5.310  -9.493
   27    H    LEU   4           HN       LEU   4  21.546  -2.425  -5.033
   28    HA   LEU   4           HA       LEU   4  22.088  -1.828  -2.383
   29    HB2  LEU   4           HB2      LEU   4  23.672  -0.605  -4.648
   30    HB3  LEU   4           HB1      LEU   4  24.242  -1.152  -3.072
   31    HG   LEU   4           HG       LEU   4  23.181  -3.522  -4.107
   32   HD11  LEU   4          HD11      LEU   4  22.763  -2.750  -6.301
   33   HD12  LEU   4          HD12      LEU   4  24.228  -3.702  -6.406
   34   HD13  LEU   4          HD13      LEU   4  24.320  -1.944  -6.424
   35   HD21  LEU   4          HD21      LEU   4  25.569  -4.126  -4.643
   36   HD22  LEU   4          HD22      LEU   4  25.355  -3.427  -3.037
   37   HD23  LEU   4          HD23      LEU   4  26.010  -2.443  -4.346
   38    H    ALA   5           HN       ALA   5  20.844   0.100  -4.957
   39    HA   ALA   5           HA       ALA   5  21.340   2.706  -4.176
   40    HB1  ALA   5           HB1      ALA   5  19.472   3.320  -5.504
   41    HB2  ALA   5           HB2      ALA   5  18.663   1.778  -5.217
   42    HB3  ALA   5           HB3      ALA   5  20.096   1.844  -6.241
   43    H    LEU   6           HN       LEU   6  19.721   0.328  -2.417
   44    HA   LEU   6           HA       LEU   6  17.928   2.102  -0.984
   45    HB2  LEU   6           HB2      LEU   6  18.607  -0.807  -0.547
   46    HB3  LEU   6           HB1      LEU   6  17.304   0.079   0.239
   47    HG   LEU   6           HG       LEU   6  17.459  -0.053  -2.777
   48   HD11  LEU   6          HD11      LEU   6  17.516  -2.380  -1.978
   49   HD12  LEU   6          HD12      LEU   6  15.955  -2.008  -2.709
   50   HD13  LEU   6          HD13      LEU   6  16.115  -2.069  -0.954
   51   HD21  LEU   6          HD21      LEU   6  15.217   0.347  -0.759
   52   HD22  LEU   6          HD22      LEU   6  14.955   0.156  -2.490
   53   HD23  LEU   6          HD23      LEU   6  15.854   1.544  -1.888
   54    H    ALA   7           HN       ALA   7  21.120   0.745  -0.624
   55    HA   ALA   7           HA       ALA   7  21.365   0.937   2.171
   56    HB1  ALA   7           HB1      ALA   7  23.121   0.428  -0.094
   57    HB2  ALA   7           HB2      ALA   7  23.300  -0.124   1.566
   58    HB3  ALA   7           HB3      ALA   7  23.949   1.443   1.086
   59    HA   PRO   8           HA       PRO   8  23.400   5.420   1.184
   60    HB2  PRO   8           HB2      PRO   8  21.268   5.896  -0.888
   61    HB3  PRO   8           HB1      PRO   8  22.871   6.644  -0.734
   62    HG2  PRO   8           HG2      PRO   8  22.504   4.717  -2.482
   63    HG3  PRO   8           HG1      PRO   8  23.986   4.752  -1.497
   64    HD2  PRO   8           HD2      PRO   8  21.636   2.925  -1.259
   65    HD3  PRO   8           HD1      PRO   8  23.336   2.632  -0.838
   66    H    ALA   9           HN       ALA   9  19.935   4.924   0.582
   67    HA   ALA   9           HA       ALA   9  19.021   7.065   2.183
   68    HB1  ALA   9           HB1      ALA   9  16.834   6.167   1.877
   69    HB2  ALA   9           HB2      ALA   9  17.472   4.557   1.543
   70    HB3  ALA   9           HB3      ALA   9  17.720   5.861   0.382
   71    H    LEU  10           HN       LEU  10  19.997   3.810   2.966
   72    HA   LEU  10           HA       LEU  10  18.807   3.886   5.604
   73    HB2  LEU  10           HB2      LEU  10  18.610   1.689   4.918
   74    HB3  LEU  10           HB1      LEU  10  19.900   1.868   3.747
   75    HG   LEU  10           HG       LEU  10  21.548   1.671   5.645
   76   HD11  LEU  10          HD11      LEU  10  19.390   0.456   7.363
   77   HD12  LEU  10          HD12      LEU  10  19.500   2.210   7.346
   78   HD13  LEU  10          HD13      LEU  10  20.893   1.248   7.833
   79   HD21  LEU  10          HD21      LEU  10  21.222  -0.788   5.853
   80   HD22  LEU  10          HD22      LEU  10  20.996  -0.224   4.197
   81   HD23  LEU  10          HD23      LEU  10  19.594  -0.608   5.196
   82    H    ALA  11           HN       ALA  11  21.496   4.889   4.070
   83    HA   ALA  11           HA       ALA  11  23.662   4.482   5.709
   84    HB1  ALA  11           HB1      ALA  11  24.599   6.536   4.872
   85    HB2  ALA  11           HB2      ALA  11  23.001   7.152   4.456
   86    HB3  ALA  11           HB3      ALA  11  23.679   5.788   3.567
   87    H    LEU  12           HN       LEU  12  20.769   6.143   6.462
   88    HA   LEU  12           HA       LEU  12  21.804   7.867   8.483
   89    HB2  LEU  12           HB2      LEU  12  18.987   6.795   8.426
   90    HB3  LEU  12           HB1      LEU  12  19.557   8.360   9.008
   91    HG   LEU  12           HG       LEU  12  19.537   7.430   6.124
   92   HD11  LEU  12          HD11      LEU  12  17.961   9.579   7.576
   93   HD12  LEU  12          HD12      LEU  12  17.317   8.041   7.000
   94   HD13  LEU  12          HD13      LEU  12  17.884   9.248   5.846
   95   HD21  LEU  12          HD21      LEU  12  20.593   9.923   7.484
   96   HD22  LEU  12          HD22      LEU  12  20.176   9.902   5.769
   97   HD23  LEU  12          HD23      LEU  12  21.446   8.842   6.381
   98    H    ALA  13           HN       ALA  13  19.792   4.919   8.799
   99    HA   ALA  13           HA       ALA  13  20.270   4.593  11.543
  100    HB1  ALA  13           HB1      ALA  13  18.533   3.378  10.092
  101    HB2  ALA  13           HB2      ALA  13  19.339   2.430  11.342
  102    HB3  ALA  13           HB3      ALA  13  19.842   2.277   9.660
  103    H    LEU  14           HN       LEU  14  22.051   3.502   8.695
  104    HA   LEU  14           HA       LEU  14  23.820   1.754   9.936
  105    HB2  LEU  14           HB2      LEU  14  23.592   2.238   7.451
  106    HB3  LEU  14           HB1      LEU  14  24.569   3.675   7.718
  107    HG   LEU  14           HG       LEU  14  25.664   1.047   8.731
  108   HD11  LEU  14          HD11      LEU  14  24.984   0.355   6.537
  109   HD12  LEU  14          HD12      LEU  14  26.718   0.669   6.476
  110   HD13  LEU  14          HD13      LEU  14  25.585   1.849   5.817
  111   HD21  LEU  14          HD21      LEU  14  27.802   2.095   7.938
  112   HD22  LEU  14          HD22      LEU  14  26.963   3.088   9.124
  113   HD23  LEU  14          HD23      LEU  14  26.884   3.505   7.415
  114    H    ALA  15           HN       ALA  15  24.074   5.269   9.503
  115    HA   ALA  15           HA       ALA  15  26.541   5.587  10.808
  116    HB1  ALA  15           HB1      ALA  15  25.514   7.397   9.522
  117    HB2  ALA  15           HB2      ALA  15  25.811   7.928  11.177
  118    HB3  ALA  15           HB3      ALA  15  24.181   7.482  10.673
  119    H    LEU  16           HN       LEU  16  23.342   4.964  11.976
  120    HA   LEU  16           HA       LEU  16  23.776   5.811  14.657
  121    HB2  LEU  16           HB2      LEU  16  21.540   5.427  13.333
  122    HB3  LEU  16           HB1      LEU  16  21.682   3.785  13.944
  123    HG   LEU  16           HG       LEU  16  21.600   6.326  15.603
  124   HD11  LEU  16          HD11      LEU  16  19.664   4.028  15.204
  125   HD12  LEU  16          HD12      LEU  16  19.409   5.722  14.785
  126   HD13  LEU  16          HD13      LEU  16  19.499   5.237  16.477
  127   HD21  LEU  16          HD21      LEU  16  21.450   4.560  17.502
  128   HD22  LEU  16          HD22      LEU  16  23.037   4.847  16.792
  129   HD23  LEU  16          HD23      LEU  16  22.104   3.426  16.319
  130    H    TRP  17           HN       TRP  17  23.206   2.439  13.487
  131    HA   TRP  17           HA       TRP  17  24.392   1.417  15.893
  132    HB2  TRP  17           HB2      TRP  17  24.122  -0.799  14.829
  133    HB3  TRP  17           HB1      TRP  17  22.643   0.131  14.963
  134    HD1  TRP  17           HD1      TRP  17  21.537   0.990  12.715
  135    HE1  TRP  17           HE1      TRP  17  21.865   0.290  10.254
  136    HE3  TRP  17           HE3      TRP  17  25.909  -1.624  13.102
  137    HZ2  TRP  17           HZ2      TRP  17  23.721  -1.172   8.668
  138    HZ3  TRP  17           HZ3      TRP  17  26.934  -2.661  11.099
  139    HH2  TRP  17           HH2      TRP  17  25.847  -2.439   8.881
  140    H    TRP  18           HN       TRP  18  25.520   1.602  12.531
  141    HA   TRP  18           HA       TRP  18  27.829   0.078  12.768
  142    HB2  TRP  18           HB2      TRP  18  26.929   1.300  10.686
  143    HB3  TRP  18           HB1      TRP  18  27.799   2.711  11.278
  144    HD1  TRP  18           HD1      TRP  18  28.440  -0.937  10.235
  145    HE1  TRP  18           HE1      TRP  18  30.877  -1.129   9.408
  146    HE3  TRP  18           HE3      TRP  18  30.095   3.784  11.254
  147    HZ2  TRP  18           HZ2      TRP  18  33.208   0.495   9.208
  148    HZ3  TRP  18           HZ3      TRP  18  32.431   4.435  10.734
  149    HH2  TRP  18           HH2      TRP  18  33.988   2.798   9.712
  150    H    ALA  19           HN       ALA  19  27.457   3.557  13.333
  151    HA   ALA  19           HA       ALA  19  30.018   3.666  14.760
  152    HB1  ALA  19           HB1      ALA  19  29.926   6.014  14.495
  153    HB2  ALA  19           HB2      ALA  19  28.195   5.989  14.160
  154    HB3  ALA  19           HB3      ALA  19  29.335   5.363  12.967
  155    HA1  ETA  20           HA1      ETA  20  26.342   2.282  17.762
  156    HA2  ETA  20           HA2      ETA  20  26.556   4.027  17.907
  157    H2   ETA  20           HN       ETA  20  27.662   2.332  15.852
  158    HB1  ETA  20           HB1      ETA  20  28.710   2.008  18.595
  159    HB2  ETA  20           HB2      ETA  20  27.582   2.656  19.778
  160    HO   ETA  20           HG       ETA  20  29.602   3.826  19.597
  Start of MODEL    2
    1    H1   ACE   0           HA2      ACE   0  23.378  -7.117  -6.067
    2    H2   ACE   0           HA3      ACE   0  22.010  -8.185  -6.378
    3    H3   ACE   0           HA1      ACE   0  21.783  -6.717  -5.428
    4    H    GLY   1           HN       GLY   1  21.284  -4.832  -6.477
    5    HA2  GLY   1           HA2      GLY   1  21.919  -4.349  -9.223
    6    HA3  GLY   1           HA1      GLY   1  20.220  -4.746  -8.974
    7    H    TRP   2           HN       TRP   2  19.229  -2.937  -9.172
    8    HA   TRP   2           HA       TRP   2  20.208  -0.422  -8.263
    9    HB2  TRP   2           HB2      TRP   2  17.605   0.154  -8.739
   10    HB3  TRP   2           HB1      TRP   2  18.783   0.014 -10.040
   11    HD1  TRP   2           HD1      TRP   2  17.398  -2.821  -8.044
   12    HE1  TRP   2           HE1      TRP   2  16.109  -4.447  -9.593
   13    HE3  TRP   2           HE3      TRP   2  17.585  -0.171 -12.357
   14    HZ2  TRP   2           HZ2      TRP   2  15.273  -4.572 -12.322
   15    HZ3  TRP   2           HZ3      TRP   2  16.540  -1.046 -14.429
   16    HH2  TRP   2           HH2      TRP   2  15.385  -3.241 -14.418
   17    H    TRP   3           HN       TRP   3  19.514  -2.885  -6.465
   18    HA   TRP   3           HA       TRP   3  17.665  -1.739  -4.580
   19    HB2  TRP   3           HB2      TRP   3  19.437  -4.059  -3.913
   20    HB3  TRP   3           HB1      TRP   3  17.793  -3.736  -3.374
   21    HD1  TRP   3           HD1      TRP   3  19.468  -6.084  -5.374
   22    HE1  TRP   3           HE1      TRP   3  18.016  -7.035  -7.274
   23    HE3  TRP   3           HE3      TRP   3  15.752  -2.595  -5.477
   24    HZ2  TRP   3           HZ2      TRP   3  15.606  -6.404  -8.646
   25    HZ3  TRP   3           HZ3      TRP   3  13.909  -2.784  -7.077
   26    HH2  TRP   3           HH2      TRP   3  13.811  -4.684  -8.673
   27    H    LEU   4           HN       LEU   4  21.066  -2.657  -4.470
   28    HA   LEU   4           HA       LEU   4  21.702  -1.528  -2.022
   29    HB2  LEU   4           HB2      LEU   4  23.611  -1.450  -4.364
   30    HB3  LEU   4           HB1      LEU   4  23.976  -1.667  -2.654
   31    HG   LEU   4           HG       LEU   4  22.304  -3.859  -3.125
   32   HD11  LEU   4          HD11      LEU   4  22.162  -3.649  -5.474
   33   HD12  LEU   4          HD12      LEU   4  23.300  -4.946  -5.184
   34   HD13  LEU   4          HD13      LEU   4  23.884  -3.353  -5.656
   35   HD21  LEU   4          HD21      LEU   4  24.434  -5.203  -3.253
   36   HD22  LEU   4          HD22      LEU   4  24.398  -4.052  -1.915
   37   HD23  LEU   4          HD23      LEU   4  25.327  -3.687  -3.370
   38    H    ALA   5           HN       ALA   5  21.114  -0.129  -5.114
   39    HA   ALA   5           HA       ALA   5  22.309   2.371  -4.965
   40    HB1  ALA   5           HB1      ALA   5  20.997   1.311  -6.891
   41    HB2  ALA   5           HB2      ALA   5  20.783   3.043  -6.647
   42    HB3  ALA   5           HB3      ALA   5  19.546   1.915  -6.089
   43    H    LEU   6           HN       LEU   6  19.705   1.103  -3.091
   44    HA   LEU   6           HA       LEU   6  18.763   3.738  -2.227
   45    HB2  LEU   6           HB2      LEU   6  17.724   1.055  -1.347
   46    HB3  LEU   6           HB1      LEU   6  16.901   2.614  -1.336
   47    HG   LEU   6           HG       LEU   6  17.716   1.041  -3.792
   48   HD11  LEU   6          HD11      LEU   6  15.035   1.693  -2.536
   49   HD12  LEU   6          HD12      LEU   6  15.755   0.095  -2.736
   50   HD13  LEU   6          HD13      LEU   6  15.225   1.006  -4.150
   51   HD21  LEU   6          HD21      LEU   6  16.524   3.801  -3.419
   52   HD22  LEU   6          HD22      LEU   6  16.311   2.898  -4.919
   53   HD23  LEU   6          HD23      LEU   6  17.929   3.343  -4.380
   54    H    ALA   7           HN       ALA   7  21.191   1.667  -1.379
   55    HA   ALA   7           HA       ALA   7  20.892   1.576   1.447
   56    HB1  ALA   7           HB1      ALA   7  22.949   0.488   1.499
   57    HB2  ALA   7           HB2      ALA   7  23.591   1.402   0.138
   58    HB3  ALA   7           HB3      ALA   7  22.401   0.132  -0.137
   59    HA   PRO   8           HA       PRO   8  24.089   5.384   1.058
   60    HB2  PRO   8           HB2      PRO   8  22.346   6.738  -0.985
   61    HB3  PRO   8           HB1      PRO   8  24.101   6.852  -0.748
   62    HG2  PRO   8           HG2      PRO   8  23.183   5.396  -2.709
   63    HG3  PRO   8           HG1      PRO   8  24.497   4.754  -1.695
   64    HD2  PRO   8           HD2      PRO   8  21.582   4.059  -1.633
   65    HD3  PRO   8           HD1      PRO   8  22.991   2.989  -1.457
   66    H    ALA   9           HN       ALA   9  20.678   5.958   0.285
   67    HA   ALA   9           HA       ALA   9  20.248   8.102   2.050
   68    HB1  ALA   9           HB1      ALA   9  17.839   7.553   1.794
   69    HB2  ALA   9           HB2      ALA   9  18.296   6.063   0.969
   70    HB3  ALA   9           HB3      ALA   9  18.694   7.626   0.253
   71    H    LEU  10           HN       LEU  10  20.590   4.729   2.680
   72    HA   LEU  10           HA       LEU  10  19.228   4.826   5.230
   73    HB2  LEU  10           HB2      LEU  10  18.809   2.704   4.425
   74    HB3  LEU  10           HB1      LEU  10  20.171   2.781   3.329
   75    HG   LEU  10           HG       LEU  10  21.675   2.281   5.305
   76   HD11  LEU  10          HD11      LEU  10  20.830   1.789   7.412
   77   HD12  LEU  10          HD12      LEU  10  19.280   1.219   6.795
   78   HD13  LEU  10          HD13      LEU  10  19.596   2.943   6.919
   79   HD21  LEU  10          HD21      LEU  10  21.113  -0.119   5.279
   80   HD22  LEU  10          HD22      LEU  10  20.952   0.577   3.666
   81   HD23  LEU  10          HD23      LEU  10  19.514   0.256   4.634
   82    H    ALA  11           HN       ALA  11  22.126   5.564   3.961
   83    HA   ALA  11           HA       ALA  11  24.098   4.795   5.711
   84    HB1  ALA  11           HB1      ALA  11  25.265   6.897   5.168
   85    HB2  ALA  11           HB2      ALA  11  23.777   7.540   4.475
   86    HB3  ALA  11           HB3      ALA  11  24.570   6.152   3.728
   87    H    LEU  12           HN       LEU  12  21.371   6.749   6.384
   88    HA   LEU  12           HA       LEU  12  22.445   8.211   8.581
   89    HB2  LEU  12           HB2      LEU  12  19.536   7.479   8.281
   90    HB3  LEU  12           HB1      LEU  12  20.239   8.934   8.991
   91    HG   LEU  12           HG       LEU  12  20.269   8.164   6.060
   92   HD11  LEU  12          HD11      LEU  12  18.979  10.316   5.866
   93   HD12  LEU  12          HD12      LEU  12  18.905  10.373   7.627
   94   HD13  LEU  12          HD13      LEU  12  18.124   9.054   6.755
   95   HD21  LEU  12          HD21      LEU  12  21.614  10.399   7.601
   96   HD22  LEU  12          HD22      LEU  12  21.291  10.521   5.871
   97   HD23  LEU  12          HD23      LEU  12  22.353   9.253   6.482
   98    H    ALA  13           HN       ALA  13  20.105   5.500   8.569
   99    HA   ALA  13           HA       ALA  13  20.348   4.956  11.310
  100    HB1  ALA  13           HB1      ALA  13  19.803   2.825   9.248
  101    HB2  ALA  13           HB2      ALA  13  18.594   4.034   9.680
  102    HB3  ALA  13           HB3      ALA  13  19.209   2.923  10.904
  103    H    LEU  14           HN       LEU  14  22.187   3.825   8.512
  104    HA   LEU  14           HA       LEU  14  23.667   1.826   9.747
  105    HB2  LEU  14           HB2      LEU  14  23.665   2.472   7.290
  106    HB3  LEU  14           HB1      LEU  14  24.773   3.773   7.710
  107    HG   LEU  14           HG       LEU  14  25.502   0.984   8.618
  108   HD11  LEU  14          HD11      LEU  14  26.532   0.439   6.483
  109   HD12  LEU  14          HD12      LEU  14  25.942   1.946   5.781
  110   HD13  LEU  14          HD13      LEU  14  24.801   0.688   6.256
  111   HD21  LEU  14          HD21      LEU  14  27.791   1.827   8.027
  112   HD22  LEU  14          HD22      LEU  14  26.986   2.838   9.222
  113   HD23  LEU  14          HD23      LEU  14  27.070   3.359   7.541
  114    H    ALA  15           HN       ALA  15  24.335   5.307   9.553
  115    HA   ALA  15           HA       ALA  15  26.727   5.272  11.026
  116    HB1  ALA  15           HB1      ALA  15  26.309   7.645  11.431
  117    HB2  ALA  15           HB2      ALA  15  24.618   7.448  10.969
  118    HB3  ALA  15           HB3      ALA  15  25.891   7.244   9.766
  119    H    LEU  16           HN       LEU  16  23.408   4.942  11.957
  120    HA   LEU  16           HA       LEU  16  23.752   5.582  14.707
  121    HB2  LEU  16           HB2      LEU  16  21.580   5.527  13.227
  122    HB3  LEU  16           HB1      LEU  16  21.501   3.849  13.745
  123    HG   LEU  16           HG       LEU  16  21.582   6.291  15.546
  124   HD11  LEU  16          HD11      LEU  16  19.441   4.205  15.024
  125   HD12  LEU  16          HD12      LEU  16  19.406   5.880  14.475
  126   HD13  LEU  16          HD13      LEU  16  19.325   5.515  16.200
  127   HD21  LEU  16          HD21      LEU  16  22.779   4.603  16.722
  128   HD22  LEU  16          HD22      LEU  16  21.730   3.320  16.118
  129   HD23  LEU  16          HD23      LEU  16  21.130   4.456  17.326
  130    H    TRP  17           HN       TRP  17  22.900   2.371  13.286
  131    HA   TRP  17           HA       TRP  17  23.799   1.080  15.685
  132    HB2  TRP  17           HB2      TRP  17  23.351  -1.019  14.480
  133    HB3  TRP  17           HB1      TRP  17  21.980   0.071  14.543
  134    HD1  TRP  17           HD1      TRP  17  21.121   1.068  12.267
  135    HE1  TRP  17           HE1      TRP  17  21.609   0.474   9.805
  136    HE3  TRP  17           HE3      TRP  17  25.267  -1.858  12.858
  137    HZ2  TRP  17           HZ2      TRP  17  23.494  -1.030   8.293
  138    HZ3  TRP  17           HZ3      TRP  17  26.388  -2.859  10.888
  139    HH2  TRP  17           HH2      TRP  17  25.509  -2.449   8.606
  140    H    TRP  18           HN       TRP  18  25.172   1.345  12.423
  141    HA   TRP  18           HA       TRP  18  27.279  -0.444  12.685
  142    HB2  TRP  18           HB2      TRP  18  26.667   1.001  10.648
  143    HB3  TRP  18           HB1      TRP  18  27.629   2.271  11.401
  144    HD1  TRP  18           HD1      TRP  18  27.967  -1.321  10.079
  145    HE1  TRP  18           HE1      TRP  18  30.431  -1.721   9.422
  146    HE3  TRP  18           HE3      TRP  18  30.031   3.064  11.679
  147    HZ2  TRP  18           HZ2      TRP  18  32.931  -0.366   9.555
  148    HZ3  TRP  18           HZ3      TRP  18  32.458   3.485  11.402
  149    HH2  TRP  18           HH2      TRP  18  33.912   1.777  10.343
  150    H    ALA  19           HN       ALA  19  27.257   3.007  13.481
  151    HA   ALA  19           HA       ALA  19  29.664   2.687  15.147
  152    HB1  ALA  19           HB1      ALA  19  29.939   4.450  13.572
  153    HB2  ALA  19           HB2      ALA  19  29.607   5.229  15.120
  154    HB3  ALA  19           HB3      ALA  19  28.332   5.092  13.909
  155    HA1  ETA  20           HA1      ETA  20  25.550   1.899  17.728
  156    HA2  ETA  20           HA2      ETA  20  25.951   3.611  17.861
  157    H2   ETA  20           HN       ETA  20  27.066   1.737  15.979
  158    HB1  ETA  20           HB1      ETA  20  28.131   2.886  18.951
  159    HB2  ETA  20           HB2      ETA  20  27.461   1.262  19.025
  160    HO   ETA  20           HG       ETA  20  26.789   2.066  20.886
  Start of MODEL    3
    1    H1   ACE   0           HA2      ACE   0  23.060  -6.039  -6.340
    2    H2   ACE   0           HA3      ACE   0  24.641  -5.920  -7.117
    3    H3   ACE   0           HA1      ACE   0  23.535  -7.219  -7.561
    4    H    GLY   1           HN       GLY   1  22.038  -4.187  -6.990
    5    HA2  GLY   1           HA2      GLY   1  22.296  -3.091  -9.618
    6    HA3  GLY   1           HA1      GLY   1  20.767  -3.933  -9.375
    7    H    TRP   2           HN       TRP   2  19.363  -2.423  -9.179
    8    HA   TRP   2           HA       TRP   2  19.799   0.063  -7.861
    9    HB2  TRP   2           HB2      TRP   2  17.101   0.044  -8.088
   10    HB3  TRP   2           HB1      TRP   2  18.150   0.425  -9.450
   11    HD1  TRP   2           HD1      TRP   2  17.676  -2.966  -7.963
   12    HE1  TRP   2           HE1      TRP   2  16.662  -4.571  -9.724
   13    HE3  TRP   2           HE3      TRP   2  16.804   0.350 -11.691
   14    HZ2  TRP   2           HZ2      TRP   2  15.614  -4.427 -12.378
   15    HZ3  TRP   2           HZ3      TRP   2  15.796  -0.387 -13.833
   16    HH2  TRP   2           HH2      TRP   2  15.199  -2.770 -14.183
   17    H    TRP   3           HN       TRP   3  19.863  -2.778  -6.536
   18    HA   TRP   3           HA       TRP   3  17.988  -2.465  -4.378
   19    HB2  TRP   3           HB2      TRP   3  20.315  -4.344  -4.245
   20    HB3  TRP   3           HB1      TRP   3  18.698  -4.542  -3.580
   21    HD1  TRP   3           HD1      TRP   3  20.696  -6.016  -6.060
   22    HE1  TRP   3           HE1      TRP   3  19.348  -6.963  -8.035
   23    HE3  TRP   3           HE3      TRP   3  16.260  -3.610  -5.336
   24    HZ2  TRP   3           HZ2      TRP   3  16.742  -6.736  -9.152
   25    HZ3  TRP   3           HZ3      TRP   3  14.379  -3.983  -6.857
   26    HH2  TRP   3           HH2      TRP   3  14.593  -5.545  -8.775
   27    H    LEU   4           HN       LEU   4  21.505  -2.514  -4.601
   28    HA   LEU   4           HA       LEU   4  22.078  -1.692  -2.021
   29    HB2  LEU   4           HB2      LEU   4  23.696  -0.748  -4.392
   30    HB3  LEU   4           HB1      LEU   4  24.253  -1.158  -2.771
   31    HG   LEU   4           HG       LEU   4  23.108  -3.580  -3.569
   32   HD11  LEU   4          HD11      LEU   4  24.290  -2.275  -6.028
   33   HD12  LEU   4          HD12      LEU   4  22.708  -3.013  -5.828
   34   HD13  LEU   4          HD13      LEU   4  24.139  -4.019  -5.839
   35   HD21  LEU   4          HD21      LEU   4  25.970  -2.626  -3.915
   36   HD22  LEU   4          HD22      LEU   4  25.473  -4.313  -4.045
   37   HD23  LEU   4          HD23      LEU   4  25.288  -3.456  -2.514
   38    H    ALA   5           HN       ALA   5  20.898   0.031  -4.766
   39    HA   ALA   5           HA       ALA   5  21.494   2.678  -4.233
   40    HB1  ALA   5           HB1      ALA   5  18.780   1.757  -5.182
   41    HB2  ALA   5           HB2      ALA   5  20.212   1.676  -6.208
   42    HB3  ALA   5           HB3      ALA   5  19.645   3.235  -5.611
   43    H    LEU   6           HN       LEU   6  19.749   0.534  -2.278
   44    HA   LEU   6           HA       LEU   6  18.064   2.526  -1.008
   45    HB2  LEU   6           HB2      LEU   6  18.556  -0.371  -0.320
   46    HB3  LEU   6           HB1      LEU   6  17.304   0.657   0.364
   47    HG   LEU   6           HG       LEU   6  17.508   0.197  -2.618
   48   HD11  LEU   6          HD11      LEU   6  15.834  -1.587  -2.377
   49   HD12  LEU   6          HD12      LEU   6  15.903  -1.426  -0.622
   50   HD13  LEU   6          HD13      LEU   6  17.313  -2.002  -1.510
   51   HD21  LEU   6          HD21      LEU   6  15.308   1.122  -0.730
   52   HD22  LEU   6          HD22      LEU   6  15.001   0.652  -2.398
   53   HD23  LEU   6          HD23      LEU   6  16.043   2.027  -2.054
   54    H    ALA   7           HN       ALA   7  21.160   0.992  -0.500
   55    HA   ALA   7           HA       ALA   7  21.411   1.379   2.266
   56    HB1  ALA   7           HB1      ALA   7  24.020   1.702   1.162
   57    HB2  ALA   7           HB2      ALA   7  23.154   0.642   0.056
   58    HB3  ALA   7           HB3      ALA   7  23.300   0.198   1.749
   59    HA   PRO   8           HA       PRO   8  23.644   5.689   0.999
   60    HB2  PRO   8           HB2      PRO   8  21.537   6.124  -1.105
   61    HB3  PRO   8           HB1      PRO   8  23.170   6.812  -0.994
   62    HG2  PRO   8           HG2      PRO   8  22.727   4.795  -2.616
   63    HG3  PRO   8           HG1      PRO   8  24.203   4.824  -1.623
   64    HD2  PRO   8           HD2      PRO   8  21.764   3.134  -1.284
   65    HD3  PRO   8           HD1      PRO   8  23.448   2.781  -0.841
   66    H    ALA   9           HN       ALA   9  20.161   5.309   0.422
   67    HA   ALA   9           HA       ALA   9  19.376   7.578   1.939
   68    HB1  ALA   9           HB1      ALA   9  17.730   5.161   1.173
   69    HB2  ALA   9           HB2      ALA   9  17.981   6.579   0.156
   70    HB3  ALA   9           HB3      ALA   9  17.109   6.731   1.680
   71    H    LEU  10           HN       LEU  10  19.986   4.228   2.757
   72    HA   LEU  10           HA       LEU  10  18.804   4.465   5.384
   73    HB2  LEU  10           HB2      LEU  10  18.386   2.290   4.720
   74    HB3  LEU  10           HB1      LEU  10  19.696   2.323   3.558
   75    HG   LEU  10           HG       LEU  10  21.300   1.981   5.477
   76   HD11  LEU  10          HD11      LEU  10  19.314   2.742   7.152
   77   HD12  LEU  10          HD12      LEU  10  20.572   1.624   7.660
   78   HD13  LEU  10          HD13      LEU  10  19.000   1.006   7.167
   79   HD21  LEU  10          HD21      LEU  10  20.570  -0.451   5.785
   80   HD22  LEU  10          HD22      LEU  10  20.735   0.101   4.118
   81   HD23  LEU  10          HD23      LEU  10  19.134  -0.038   4.846
   82    H    ALA  11           HN       ALA  11  21.583   5.170   3.860
   83    HA   ALA  11           HA       ALA  11  23.698   4.566   5.503
   84    HB1  ALA  11           HB1      ALA  11  24.839   6.480   4.629
   85    HB2  ALA  11           HB2      ALA  11  23.320   7.295   4.264
   86    HB3  ALA  11           HB3      ALA  11  23.799   5.869   3.343
   87    H    LEU  12           HN       LEU  12  20.980   6.509   6.246
   88    HA   LEU  12           HA       LEU  12  22.183   8.131   8.259
   89    HB2  LEU  12           HB2      LEU  12  19.272   7.348   8.196
   90    HB3  LEU  12           HB1      LEU  12  19.994   8.847   8.781
   91    HG   LEU  12           HG       LEU  12  19.860   7.920   5.899
   92   HD11  LEU  12          HD11      LEU  12  18.543  10.190   7.419
   93   HD12  LEU  12          HD12      LEU  12  17.739   8.799   6.691
   94   HD13  LEU  12          HD13      LEU  12  18.498  10.016   5.664
   95   HD21  LEU  12          HD21      LEU  12  20.807  10.291   5.528
   96   HD22  LEU  12          HD22      LEU  12  21.936   9.078   6.128
   97   HD23  LEU  12          HD23      LEU  12  21.243  10.261   7.238
   98    H    ALA  13           HN       ALA  13  19.866   5.422   8.597
   99    HA   ALA  13           HA       ALA  13  20.318   5.055  11.340
  100    HB1  ALA  13           HB1      ALA  13  18.455   4.028   9.897
  101    HB2  ALA  13           HB2      ALA  13  19.157   3.004  11.150
  102    HB3  ALA  13           HB3      ALA  13  19.636   2.789   9.470
  103    H    LEU  14           HN       LEU  14  21.984   3.809   8.492
  104    HA   LEU  14           HA       LEU  14  23.549   1.861   9.701
  105    HB2  LEU  14           HB2      LEU  14  23.398   2.434   7.229
  106    HB3  LEU  14           HB1      LEU  14  24.520   3.751   7.545
  107    HG   LEU  14           HG       LEU  14  25.317   0.993   8.488
  108   HD11  LEU  14          HD11      LEU  14  25.353   1.883   5.599
  109   HD12  LEU  14          HD12      LEU  14  24.592   0.440   6.271
  110   HD13  LEU  14          HD13      LEU  14  26.350   0.572   6.229
  111   HD21  LEU  14          HD21      LEU  14  26.820   2.872   8.952
  112   HD22  LEU  14          HD22      LEU  14  26.807   3.342   7.256
  113   HD23  LEU  14          HD23      LEU  14  27.564   1.828   7.744
  114    H    ALA  15           HN       ALA  15  24.160   5.342   9.383
  115    HA   ALA  15           HA       ALA  15  26.638   5.369  10.705
  116    HB1  ALA  15           HB1      ALA  15  24.559   7.558  10.863
  117    HB2  ALA  15           HB2      ALA  15  25.551   7.282   9.432
  118    HB3  ALA  15           HB3      ALA  15  26.312   7.725  10.959
  119    H    LEU  16           HN       LEU  16  23.386   5.029  11.851
  120    HA   LEU  16           HA       LEU  16  23.900   5.739  14.557
  121    HB2  LEU  16           HB2      LEU  16  21.631   5.656  13.258
  122    HB3  LEU  16           HB1      LEU  16  21.616   3.969  13.758
  123    HG   LEU  16           HG       LEU  16  22.142   4.959  16.158
  124   HD11  LEU  16          HD11      LEU  16  20.889   7.322  14.720
  125   HD12  LEU  16          HD12      LEU  16  22.455   7.287  15.526
  126   HD13  LEU  16          HD13      LEU  16  20.976   7.163  16.472
  127   HD21  LEU  16          HD21      LEU  16  19.426   5.146  14.809
  128   HD22  LEU  16          HD22      LEU  16  19.669   5.218  16.555
  129   HD23  LEU  16          HD23      LEU  16  20.085   3.753  15.667
  130    H    TRP  17           HN       TRP  17  22.983   2.482  13.294
  131    HA   TRP  17           HA       TRP  17  24.053   1.278  15.669
  132    HB2  TRP  17           HB2      TRP  17  23.561  -0.877  14.488
  133    HB3  TRP  17           HB1      TRP  17  22.193   0.187  14.754
  134    HD1  TRP  17           HD1      TRP  17  21.264   1.521  12.589
  135    HE1  TRP  17           HE1      TRP  17  21.333   0.884  10.089
  136    HE3  TRP  17           HE3      TRP  17  24.917  -2.049  12.674
  137    HZ2  TRP  17           HZ2      TRP  17  22.739  -0.889   8.364
  138    HZ3  TRP  17           HZ3      TRP  17  25.601  -3.196  10.586
  139    HH2  TRP  17           HH2      TRP  17  24.518  -2.621   8.431
  140    H    TRP  18           HN       TRP  18  25.201   1.449  12.313
  141    HA   TRP  18           HA       TRP  18  27.335  -0.321  12.501
  142    HB2  TRP  18           HB2      TRP  18  26.580   1.057  10.459
  143    HB3  TRP  18           HB1      TRP  18  27.595   2.346  11.098
  144    HD1  TRP  18           HD1      TRP  18  27.854  -1.324   9.962
  145    HE1  TRP  18           HE1      TRP  18  30.258  -1.745   9.123
  146    HE3  TRP  18           HE3      TRP  18  29.983   3.180  11.075
  147    HZ2  TRP  18           HZ2      TRP  18  32.741  -0.364   8.947
  148    HZ3  TRP  18           HZ3      TRP  18  32.372   3.601  10.561
  149    HH2  TRP  18           HH2      TRP  18  33.753   1.837   9.499
  150    H    ALA  19           HN       ALA  19  27.333   3.157  13.183
  151    HA   ALA  19           HA       ALA  19  29.901   2.964  14.573
  152    HB1  ALA  19           HB1      ALA  19  28.264   5.460  14.169
  153    HB2  ALA  19           HB2      ALA  19  29.314   4.820  12.905
  154    HB3  ALA  19           HB3      ALA  19  29.999   5.323  14.450
  155    HA1  ETA  20           HA1      ETA  20  26.159   1.723  17.569
  156    HA2  ETA  20           HA2      ETA  20  26.558   3.420  17.832
  157    H2   ETA  20           HN       ETA  20  27.442   1.776  15.632
  158    HB1  ETA  20           HB1      ETA  20  28.267   1.001  18.480
  159    HB2  ETA  20           HB2      ETA  20  27.543   2.124  19.624
  160    HO   ETA  20           HG       ETA  20  29.505   2.776  17.694
  Start of MODEL    4
    1    H1   ACE   0           HA2      ACE   0  23.611  -6.881  -8.330
    2    H2   ACE   0           HA3      ACE   0  23.125  -5.822  -7.006
    3    H3   ACE   0           HA1      ACE   0  24.677  -5.577  -7.809
    4    H    GLY   1           HN       GLY   1  22.016  -3.966  -7.481
    5    HA2  GLY   1           HA2      GLY   1  22.157  -2.655 -10.017
    6    HA3  GLY   1           HA1      GLY   1  20.670  -3.577  -9.808
    7    H    TRP   2           HN       TRP   2  19.213  -2.153  -9.455
    8    HA   TRP   2           HA       TRP   2  19.580   0.238  -7.951
    9    HB2  TRP   2           HB2      TRP   2  16.879   0.117  -8.117
   10    HB3  TRP   2           HB1      TRP   2  17.876   0.655  -9.465
   11    HD1  TRP   2           HD1      TRP   2  17.577  -2.861  -8.247
   12    HE1  TRP   2           HE1      TRP   2  16.591  -4.365 -10.111
   13    HE3  TRP   2           HE3      TRP   2  16.489   0.698 -11.679
   14    HZ2  TRP   2           HZ2      TRP   2  15.480  -4.056 -12.725
   15    HZ3  TRP   2           HZ3      TRP   2  15.466   0.092 -13.855
   16    HH2  TRP   2           HH2      TRP   2  14.959  -2.279 -14.384
   17    H    TRP   3           HN       TRP   3  19.802  -2.691  -6.860
   18    HA   TRP   3           HA       TRP   3  17.972  -2.634  -4.640
   19    HB2  TRP   3           HB2      TRP   3  20.377  -4.415  -4.715
   20    HB3  TRP   3           HB1      TRP   3  18.789  -4.737  -4.030
   21    HD1  TRP   3           HD1      TRP   3  20.778  -5.915  -6.671
   22    HE1  TRP   3           HE1      TRP   3  19.417  -6.760  -8.683
   23    HE3  TRP   3           HE3      TRP   3  16.267  -3.776  -5.643
   24    HZ2  TRP   3           HZ2      TRP   3  16.773  -6.560  -9.713
   25    HZ3  TRP   3           HZ3      TRP   3  14.361  -4.107  -7.142
   26    HH2  TRP   3           HH2      TRP   3  14.587  -5.499  -9.187
   27    H    LEU   4           HN       LEU   4  21.481  -2.515  -4.950
   28    HA   LEU   4           HA       LEU   4  22.091  -1.876  -2.327
   29    HB2  LEU   4           HB2      LEU   4  23.602  -0.681  -4.654
   30    HB3  LEU   4           HB1      LEU   4  24.222  -1.194  -3.086
   31    HG   LEU   4           HG       LEU   4  23.147  -3.591  -4.048
   32   HD11  LEU   4          HD11      LEU   4  24.137  -3.807  -6.369
   33   HD12  LEU   4          HD12      LEU   4  24.217  -2.050  -6.421
   34   HD13  LEU   4          HD13      LEU   4  22.668  -2.860  -6.243
   35   HD21  LEU   4          HD21      LEU   4  25.347  -3.463  -3.035
   36   HD22  LEU   4          HD22      LEU   4  25.963  -2.500  -4.379
   37   HD23  LEU   4          HD23      LEU   4  25.525  -4.190  -4.634
   38    H    ALA   5           HN       ALA   5  20.763   0.005  -4.893
   39    HA   ALA   5           HA       ALA   5  21.266   2.625  -4.170
   40    HB1  ALA   5           HB1      ALA   5  19.966   1.728  -6.181
   41    HB2  ALA   5           HB2      ALA   5  19.350   3.207  -5.445
   42    HB3  ALA   5           HB3      ALA   5  18.565   1.662  -5.111
   43    H    LEU   6           HN       LEU   6  19.718   0.269  -2.320
   44    HA   LEU   6           HA       LEU   6  17.961   2.060  -0.861
   45    HB2  LEU   6           HB2      LEU   6  18.666  -0.838  -0.397
   46    HB3  LEU   6           HB1      LEU   6  17.384   0.055   0.415
   47    HG   LEU   6           HG       LEU   6  17.447  -0.131  -2.601
   48   HD11  LEU   6          HD11      LEU   6  17.538  -2.442  -1.690
   49   HD12  LEU   6          HD12      LEU   6  16.003  -2.098  -2.488
   50   HD13  LEU   6          HD13      LEU   6  16.101  -2.098  -0.727
   51   HD21  LEU   6          HD21      LEU   6  14.951   0.077  -2.239
   52   HD22  LEU   6          HD22      LEU   6  15.866   1.480  -1.701
   53   HD23  LEU   6          HD23      LEU   6  15.269   0.313  -0.523
   54    H    ALA   7           HN       ALA   7  21.165   0.713  -0.577
   55    HA   ALA   7           HA       ALA   7  21.504   0.952   2.202
   56    HB1  ALA   7           HB1      ALA   7  23.426  -0.102   1.549
   57    HB2  ALA   7           HB2      ALA   7  24.047   1.461   1.024
   58    HB3  ALA   7           HB3      ALA   7  23.188   0.426  -0.113
   59    HA   PRO   8           HA       PRO   8  23.476   5.434   1.080
   60    HB2  PRO   8           HB2      PRO   8  21.258   5.860  -0.912
   61    HB3  PRO   8           HB1      PRO   8  22.857   6.629  -0.830
   62    HG2  PRO   8           HG2      PRO   8  22.448   4.675  -2.537
   63    HG3  PRO   8           HG1      PRO   8  23.964   4.738  -1.608
   64    HD2  PRO   8           HD2      PRO   8  21.645   2.891  -1.260
   65    HD3  PRO   8           HD1      PRO   8  23.361   2.621  -0.895
   66    H    ALA   9           HN       ALA   9  19.992   4.900   0.627
   67    HA   ALA   9           HA       ALA   9  19.112   7.057   2.218
   68    HB1  ALA   9           HB1      ALA   9  17.707   5.843   0.555
   69    HB2  ALA   9           HB2      ALA   9  16.929   6.021   2.128
   70    HB3  ALA   9           HB3      ALA   9  17.641   4.475   1.667
   71    H    LEU  10           HN       LEU  10  20.238   3.872   3.049
   72    HA   LEU  10           HA       LEU  10  19.191   3.988   5.746
   73    HB2  LEU  10           HB2      LEU  10  19.048   1.755   5.182
   74    HB3  LEU  10           HB1      LEU  10  20.205   1.949   3.883
   75    HG   LEU  10           HG       LEU  10  22.034   1.893   5.663
   76   HD11  LEU  10          HD11      LEU  10  20.026   0.557   7.478
   77   HD12  LEU  10          HD12      LEU  10  20.141   2.308   7.511
   78   HD13  LEU  10          HD13      LEU  10  21.557   1.332   7.878
   79   HD21  LEU  10          HD21      LEU  10  20.189  -0.445   5.134
   80   HD22  LEU  10          HD22      LEU  10  21.726  -0.632   5.980
   81   HD23  LEU  10          HD23      LEU  10  21.702  -0.044   4.318
   82    H    ALA  11           HN       ALA  11  21.757   5.035   4.039
   83    HA   ALA  11           HA       ALA  11  24.005   4.752   5.601
   84    HB1  ALA  11           HB1      ALA  11  23.242   7.338   4.238
   85    HB2  ALA  11           HB2      ALA  11  23.897   5.936   3.389
   86    HB3  ALA  11           HB3      ALA  11  24.867   6.761   4.608
   87    H    LEU  12           HN       LEU  12  21.188   6.718   6.219
   88    HA   LEU  12           HA       LEU  12  22.374   8.348   8.230
   89    HB2  LEU  12           HB2      LEU  12  19.445   7.645   8.116
   90    HB3  LEU  12           HB1      LEU  12  20.196   9.143   8.669
   91    HG   LEU  12           HG       LEU  12  20.101   8.124   5.816
   92   HD11  LEU  12          HD11      LEU  12  17.994   9.108   6.604
   93   HD12  LEU  12          HD12      LEU  12  18.775  10.190   5.452
   94   HD13  LEU  12          HD13      LEU  12  18.857  10.533   7.180
   95   HD21  LEU  12          HD21      LEU  12  21.131  10.448   5.390
   96   HD22  LEU  12          HD22      LEU  12  22.206   9.224   6.061
   97   HD23  LEU  12          HD23      LEU  12  21.523  10.467   7.110
   98    H    ALA  13           HN       ALA  13  19.988   5.704   8.572
   99    HA   ALA  13           HA       ALA  13  20.391   5.417  11.340
  100    HB1  ALA  13           HB1      ALA  13  18.433   4.390  10.571
  101    HB2  ALA  13           HB2      ALA  13  19.487   3.004  10.850
  102    HB3  ALA  13           HB3      ALA  13  19.252   3.622   9.216
  103    H    LEU  14           HN       LEU  14  22.092   4.105   8.546
  104    HA   LEU  14           HA       LEU  14  23.534   2.083   9.802
  105    HB2  LEU  14           HB2      LEU  14  23.479   2.700   7.323
  106    HB3  LEU  14           HB1      LEU  14  24.663   3.943   7.698
  107    HG   LEU  14           HG       LEU  14  25.282   1.137   8.626
  108   HD11  LEU  14          HD11      LEU  14  24.518   0.735   6.342
  109   HD12  LEU  14          HD12      LEU  14  26.272   0.577   6.429
  110   HD13  LEU  14          HD13      LEU  14  25.552   2.034   5.747
  111   HD21  LEU  14          HD21      LEU  14  27.581   1.831   8.033
  112   HD22  LEU  14          HD22      LEU  14  26.837   3.019   9.098
  113   HD23  LEU  14          HD23      LEU  14  26.959   3.342   7.372
  114    H    ALA  15           HN       ALA  15  24.286   5.540   9.488
  115    HA   ALA  15           HA       ALA  15  26.716   5.501  10.884
  116    HB1  ALA  15           HB1      ALA  15  26.414   7.869  11.183
  117    HB2  ALA  15           HB2      ALA  15  24.669   7.728  10.970
  118    HB3  ALA  15           HB3      ALA  15  25.749   7.451   9.604
  119    H    LEU  16           HN       LEU  16  23.432   5.231  11.952
  120    HA   LEU  16           HA       LEU  16  23.881   5.922  14.671
  121    HB2  LEU  16           HB2      LEU  16  21.656   5.831  13.275
  122    HB3  LEU  16           HB1      LEU  16  21.599   4.166  13.834
  123    HG   LEU  16           HG       LEU  16  21.746   6.649  15.576
  124   HD11  LEU  16          HD11      LEU  16  19.510   5.952  16.303
  125   HD12  LEU  16          HD12      LEU  16  19.584   4.545  15.243
  126   HD13  LEU  16          HD13      LEU  16  19.534   6.168  14.553
  127   HD21  LEU  16          HD21      LEU  16  21.913   3.690  16.208
  128   HD22  LEU  16          HD22      LEU  16  21.354   4.854  17.410
  129   HD23  LEU  16          HD23      LEU  16  22.981   4.986  16.748
  130    H    TRP  17           HN       TRP  17  22.945   2.678  13.393
  131    HA   TRP  17           HA       TRP  17  23.971   1.456  15.778
  132    HB2  TRP  17           HB2      TRP  17  23.461  -0.690  14.581
  133    HB3  TRP  17           HB1      TRP  17  22.106   0.393  14.841
  134    HD1  TRP  17           HD1      TRP  17  21.228   1.768  12.676
  135    HE1  TRP  17           HE1      TRP  17  21.310   1.145  10.173
  136    HE3  TRP  17           HE3      TRP  17  24.803  -1.881  12.779
  137    HZ2  TRP  17           HZ2      TRP  17  22.698  -0.648   8.451
  138    HZ3  TRP  17           HZ3      TRP  17  25.485  -3.030  10.691
  139    HH2  TRP  17           HH2      TRP  17  24.438  -2.419   8.527
  140    H    TRP  18           HN       TRP  18  25.157   1.635  12.442
  141    HA   TRP  18           HA       TRP  18  27.257  -0.174  12.624
  142    HB2  TRP  18           HB2      TRP  18  26.545   1.235  10.595
  143    HB3  TRP  18           HB1      TRP  18  27.565   2.507  11.261
  144    HD1  TRP  18           HD1      TRP  18  27.819  -1.174  10.137
  145    HE1  TRP  18           HE1      TRP  18  30.222  -1.596   9.295
  146    HE3  TRP  18           HE3      TRP  18  29.935   3.352  11.192
  147    HZ2  TRP  18           HZ2      TRP  18  32.699  -0.207   9.096
  148    HZ3  TRP  18           HZ3      TRP  18  32.320   3.775  10.665
  149    HH2  TRP  18           HH2      TRP  18  33.705   2.003   9.619
  150    H    ALA  19           HN       ALA  19  27.314   3.298  13.354
  151    HA   ALA  19           HA       ALA  19  29.893   3.069  14.687
  152    HB1  ALA  19           HB1      ALA  19  28.188   5.545  14.532
  153    HB2  ALA  19           HB2      ALA  19  29.186   5.020  13.177
  154    HB3  ALA  19           HB3      ALA  19  29.939   5.428  14.718
  155    HA1  ETA  20           HA1      ETA  20  27.763   1.889  18.411
  156    HA2  ETA  20           HA2      ETA  20  26.188   1.602  17.673
  157    H2   ETA  20           HN       ETA  20  27.408   1.814  15.711
  158    HB1  ETA  20           HB1      ETA  20  26.194   4.260  17.479
  159    HB2  ETA  20           HB2      ETA  20  27.305   4.131  18.836
  160    HO   ETA  20           HG       ETA  20  25.506   2.479  19.502
  Start of MODEL    5
    1    H1   ACE   0           HA2      ACE   0  22.769  -6.298  -5.871
    2    H2   ACE   0           HA3      ACE   0  24.374  -6.311  -6.604
    3    H3   ACE   0           HA1      ACE   0  23.207  -7.568  -7.012
    4    H    GLY   1           HN       GLY   1  21.884  -4.423  -6.647
    5    HA2  GLY   1           HA2      GLY   1  22.272  -3.492  -9.322
    6    HA3  GLY   1           HA1      GLY   1  20.690  -4.231  -9.080
    7    H    TRP   2           HN       TRP   2  19.372  -2.637  -9.003
    8    HA   TRP   2           HA       TRP   2  19.915  -0.111  -7.807
    9    HB2  TRP   2           HB2      TRP   2  17.227   0.008  -8.114
   10    HB3  TRP   2           HB1      TRP   2  18.334   0.257  -9.461
   11    HD1  TRP   2           HD1      TRP   2  17.622  -3.015  -7.811
   12    HE1  TRP   2           HE1      TRP   2  16.568  -4.656  -9.515
   13    HE3  TRP   2           HE3      TRP   2  17.053   0.132 -11.736
   14    HZ2  TRP   2           HZ2      TRP   2  15.608  -4.600 -12.204
   15    HZ3  TRP   2           HZ3      TRP   2  16.067  -0.663 -13.868
   16    HH2  TRP   2           HH2      TRP   2  15.342  -3.024 -14.108
   17    H    TRP   3           HN       TRP   3  19.781  -2.873  -6.333
   18    HA   TRP   3           HA       TRP   3  17.870  -2.340  -4.251
   19    HB2  TRP   3           HB2      TRP   3  20.081  -4.336  -3.949
   20    HB3  TRP   3           HB1      TRP   3  18.440  -4.408  -3.322
   21    HD1  TRP   3           HD1      TRP   3  20.415  -6.121  -5.663
   22    HE1  TRP   3           HE1      TRP   3  19.067  -7.098  -7.625
   23    HE3  TRP   3           HE3      TRP   3  16.105  -3.439  -5.195
   24    HZ2  TRP   3           HZ2      TRP   3  16.509  -6.788  -8.827
   25    HZ3  TRP   3           HZ3      TRP   3  14.246  -3.787  -6.748
   26    HH2  TRP   3           HH2      TRP   3  14.422  -5.461  -8.575
   27    H    LEU   4           HN       LEU   4  21.382  -2.599  -4.365
   28    HA   LEU   4           HA       LEU   4  21.934  -1.669  -1.817
   29    HB2  LEU   4           HB2      LEU   4  23.665  -0.952  -4.187
   30    HB3  LEU   4           HB1      LEU   4  24.155  -1.301  -2.531
   31    HG   LEU   4           HG       LEU   4  22.889  -3.696  -3.230
   32   HD11  LEU   4          HD11      LEU   4  24.219  -2.601  -5.718
   33   HD12  LEU   4          HD12      LEU   4  22.587  -3.227  -5.528
   34   HD13  LEU   4          HD13      LEU   4  23.951  -4.320  -5.441
   35   HD21  LEU   4          HD21      LEU   4  25.812  -2.930  -3.542
   36   HD22  LEU   4          HD22      LEU   4  25.218  -4.590  -3.592
   37   HD23  LEU   4          HD23      LEU   4  25.044  -3.636  -2.119
   38    H    ALA   5           HN       ALA   5  20.926  -0.036  -4.684
   39    HA   ALA   5           HA       ALA   5  21.660   2.598  -4.274
   40    HB1  ALA   5           HB1      ALA   5  20.367   1.565  -6.227
   41    HB2  ALA   5           HB2      ALA   5  19.876   3.183  -5.726
   42    HB3  ALA   5           HB3      ALA   5  18.919   1.781  -5.242
   43    H    LEU   6           HN       LEU   6  19.800   0.662  -2.236
   44    HA   LEU   6           HA       LEU   6  18.187   2.799  -1.106
   45    HB2  LEU   6           HB2      LEU   6  18.503  -0.086  -0.276
   46    HB3  LEU   6           HB1      LEU   6  17.294   1.042   0.330
   47    HG   LEU   6           HG       LEU   6  17.518   0.465  -2.629
   48   HD11  LEU   6          HD11      LEU   6  17.248  -1.704  -1.484
   49   HD12  LEU   6          HD12      LEU   6  15.785  -1.260  -2.362
   50   HD13  LEU   6          HD13      LEU   6  15.854  -1.068  -0.611
   51   HD21  LEU   6          HD21      LEU   6  15.050   1.020  -2.485
   52   HD22  LEU   6          HD22      LEU   6  16.110   2.362  -2.067
   53   HD23  LEU   6          HD23      LEU   6  15.298   1.449  -0.796
   54    H    ALA   7           HN       ALA   7  21.164   1.087  -0.452
   55    HA   ALA   7           HA       ALA   7  21.407   1.578   2.291
   56    HB1  ALA   7           HB1      ALA   7  23.253   0.302   1.849
   57    HB2  ALA   7           HB2      ALA   7  24.041   1.740   1.202
   58    HB3  ALA   7           HB3      ALA   7  23.134   0.677   0.133
   59    HA   PRO   8           HA       PRO   8  23.855   5.727   0.895
   60    HB2  PRO   8           HB2      PRO   8  21.783   6.187  -1.239
   61    HB3  PRO   8           HB1      PRO   8  23.446   6.802  -1.138
   62    HG2  PRO   8           HG2      PRO   8  22.928   4.755  -2.693
   63    HG3  PRO   8           HG1      PRO   8  24.391   4.747  -1.681
   64    HD2  PRO   8           HD2      PRO   8  21.867   3.193  -1.316
   65    HD3  PRO   8           HD1      PRO   8  23.526   2.767  -0.845
   66    H    ALA   9           HN       ALA   9  20.360   5.497   0.309
   67    HA   ALA   9           HA       ALA   9  19.688   7.850   1.759
   68    HB1  ALA   9           HB1      ALA   9  18.290   6.798  -0.045
   69    HB2  ALA   9           HB2      ALA   9  17.402   7.209   1.423
   70    HB3  ALA   9           HB3      ALA   9  17.863   5.535   1.110
   71    H    LEU  10           HN       LEU  10  20.083   4.487   2.649
   72    HA   LEU  10           HA       LEU  10  18.891   4.846   5.257
   73    HB2  LEU  10           HB2      LEU  10  18.346   2.690   4.623
   74    HB3  LEU  10           HB1      LEU  10  19.672   2.618   3.481
   75    HG   LEU  10           HG       LEU  10  21.226   2.212   5.421
   76   HD11  LEU  10          HD11      LEU  10  19.270   3.139   7.059
   77   HD12  LEU  10          HD12      LEU  10  20.465   1.969   7.605
   78   HD13  LEU  10          HD13      LEU  10  18.864   1.422   7.120
   79   HD21  LEU  10          HD21      LEU  10  18.935   0.318   4.842
   80   HD22  LEU  10          HD22      LEU  10  20.357  -0.158   5.768
   81   HD23  LEU  10          HD23      LEU  10  20.530   0.348   4.088
   82    H    ALA  11           HN       ALA  11  21.718   5.355   3.752
   83    HA   ALA  11           HA       ALA  11  23.784   4.654   5.413
   84    HB1  ALA  11           HB1      ALA  11  25.038   6.486   4.519
   85    HB2  ALA  11           HB2      ALA  11  23.569   7.381   4.135
   86    HB3  ALA  11           HB3      ALA  11  23.969   5.918   3.237
   87    H    LEU  12           HN       LEU  12  21.182   6.759   6.123
   88    HA   LEU  12           HA       LEU  12  22.482   8.325   8.126
   89    HB2  LEU  12           HB2      LEU  12  19.594   7.782   7.448
   90    HB3  LEU  12           HB1      LEU  12  20.041   8.736   8.861
   91    HG   LEU  12           HG       LEU  12  21.205  10.351   7.486
   92   HD11  LEU  12          HD11      LEU  12  21.036  10.031   4.927
   93   HD12  LEU  12          HD12      LEU  12  20.688   8.341   5.289
   94   HD13  LEU  12          HD13      LEU  12  22.224   9.050   5.785
   95   HD21  LEU  12          HD21      LEU  12  18.705  10.508   7.687
   96   HD22  LEU  12          HD22      LEU  12  18.568   9.648   6.154
   97   HD23  LEU  12          HD23      LEU  12  19.328  11.238   6.207
   98    H    ALA  13           HN       ALA  13  19.962   5.804   8.480
   99    HA   ALA  13           HA       ALA  13  20.382   5.426  11.225
  100    HB1  ALA  13           HB1      ALA  13  19.542   3.191   9.381
  101    HB2  ALA  13           HB2      ALA  13  18.456   4.524   9.772
  102    HB3  ALA  13           HB3      ALA  13  19.064   3.474  11.055
  103    H    LEU  14           HN       LEU  14  21.981   4.072   8.395
  104    HA   LEU  14           HA       LEU  14  23.388   2.000   9.588
  105    HB2  LEU  14           HB2      LEU  14  23.319   2.639   7.127
  106    HB3  LEU  14           HB1      LEU  14  24.527   3.864   7.492
  107    HG   LEU  14           HG       LEU  14  25.113   1.037   8.383
  108   HD11  LEU  14          HD11      LEU  14  26.149   0.597   6.124
  109   HD12  LEU  14          HD12      LEU  14  25.244   1.981   5.513
  110   HD13  LEU  14          HD13      LEU  14  24.386   0.576   6.147
  111   HD21  LEU  14          HD21      LEU  14  26.782   3.295   7.212
  112   HD22  LEU  14          HD22      LEU  14  27.423   1.727   7.694
  113   HD23  LEU  14          HD23      LEU  14  26.734   2.803   8.903
  114    H    ALA  15           HN       ALA  15  24.267   5.431   9.339
  115    HA   ALA  15           HA       ALA  15  26.713   5.255  10.705
  116    HB1  ALA  15           HB1      ALA  15  26.381   7.662  11.197
  117    HB2  ALA  15           HB2      ALA  15  24.711   7.528  10.646
  118    HB3  ALA  15           HB3      ALA  15  26.038   7.281   9.511
  119    H    LEU  16           HN       LEU  16  23.428   5.119  11.794
  120    HA   LEU  16           HA       LEU  16  23.934   5.739  14.522
  121    HB2  LEU  16           HB2      LEU  16  21.695   5.796  13.144
  122    HB3  LEU  16           HB1      LEU  16  21.551   4.127  13.678
  123    HG   LEU  16           HG       LEU  16  21.851   6.569  15.457
  124   HD11  LEU  16          HD11      LEU  16  19.587   5.927  16.218
  125   HD12  LEU  16          HD12      LEU  16  19.574   4.604  15.052
  126   HD13  LEU  16          HD13      LEU  16  19.607   6.275  14.489
  127   HD21  LEU  16          HD21      LEU  16  21.860   3.596  16.040
  128   HD22  LEU  16          HD22      LEU  16  21.379   4.769  17.266
  129   HD23  LEU  16          HD23      LEU  16  23.004   4.821  16.588
  130    H    TRP  17           HN       TRP  17  22.828   2.572  13.182
  131    HA   TRP  17           HA       TRP  17  23.788   1.255  15.545
  132    HB2  TRP  17           HB2      TRP  17  23.175  -0.840  14.319
  133    HB3  TRP  17           HB1      TRP  17  21.874   0.307  14.579
  134    HD1  TRP  17           HD1      TRP  17  21.040   1.700  12.426
  135    HE1  TRP  17           HE1      TRP  17  21.128   1.110   9.915
  136    HE3  TRP  17           HE3      TRP  17  24.532  -2.028  12.505
  137    HZ2  TRP  17           HZ2      TRP  17  22.489  -0.690   8.181
  138    HZ3  TRP  17           HZ3      TRP  17  25.204  -3.163  10.407
  139    HH2  TRP  17           HH2      TRP  17  24.189  -2.500   8.245
  140    H    TRP  18           HN       TRP  18  24.991   1.434  12.214
  141    HA   TRP  18           HA       TRP  18  26.999  -0.477  12.370
  142    HB2  TRP  18           HB2      TRP  18  26.365   0.998  10.362
  143    HB3  TRP  18           HB1      TRP  18  27.440   2.209  11.053
  144    HD1  TRP  18           HD1      TRP  18  27.531  -1.469   9.887
  145    HE1  TRP  18           HE1      TRP  18  29.914  -1.988   9.043
  146    HE3  TRP  18           HE3      TRP  18  29.842   2.949  10.984
  147    HZ2  TRP  18           HZ2      TRP  18  32.450  -0.708   8.858
  148    HZ3  TRP  18           HZ3      TRP  18  32.244   3.272  10.464
  149    HH2  TRP  18           HH2      TRP  18  33.551   1.451   9.402
  150    H    ALA  19           HN       ALA  19  27.222   2.975  13.161
  151    HA   ALA  19           HA       ALA  19  29.790   2.610  14.473
  152    HB1  ALA  19           HB1      ALA  19  29.911   4.968  14.594
  153    HB2  ALA  19           HB2      ALA  19  28.165   5.143  14.419
  154    HB3  ALA  19           HB3      ALA  19  29.142   4.635  13.042
  155    HA1  ETA  20           HA1      ETA  20  27.594   1.287  18.139
  156    HA2  ETA  20           HA2      ETA  20  25.987   1.253  17.418
  157    H2   ETA  20           HN       ETA  20  27.240   1.434  15.468
  158    HB1  ETA  20           HB1      ETA  20  27.432   3.521  18.766
  159    HB2  ETA  20           HB2      ETA  20  25.741   3.054  18.883
  160    HO   ETA  20           HG       ETA  20  26.737   4.914  17.346
  Start of MODEL    6
    1    H1   ACE   0           HA2      ACE   0  20.897  -5.773  -9.061
    2    H2   ACE   0           HA3      ACE   0  22.489  -5.937  -9.807
    3    H3   ACE   0           HA1      ACE   0  21.079  -6.676 -10.565
    4    H    GLY   1           HN       GLY   1  20.537  -3.589  -9.160
    5    HA2  GLY   1           HA2      GLY   1  21.266  -1.973 -11.400
    6    HA3  GLY   1           HA1      GLY   1  19.543  -2.344 -11.363
    7    H    TRP   2           HN       TRP   2  18.641  -0.591 -10.734
    8    HA   TRP   2           HA       TRP   2  19.711   1.205  -8.801
    9    HB2  TRP   2           HB2      TRP   2  17.148   2.064  -8.971
   10    HB3  TRP   2           HB1      TRP   2  18.348   2.457 -10.199
   11    HD1  TRP   2           HD1      TRP   2  16.794  -0.897  -9.673
   12    HE1  TRP   2           HE1      TRP   2  15.466  -1.599 -11.783
   13    HE3  TRP   2           HE3      TRP   2  17.191   3.381 -12.354
   14    HZ2  TRP   2           HZ2      TRP   2  14.684  -0.455 -14.281
   15    HZ3  TRP   2           HZ3      TRP   2  16.152   3.573 -14.598
   16    HH2  TRP   2           HH2      TRP   2  14.899   1.662 -15.565
   17    H    TRP   3           HN       TRP   3  18.850  -1.764  -8.294
   18    HA   TRP   3           HA       TRP   3  17.018  -1.481  -6.095
   19    HB2  TRP   3           HB2      TRP   3  18.671  -3.941  -6.524
   20    HB3  TRP   3           HB1      TRP   3  17.030  -3.811  -5.903
   21    HD1  TRP   3           HD1      TRP   3  18.655  -5.107  -8.732
   22    HE1  TRP   3           HE1      TRP   3  17.213  -5.046 -10.862
   23    HE3  TRP   3           HE3      TRP   3  15.091  -1.758  -7.290
   24    HZ2  TRP   3           HZ2      TRP   3  14.865  -3.757 -11.820
   25    HZ3  TRP   3           HZ3      TRP   3  13.283  -1.130  -8.815
   26    HH2  TRP   3           HH2      TRP   3  13.145  -2.119 -11.089
   27    H    LEU   4           HN       LEU   4  20.366  -2.541  -6.390
   28    HA   LEU   4           HA       LEU   4  20.990  -2.639  -3.695
   29    HB2  LEU   4           HB2      LEU   4  22.971  -1.649  -5.752
   30    HB3  LEU   4           HB1      LEU   4  23.267  -2.626  -4.316
   31    HG   LEU   4           HG       LEU   4  21.497  -4.271  -5.724
   32   HD11  LEU   4          HD11      LEU   4  23.189  -2.797  -7.753
   33   HD12  LEU   4          HD12      LEU   4  21.447  -3.023  -7.731
   34   HD13  LEU   4          HD13      LEU   4  22.494  -4.389  -8.045
   35   HD21  LEU   4          HD21      LEU   4  23.537  -5.112  -4.715
   36   HD22  LEU   4          HD22      LEU   4  24.531  -4.198  -5.850
   37   HD23  LEU   4          HD23      LEU   4  23.554  -5.549  -6.425
   38    H    ALA   5           HN       ALA   5  20.556   0.019  -5.849
   39    HA   ALA   5           HA       ALA   5  21.884   2.121  -4.643
   40    HB1  ALA   5           HB1      ALA   5  20.480   2.114  -6.779
   41    HB2  ALA   5           HB2      ALA   5  20.363   3.555  -5.769
   42    HB3  ALA   5           HB3      ALA   5  19.078   2.346  -5.733
   43    H    LEU   6           HN       LEU   6  19.460   0.180  -3.289
   44    HA   LEU   6           HA       LEU   6  18.348   2.177  -1.517
   45    HB2  LEU   6           HB2      LEU   6  18.024  -0.825  -1.571
   46    HB3  LEU   6           HB1      LEU   6  17.069   0.299  -0.607
   47    HG   LEU   6           HG       LEU   6  17.234   0.618  -3.609
   48   HD11  LEU   6          HD11      LEU   6  15.254  -1.107  -2.091
   49   HD12  LEU   6          HD12      LEU   6  16.506  -1.699  -3.183
   50   HD13  LEU   6          HD13      LEU   6  15.178  -0.724  -3.811
   51   HD21  LEU   6          HD21      LEU   6  16.225   2.485  -2.425
   52   HD22  LEU   6          HD22      LEU   6  15.210   1.401  -1.476
   53   HD23  LEU   6          HD23      LEU   6  14.929   1.583  -3.203
   54    H    ALA   7           HN       ALA   7  20.921  -0.171  -1.472
   55    HA   ALA   7           HA       ALA   7  21.145  -0.518   1.312
   56    HB1  ALA   7           HB1      ALA   7  23.780  -0.719   0.279
   57    HB2  ALA   7           HB2      ALA   7  22.725  -1.177  -1.053
   58    HB3  ALA   7           HB3      ALA   7  22.626  -2.045   0.470
   59    HA   PRO   8           HA       PRO   8  24.582   3.166   0.949
   60    HB2  PRO   8           HB2      PRO   8  22.662   4.560  -0.905
   61    HB3  PRO   8           HB1      PRO   8  24.403   4.812  -0.701
   62    HG2  PRO   8           HG2      PRO   8  23.555   3.369  -2.710
   63    HG3  PRO   8           HG1      PRO   8  24.964   2.821  -1.770
   64    HD2  PRO   8           HD2      PRO   8  22.193   1.718  -1.774
   65    HD3  PRO   8           HD1      PRO   8  23.727   0.899  -1.414
   66    H    ALA   9           HN       ALA   9  21.114   3.544   0.663
   67    HA   ALA   9           HA       ALA   9  20.700   5.762   2.300
   68    HB1  ALA   9           HB1      ALA   9  18.400   5.065   2.436
   69    HB2  ALA   9           HB2      ALA   9  18.830   3.412   1.996
   70    HB3  ALA   9           HB3      ALA   9  18.996   4.711   0.815
   71    H    LEU  10           HN       LEU  10  22.031   2.824   3.282
   72    HA   LEU  10           HA       LEU  10  20.773   2.675   5.846
   73    HB2  LEU  10           HB2      LEU  10  21.956   0.706   6.168
   74    HB3  LEU  10           HB1      LEU  10  21.939   0.783   4.418
   75    HG   LEU  10           HG       LEU  10  24.223   1.742   6.167
   76   HD11  LEU  10          HD11      LEU  10  23.865  -0.709   6.244
   77   HD12  LEU  10          HD12      LEU  10  25.388  -0.263   5.473
   78   HD13  LEU  10          HD13      LEU  10  24.011  -0.754   4.487
   79   HD21  LEU  10          HD21      LEU  10  25.449   2.091   4.169
   80   HD22  LEU  10          HD22      LEU  10  23.866   2.762   3.810
   81   HD23  LEU  10          HD23      LEU  10  24.302   1.170   3.199
   82    H    ALA  11           HN       ALA  11  22.965   4.579   4.475
   83    HA   ALA  11           HA       ALA  11  24.967   5.136   6.271
   84    HB1  ALA  11           HB1      ALA  11  24.957   7.439   5.425
   85    HB2  ALA  11           HB2      ALA  11  23.351   7.188   4.739
   86    HB3  ALA  11           HB3      ALA  11  24.731   6.290   4.106
   87    H    LEU  12           HN       LEU  12  21.562   5.923   6.511
   88    HA   LEU  12           HA       LEU  12  21.820   7.714   8.713
   89    HB2  LEU  12           HB2      LEU  12  19.821   7.836   7.377
   90    HB3  LEU  12           HB1      LEU  12  19.482   6.127   7.634
   91    HG   LEU  12           HG       LEU  12  19.004   6.495   9.973
   92   HD11  LEU  12          HD11      LEU  12  20.123   9.249   9.423
   93   HD12  LEU  12          HD12      LEU  12  20.601   8.101  10.673
   94   HD13  LEU  12          HD13      LEU  12  19.064   8.952  10.801
   95   HD21  LEU  12          HD21      LEU  12  17.742   8.768   8.407
   96   HD22  LEU  12          HD22      LEU  12  17.053   7.920   9.791
   97   HD23  LEU  12          HD23      LEU  12  17.249   7.083   8.252
   98    H    ALA  13           HN       ALA  13  20.722   4.323   8.477
   99    HA   ALA  13           HA       ALA  13  20.548   3.856  11.239
  100    HB1  ALA  13           HB1      ALA  13  19.562   2.243   9.781
  101    HB2  ALA  13           HB2      ALA  13  20.905   1.425  10.583
  102    HB3  ALA  13           HB3      ALA  13  21.083   1.992   8.922
  103    H    LEU  14           HN       LEU  14  23.247   3.682   8.977
  104    HA   LEU  14           HA       LEU  14  25.112   2.391  10.571
  105    HB2  LEU  14           HB2      LEU  14  25.362   3.127   8.154
  106    HB3  LEU  14           HB1      LEU  14  25.727   4.738   8.759
  107    HG   LEU  14           HG       LEU  14  27.326   2.439   9.895
  108   HD11  LEU  14          HD11      LEU  14  28.943   2.594   8.022
  109   HD12  LEU  14          HD12      LEU  14  27.801   3.611   7.143
  110   HD13  LEU  14          HD13      LEU  14  27.388   1.937   7.511
  111   HD21  LEU  14          HD21      LEU  14  27.980   5.296   9.080
  112   HD22  LEU  14          HD22      LEU  14  29.136   4.168   9.784
  113   HD23  LEU  14          HD23      LEU  14  27.752   4.709  10.725
  114    H    ALA  15           HN       ALA  15  24.367   5.859  10.410
  115    HA   ALA  15           HA       ALA  15  26.186   6.694  12.372
  116    HB1  ALA  15           HB1      ALA  15  24.884   8.225  10.897
  117    HB2  ALA  15           HB2      ALA  15  24.784   8.671  12.600
  118    HB3  ALA  15           HB3      ALA  15  23.435   7.840  11.827
  119    H    LEU  16           HN       LEU  16  23.170   4.999  12.586
  120    HA   LEU  16           HA       LEU  16  22.637   5.559  15.319
  121    HB2  LEU  16           HB2      LEU  16  21.055   4.677  13.409
  122    HB3  LEU  16           HB1      LEU  16  21.578   3.097  13.974
  123    HG   LEU  16           HG       LEU  16  20.242   5.258  15.635
  124   HD11  LEU  16          HD11      LEU  16  18.773   3.950  14.096
  125   HD12  LEU  16          HD12      LEU  16  18.409   3.653  15.796
  126   HD13  LEU  16          HD13      LEU  16  19.329   2.467  14.870
  127   HD21  LEU  16          HD21      LEU  16  21.502   2.602  16.369
  128   HD22  LEU  16          HD22      LEU  16  20.243   3.330  17.367
  129   HD23  LEU  16          HD23      LEU  16  21.765   4.179  17.114
  130    H    TRP  17           HN       TRP  17  23.507   2.355  13.893
  131    HA   TRP  17           HA       TRP  17  24.360   1.450  16.479
  132    HB2  TRP  17           HB2      TRP  17  25.116  -0.587  15.229
  133    HB3  TRP  17           HB1      TRP  17  23.410  -0.199  15.113
  134    HD1  TRP  17           HD1      TRP  17  22.564   0.845  12.768
  135    HE1  TRP  17           HE1      TRP  17  23.503   0.558  10.383
  136    HE3  TRP  17           HE3      TRP  17  27.243  -0.897  13.852
  137    HZ2  TRP  17           HZ2      TRP  17  25.903  -0.291   9.108
  138    HZ3  TRP  17           HZ3      TRP  17  28.834  -1.437  12.031
  139    HH2  TRP  17           HH2      TRP  17  28.171  -1.137   9.660
  140    H    TRP  18           HN       TRP  18  26.104   2.427  13.552
  141    HA   TRP  18           HA       TRP  18  28.670   1.658  14.285
  142    HB2  TRP  18           HB2      TRP  18  27.926   2.824  12.124
  143    HB3  TRP  18           HB1      TRP  18  28.092   4.337  13.010
  144    HD1  TRP  18           HD1      TRP  18  30.185   1.265  11.998
  145    HE1  TRP  18           HE1      TRP  18  32.657   1.989  11.832
  146    HE3  TRP  18           HE3      TRP  18  29.806   6.093  13.615
  147    HZ2  TRP  18           HZ2      TRP  18  34.253   4.296  12.319
  148    HZ3  TRP  18           HZ3      TRP  18  31.819   7.532  13.755
  149    HH2  TRP  18           HH2      TRP  18  34.042   6.641  13.110
  150    H    ALA  19           HN       ALA  19  27.052   4.739  14.955
  151    HA   ALA  19           HA       ALA  19  29.053   5.434  16.977
  152    HB1  ALA  19           HB1      ALA  19  28.186   7.077  15.211
  153    HB2  ALA  19           HB2      ALA  19  28.198   7.638  16.883
  154    HB3  ALA  19           HB3      ALA  19  26.689   7.104  16.143
  155    HA1  ETA  20           HA1      ETA  20  24.922   3.686  18.866
  156    HA2  ETA  20           HA2      ETA  20  26.236   3.988  20.002
  157    H2   ETA  20           HN       ETA  20  27.134   3.259  17.348
  158    HB1  ETA  20           HB1      ETA  20  25.620   1.436  18.494
  159    HB2  ETA  20           HB2      ETA  20  25.636   1.676  20.236
  160    HO   ETA  20           HG       ETA  20  27.661   1.243  20.227
  Start of MODEL    7
    1    H1   ACE   0           HA2      ACE   0  22.940  -5.946  -6.961
    2    H2   ACE   0           HA3      ACE   0  24.538  -5.795  -7.692
    3    H3   ACE   0           HA1      ACE   0  23.426  -7.040  -8.254
    4    H    GLY   1           HN       GLY   1  21.974  -4.024  -7.493
    5    HA2  GLY   1           HA2      GLY   1  22.302  -2.749 -10.030
    6    HA3  GLY   1           HA1      GLY   1  20.755  -3.581  -9.881
    7    H    TRP   2           HN       TRP   2  19.371  -2.067  -9.603
    8    HA   TRP   2           HA       TRP   2  19.813   0.309  -8.098
    9    HB2  TRP   2           HB2      TRP   2  17.121   0.350  -8.386
   10    HB3  TRP   2           HB1      TRP   2  18.207   0.813  -9.692
   11    HD1  TRP   2           HD1      TRP   2  17.647  -2.668  -8.467
   12    HE1  TRP   2           HE1      TRP   2  16.653  -4.126 -10.363
   13    HE3  TRP   2           HE3      TRP   2  16.914   0.921 -11.963
   14    HZ2  TRP   2           HZ2      TRP   2  15.670  -3.774 -13.021
   15    HZ3  TRP   2           HZ3      TRP   2  15.946   0.357 -14.177
   16    HH2  TRP   2           HH2      TRP   2  15.324  -1.984 -14.711
   17    H    TRP   3           HN       TRP   3  19.808  -2.618  -6.982
   18    HA   TRP   3           HA       TRP   3  17.887  -2.434  -4.848
   19    HB2  TRP   3           HB2      TRP   3  20.184  -4.357  -4.803
   20    HB3  TRP   3           HB1      TRP   3  18.550  -4.577  -4.188
   21    HD1  TRP   3           HD1      TRP   3  20.582  -5.896  -6.728
   22    HE1  TRP   3           HE1      TRP   3  19.265  -6.676  -8.795
   23    HE3  TRP   3           HE3      TRP   3  16.166  -3.482  -5.924
   24    HZ2  TRP   3           HZ2      TRP   3  16.689  -6.327  -9.948
   25    HZ3  TRP   3           HZ3      TRP   3  14.313  -3.712  -7.507
   26    HH2  TRP   3           HH2      TRP   3  14.550  -5.134  -9.530
   27    H    LEU   4           HN       LEU   4  21.408  -2.533  -4.992
   28    HA   LEU   4           HA       LEU   4  21.931  -1.907  -2.347
   29    HB2  LEU   4           HB2      LEU   4  23.623  -0.826  -4.604
   30    HB3  LEU   4           HB1      LEU   4  24.133  -1.368  -3.007
   31    HG   LEU   4           HG       LEU   4  22.957  -3.698  -4.011
   32   HD11  LEU   4          HD11      LEU   4  24.040  -3.990  -6.281
   33   HD12  LEU   4          HD12      LEU   4  24.236  -2.242  -6.335
   34   HD13  LEU   4          HD13      LEU   4  22.630  -2.949  -6.230
   35   HD21  LEU   4          HD21      LEU   4  25.111  -3.700  -2.896
   36   HD22  LEU   4          HD22      LEU   4  25.849  -2.789  -4.214
   37   HD23  LEU   4          HD23      LEU   4  25.317  -4.450  -4.480
   38    H    ALA   5           HN       ALA   5  20.845   0.029  -4.985
   39    HA   ALA   5           HA       ALA   5  21.473   2.619  -4.254
   40    HB1  ALA   5           HB1      ALA   5  19.657   3.306  -5.621
   41    HB2  ALA   5           HB2      ALA   5  18.765   1.814  -5.317
   42    HB3  ALA   5           HB3      ALA   5  20.216   1.786  -6.320
   43    H    LEU   6           HN       LEU   6  19.692   0.376  -2.471
   44    HA   LEU   6           HA       LEU   6  17.989   2.288  -1.103
   45    HB2  LEU   6           HB2      LEU   6  18.470  -0.650  -0.600
   46    HB3  LEU   6           HB1      LEU   6  17.211   0.334   0.141
   47    HG   LEU   6           HG       LEU   6  17.422   0.119  -2.867
   48   HD11  LEU   6          HD11      LEU   6  15.786  -1.723  -2.787
   49   HD12  LEU   6          HD12      LEU   6  15.890  -1.742  -1.027
   50   HD13  LEU   6          HD13      LEU   6  17.295  -2.183  -1.998
   51   HD21  LEU   6          HD21      LEU   6  14.930   0.507  -2.640
   52   HD22  LEU   6          HD22      LEU   6  15.915   1.849  -2.069
   53   HD23  LEU   6          HD23      LEU   6  15.175   0.742  -0.912
   54    H    ALA   7           HN       ALA   7  21.078   0.730  -0.662
   55    HA   ALA   7           HA       ALA   7  21.291   0.948   2.131
   56    HB1  ALA   7           HB1      ALA   7  23.174  -0.226   1.577
   57    HB2  ALA   7           HB2      ALA   7  23.918   1.293   1.080
   58    HB3  ALA   7           HB3      ALA   7  23.050   0.310  -0.096
   59    HA   PRO   8           HA       PRO   8  23.597   5.294   1.125
   60    HB2  PRO   8           HB2      PRO   8  21.527   5.867  -0.984
   61    HB3  PRO   8           HB1      PRO   8  23.168   6.523  -0.814
   62    HG2  PRO   8           HG2      PRO   8  22.719   4.600  -2.545
   63    HG3  PRO   8           HG1      PRO   8  24.182   4.558  -1.534
   64    HD2  PRO   8           HD2      PRO   8  21.721   2.882  -1.316
   65    HD3  PRO   8           HD1      PRO   8  23.394   2.488  -0.867
   66    H    ALA   9           HN       ALA   9  20.116   4.998   0.478
   67    HA   ALA   9           HA       ALA   9  19.302   7.213   2.027
   68    HB1  ALA   9           HB1      ALA   9  17.820   4.760   1.086
   69    HB2  ALA   9           HB2      ALA   9  17.799   6.375   0.377
   70    HB3  ALA   9           HB3      ALA   9  17.039   6.088   1.943
   71    H    LEU  10           HN       LEU  10  20.154   3.961   2.913
   72    HA   LEU  10           HA       LEU  10  18.919   4.136   5.525
   73    HB2  LEU  10           HB2      LEU  10  18.677   1.926   4.897
   74    HB3  LEU  10           HB1      LEU  10  19.986   2.043   3.740
   75    HG   LEU  10           HG       LEU  10  21.604   1.856   5.667
   76   HD11  LEU  10          HD11      LEU  10  19.540   2.478   7.322
   77   HD12  LEU  10          HD12      LEU  10  20.904   1.503   7.854
   78   HD13  LEU  10          HD13      LEU  10  19.400   0.719   7.380
   79   HD21  LEU  10          HD21      LEU  10  19.601  -0.355   5.130
   80   HD22  LEU  10          HD22      LEU  10  21.125  -0.609   5.979
   81   HD23  LEU  10          HD23      LEU  10  21.132  -0.071   4.300
   82    H    ALA  11           HN       ALA  11  21.656   5.043   4.025
   83    HA   ALA  11           HA       ALA  11  23.786   4.620   5.704
   84    HB1  ALA  11           HB1      ALA  11  23.170   7.264   4.367
   85    HB2  ALA  11           HB2      ALA  11  23.911   5.879   3.560
   86    HB3  ALA  11           HB3      ALA  11  24.755   6.686   4.882
   87    H    LEU  12           HN       LEU  12  20.915   6.345   6.398
   88    HA   LEU  12           HA       LEU  12  21.966   8.070   8.409
   89    HB2  LEU  12           HB2      LEU  12  19.858   8.663   7.426
   90    HB3  LEU  12           HB1      LEU  12  19.169   7.088   7.811
   91    HG   LEU  12           HG       LEU  12  19.172   7.572  10.170
   92   HD11  LEU  12          HD11      LEU  12  20.843   9.954   9.351
   93   HD12  LEU  12          HD12      LEU  12  21.223   8.707  10.538
   94   HD13  LEU  12          HD13      LEU  12  19.992   9.916  10.895
   95   HD21  LEU  12          HD21      LEU  12  17.326   8.560   8.839
   96   HD22  LEU  12          HD22      LEU  12  18.273  10.034   8.632
   97   HD23  LEU  12          HD23      LEU  12  17.715   9.562  10.238
   98    H    ALA  13           HN       ALA  13  19.843   5.204   8.747
   99    HA   ALA  13           HA       ALA  13  20.296   4.884  11.495
  100    HB1  ALA  13           HB1      ALA  13  18.535   3.712  10.024
  101    HB2  ALA  13           HB2      ALA  13  19.279   2.762  11.311
  102    HB3  ALA  13           HB3      ALA  13  19.809   2.552   9.644
  103    H    LEU  14           HN       LEU  14  22.086   3.761   8.673
  104    HA   LEU  14           HA       LEU  14  23.778   1.933   9.895
  105    HB2  LEU  14           HB2      LEU  14  23.620   2.517   7.425
  106    HB3  LEU  14           HB1      LEU  14  24.638   3.909   7.769
  107    HG   LEU  14           HG       LEU  14  25.620   1.206   8.701
  108   HD11  LEU  14          HD11      LEU  14  26.608   0.703   6.531
  109   HD12  LEU  14          HD12      LEU  14  25.858   2.136   5.829
  110   HD13  LEU  14          HD13      LEU  14  24.852   0.797   6.380
  111   HD21  LEU  14          HD21      LEU  14  26.974   3.188   9.202
  112   HD22  LEU  14          HD22      LEU  14  26.953   3.668   7.508
  113   HD23  LEU  14          HD23      LEU  14  27.810   2.210   8.000
  114    H    ALA  15           HN       ALA  15  24.135   5.452   9.604
  115    HA   ALA  15           HA       ALA  15  26.583   5.656  10.963
  116    HB1  ALA  15           HB1      ALA  15  26.004   7.989  11.320
  117    HB2  ALA  15           HB2      ALA  15  24.303   7.650  11.004
  118    HB3  ALA  15           HB3      ALA  15  25.485   7.514   9.703
  119    H    LEU  16           HN       LEU  16  23.352   5.062  12.061
  120    HA   LEU  16           HA       LEU  16  23.776   5.783  14.781
  121    HB2  LEU  16           HB2      LEU  16  21.537   5.539  13.437
  122    HB3  LEU  16           HB1      LEU  16  21.638   3.857  13.943
  123    HG   LEU  16           HG       LEU  16  22.066   4.922  16.351
  124   HD11  LEU  16          HD11      LEU  16  21.030   7.039  16.726
  125   HD12  LEU  16          HD12      LEU  16  20.334   7.071  15.107
  126   HD13  LEU  16          HD13      LEU  16  22.070   7.273  15.322
  127   HD21  LEU  16          HD21      LEU  16  20.151   3.513  15.938
  128   HD22  LEU  16          HD22      LEU  16  19.380   4.751  14.947
  129   HD23  LEU  16          HD23      LEU  16  19.543   4.991  16.686
  130    H    TRP  17           HN       TRP  17  23.124   2.482  13.472
  131    HA   TRP  17           HA       TRP  17  24.240   1.334  15.853
  132    HB2  TRP  17           HB2      TRP  17  23.926  -0.833  14.678
  133    HB3  TRP  17           HB1      TRP  17  22.474   0.131  14.866
  134    HD1  TRP  17           HD1      TRP  17  21.444   1.223  12.660
  135    HE1  TRP  17           HE1      TRP  17  21.723   0.615  10.168
  136    HE3  TRP  17           HE3      TRP  17  25.602  -1.733  12.921
  137    HZ2  TRP  17           HZ2      TRP  17  23.464  -0.912   8.514
  138    HZ3  TRP  17           HZ3      TRP  17  26.548  -2.753  10.870
  139    HH2  TRP  17           HH2      TRP  17  25.486  -2.346   8.666
  140    H    TRP  18           HN       TRP  18  25.425   1.626  12.521
  141    HA   TRP  18           HA       TRP  18  27.683   0.020  12.718
  142    HB2  TRP  18           HB2      TRP  18  26.855   1.365  10.684
  143    HB3  TRP  18           HB1      TRP  18  27.756   2.720  11.357
  144    HD1  TRP  18           HD1      TRP  18  28.317  -0.902  10.177
  145    HE1  TRP  18           HE1      TRP  18  30.758  -1.123   9.367
  146    HE3  TRP  18           HE3      TRP  18  30.071   3.739  11.379
  147    HZ2  TRP  18           HZ2      TRP  18  33.127   0.451   9.247
  148    HZ3  TRP  18           HZ3      TRP  18  32.426   4.352  10.906
  149    HH2  TRP  18           HH2      TRP  18  33.956   2.716   9.843
  150    H    ALA  19           HN       ALA  19  27.406   3.478  13.447
  151    HA   ALA  19           HA       ALA  19  29.961   3.462  14.874
  152    HB1  ALA  19           HB1      ALA  19  29.259   5.293  13.225
  153    HB2  ALA  19           HB2      ALA  19  29.874   5.824  14.790
  154    HB3  ALA  19           HB3      ALA  19  28.138   5.827  14.477
  155    HA1  ETA  20           HA1      ETA  20  26.103   3.236  17.834
  156    HA2  ETA  20           HA2      ETA  20  27.686   3.053  18.593
  157    H2   ETA  20           HN       ETA  20  27.583   2.071  15.873
  158    HB1  ETA  20           HB1      ETA  20  25.824   0.911  17.558
  159    HB2  ETA  20           HB2      ETA  20  26.501   1.080  19.172
  160    HO   ETA  20           HG       ETA  20  28.199   0.763  16.962
  Start of MODEL    8
    1    H1   ACE   0           HA2      ACE   0  23.224  -5.517  -7.548
    2    H2   ACE   0           HA3      ACE   0  24.740  -5.151  -8.376
    3    H3   ACE   0           HA1      ACE   0  23.719  -6.471  -8.946
    4    H    GLY   1           HN       GLY   1  22.030  -3.681  -7.876
    5    HA2  GLY   1           HA2      GLY   1  22.031  -2.221 -10.332
    6    HA3  GLY   1           HA1      GLY   1  20.593  -3.220 -10.136
    7    H    TRP   2           HN       TRP   2  19.086  -1.885  -9.656
    8    HA   TRP   2           HA       TRP   2  19.398   0.425  -8.020
    9    HB2  TRP   2           HB2      TRP   2  16.702   0.197  -8.117
   10    HB3  TRP   2           HB1      TRP   2  17.633   0.857  -9.459
   11    HD1  TRP   2           HD1      TRP   2  17.521  -2.736  -8.447
   12    HE1  TRP   2           HE1      TRP   2  16.541  -4.168 -10.371
   13    HE3  TRP   2           HE3      TRP   2  16.176   0.970 -11.627
   14    HZ2  TRP   2           HZ2      TRP   2  15.336  -3.754 -12.927
   15    HZ3  TRP   2           HZ3      TRP   2  15.110   0.448 -13.804
   16    HH2  TRP   2           HH2      TRP   2  14.688  -1.907 -14.460
   17    H    TRP   3           HN       TRP   3  19.780  -2.548  -7.115
   18    HA   TRP   3           HA       TRP   3  18.017  -2.706  -4.846
   19    HB2  TRP   3           HB2      TRP   3  20.494  -4.373  -5.099
   20    HB3  TRP   3           HB1      TRP   3  18.943  -4.804  -4.388
   21    HD1  TRP   3           HD1      TRP   3  20.896  -5.734  -7.152
   22    HE1  TRP   3           HE1      TRP   3  19.508  -6.517  -9.172
   23    HE3  TRP   3           HE3      TRP   3  16.333  -3.861  -5.868
   24    HZ2  TRP   3           HZ2      TRP   3  16.827  -6.372 -10.113
   25    HZ3  TRP   3           HZ3      TRP   3  14.396  -4.185  -7.329
   26    HH2  TRP   3           HH2      TRP   3  14.617  -5.442  -9.459
   27    H    LEU   4           HN       LEU   4  21.508  -2.416  -5.244
   28    HA   LEU   4           HA       LEU   4  22.168  -1.911  -2.604
   29    HB2  LEU   4           HB2      LEU   4  23.561  -0.511  -4.890
   30    HB3  LEU   4           HB1      LEU   4  24.245  -1.094  -3.375
   31    HG   LEU   4           HG       LEU   4  23.244  -3.470  -4.458
   32   HD11  LEU   4          HD11      LEU   4  24.178  -1.738  -6.757
   33   HD12  LEU   4          HD12      LEU   4  22.669  -2.623  -6.589
   34   HD13  LEU   4          HD13      LEU   4  24.166  -3.499  -6.815
   35   HD21  LEU   4          HD21      LEU   4  25.468  -3.308  -3.503
   36   HD22  LEU   4          HD22      LEU   4  26.000  -2.240  -4.801
   37   HD23  LEU   4          HD23      LEU   4  25.625  -3.928  -5.147
   38    H    ALA   5           HN       ALA   5  20.686   0.061  -5.012
   39    HA   ALA   5           HA       ALA   5  21.098   2.654  -4.146
   40    HB1  ALA   5           HB1      ALA   5  18.414   1.628  -5.072
   41    HB2  ALA   5           HB2      ALA   5  19.779   1.820  -6.172
   42    HB3  ALA   5           HB3      ALA   5  19.123   3.223  -5.331
   43    H    LEU   6           HN       LEU   6  19.716   0.131  -2.389
   44    HA   LEU   6           HA       LEU   6  17.920   1.755  -0.789
   45    HB2  LEU   6           HB2      LEU   6  18.777  -1.126  -0.504
   46    HB3  LEU   6           HB1      LEU   6  17.481  -0.342   0.394
   47    HG   LEU   6           HG       LEU   6  17.455  -0.359  -2.630
   48   HD11  LEU   6          HD11      LEU   6  16.101  -2.399  -2.577
   49   HD12  LEU   6          HD12      LEU   6  16.284  -2.497  -0.826
   50   HD13  LEU   6          HD13      LEU   6  17.688  -2.709  -1.871
   51   HD21  LEU   6          HD21      LEU   6  14.965  -0.299  -2.185
   52   HD22  LEU   6          HD22      LEU   6  15.826   1.116  -1.589
   53   HD23  LEU   6          HD23      LEU   6  15.325  -0.147  -0.467
   54    H    ALA   7           HN       ALA   7  21.193   0.559  -0.669
   55    HA   ALA   7           HA       ALA   7  21.599   0.679   2.114
   56    HB1  ALA   7           HB1      ALA   7  23.539  -0.272   1.360
   57    HB2  ALA   7           HB2      ALA   7  24.086   1.336   0.889
   58    HB3  ALA   7           HB3      ALA   7  23.232   0.320  -0.270
   59    HA   PRO   8           HA       PRO   8  23.364   5.279   1.144
   60    HB2  PRO   8           HB2      PRO   8  21.083   5.710  -0.774
   61    HB3  PRO   8           HB1      PRO   8  22.655   6.531  -0.696
   62    HG2  PRO   8           HG2      PRO   8  22.271   4.641  -2.479
   63    HG3  PRO   8           HG1      PRO   8  23.808   4.720  -1.586
   64    HD2  PRO   8           HD2      PRO   8  21.567   2.774  -1.262
   65    HD3  PRO   8           HD1      PRO   8  23.302   2.553  -0.956
   66    H    ALA   9           HN       ALA   9  19.894   4.630   0.745
   67    HA   ALA   9           HA       ALA   9  18.954   6.677   2.431
   68    HB1  ALA   9           HB1      ALA   9  17.659   4.038   1.724
   69    HB2  ALA   9           HB2      ALA   9  17.502   5.548   0.826
   70    HB3  ALA   9           HB3      ALA   9  16.835   5.416   2.453
   71    H    LEU  10           HN       LEU  10  20.325   3.575   3.154
   72    HA   LEU  10           HA       LEU  10  19.319   3.529   5.868
   73    HB2  LEU  10           HB2      LEU  10  19.358   1.308   5.247
   74    HB3  LEU  10           HB1      LEU  10  20.469   1.633   3.936
   75    HG   LEU  10           HG       LEU  10  22.329   1.692   5.697
   76   HD11  LEU  10          HD11      LEU  10  20.446   0.131   7.470
   77   HD12  LEU  10          HD12      LEU  10  20.450   1.883   7.578
   78   HD13  LEU  10          HD13      LEU  10  21.929   0.985   7.891
   79   HD21  LEU  10          HD21      LEU  10  20.705  -0.817   5.194
   80   HD22  LEU  10          HD22      LEU  10  22.330  -0.827   5.878
   81   HD23  LEU  10          HD23      LEU  10  22.066  -0.219   4.245
   82    H    ALA  11           HN       ALA  11  21.760   4.834   4.153
   83    HA   ALA  11           HA       ALA  11  24.041   4.699   5.697
   84    HB1  ALA  11           HB1      ALA  11  23.848   5.889   3.503
   85    HB2  ALA  11           HB2      ALA  11  24.729   6.795   4.732
   86    HB3  ALA  11           HB3      ALA  11  23.061   7.221   4.352
   87    H    LEU  12           HN       LEU  12  21.098   6.486   6.322
   88    HA   LEU  12           HA       LEU  12  22.174   8.148   8.362
   89    HB2  LEU  12           HB2      LEU  12  19.916   8.341   7.039
   90    HB3  LEU  12           HB1      LEU  12  19.282   7.298   8.307
   91    HG   LEU  12           HG       LEU  12  20.710   9.934   8.783
   92   HD11  LEU  12          HD11      LEU  12  18.528  10.259   7.702
   93   HD12  LEU  12          HD12      LEU  12  18.457  10.768   9.389
   94   HD13  LEU  12          HD13      LEU  12  17.763   9.222   8.905
   95   HD21  LEU  12          HD21      LEU  12  19.555   9.550  11.098
   96   HD22  LEU  12          HD22      LEU  12  21.008   8.624  10.738
   97   HD23  LEU  12          HD23      LEU  12  19.423   7.865  10.586
   98    H    ALA  13           HN       ALA  13  19.983   5.329   8.641
   99    HA   ALA  13           HA       ALA  13  20.360   5.021  11.409
  100    HB1  ALA  13           HB1      ALA  13  19.429   3.167   9.234
  101    HB2  ALA  13           HB2      ALA  13  18.508   3.860  10.562
  102    HB3  ALA  13           HB3      ALA  13  19.660   2.561  10.874
  103    H    LEU  14           HN       LEU  14  22.190   3.842   8.628
  104    HA   LEU  14           HA       LEU  14  23.774   1.952   9.921
  105    HB2  LEU  14           HB2      LEU  14  23.693   2.481   7.439
  106    HB3  LEU  14           HB1      LEU  14  24.737   3.856   7.772
  107    HG   LEU  14           HG       LEU  14  25.639   1.160   8.794
  108   HD11  LEU  14          HD11      LEU  14  24.929   0.649   6.499
  109   HD12  LEU  14          HD12      LEU  14  26.687   0.617   6.635
  110   HD13  LEU  14          HD13      LEU  14  25.885   2.002   5.894
  111   HD21  LEU  14          HD21      LEU  14  27.048   3.552   7.549
  112   HD22  LEU  14          HD22      LEU  14  27.863   2.094   8.106
  113   HD23  LEU  14          HD23      LEU  14  27.028   3.127   9.259
  114    H    ALA  15           HN       ALA  15  24.261   5.452   9.560
  115    HA   ALA  15           HA       ALA  15  26.683   5.605  10.969
  116    HB1  ALA  15           HB1      ALA  15  25.664   7.468   9.644
  117    HB2  ALA  15           HB2      ALA  15  26.182   7.962  11.256
  118    HB3  ALA  15           HB3      ALA  15  24.473   7.675  10.929
  119    H    LEU  16           HN       LEU  16  23.413   5.145  12.007
  120    HA   LEU  16           HA       LEU  16  23.784   5.919  14.716
  121    HB2  LEU  16           HB2      LEU  16  21.587   5.662  13.304
  122    HB3  LEU  16           HB1      LEU  16  21.631   4.004  13.886
  123    HG   LEU  16           HG       LEU  16  21.606   6.511  15.597
  124   HD11  LEU  16          HD11      LEU  16  19.570   4.312  15.124
  125   HD12  LEU  16          HD12      LEU  16  19.427   6.000  14.634
  126   HD13  LEU  16          HD13      LEU  16  19.412   5.574  16.345
  127   HD21  LEU  16          HD21      LEU  16  22.911   4.938  16.812
  128   HD22  LEU  16          HD22      LEU  16  21.937   3.574  16.262
  129   HD23  LEU  16          HD23      LEU  16  21.282   4.707  17.444
  130    H    TRP  17           HN       TRP  17  23.105   2.597  13.470
  131    HA   TRP  17           HA       TRP  17  24.150   1.483  15.898
  132    HB2  TRP  17           HB2      TRP  17  23.814  -0.697  14.794
  133    HB3  TRP  17           HB1      TRP  17  22.375   0.302  14.869
  134    HD1  TRP  17           HD1      TRP  17  21.378   1.164  12.589
  135    HE1  TRP  17           HE1      TRP  17  21.814   0.497  10.135
  136    HE3  TRP  17           HE3      TRP  17  25.704  -1.496  13.142
  137    HZ2  TRP  17           HZ2      TRP  17  23.730  -0.960   8.615
  138    HZ3  TRP  17           HZ3      TRP  17  26.814  -2.513  11.172
  139    HH2  TRP  17           HH2      TRP  17  25.833  -2.249   8.909
  140    H    TRP  18           HN       TRP  18  25.407   1.680  12.586
  141    HA   TRP  18           HA       TRP  18  27.635   0.047  12.863
  142    HB2  TRP  18           HB2      TRP  18  26.870   1.345  10.780
  143    HB3  TRP  18           HB1      TRP  18  27.759   2.713  11.443
  144    HD1  TRP  18           HD1      TRP  18  28.331  -0.928  10.336
  145    HE1  TRP  18           HE1      TRP  18  30.794  -1.176   9.602
  146    HE3  TRP  18           HE3      TRP  18  30.084   3.715  11.533
  147    HZ2  TRP  18           HZ2      TRP  18  33.176   0.379   9.532
  148    HZ3  TRP  18           HZ3      TRP  18  32.456   4.305  11.122
  149    HH2  TRP  18           HH2      TRP  18  34.004   2.646  10.123
  150    H    ALA  19           HN       ALA  19  27.399   3.524  13.500
  151    HA   ALA  19           HA       ALA  19  29.905   3.479  15.026
  152    HB1  ALA  19           HB1      ALA  19  29.946   5.834  14.796
  153    HB2  ALA  19           HB2      ALA  19  28.233   5.901  14.383
  154    HB3  ALA  19           HB3      ALA  19  29.393   5.235  13.233
  155    HA1  ETA  20           HA1      ETA  20  26.087   2.210  17.877
  156    HA2  ETA  20           HA2      ETA  20  26.293   3.956  18.005
  157    H2   ETA  20           HN       ETA  20  27.450   2.252  16.003
  158    HB1  ETA  20           HB1      ETA  20  28.641   3.452  18.896
  159    HB2  ETA  20           HB2      ETA  20  28.114   1.781  19.048
  160    HO   ETA  20           HG       ETA  20  26.307   2.592  20.283
  Start of MODEL    9
    1    H1   ACE   0           HA2      ACE   0  22.799  -6.104  -6.676
    2    H2   ACE   0           HA3      ACE   0  24.414  -6.040  -7.384
    3    H3   ACE   0           HA1      ACE   0  23.263  -7.261  -7.924
    4    H    GLY   1           HN       GLY   1  21.906  -4.174  -7.291
    5    HA2  GLY   1           HA2      GLY   1  22.328  -2.995  -9.860
    6    HA3  GLY   1           HA1      GLY   1  20.750  -3.766  -9.716
    7    H    TRP   2           HN       TRP   2  19.413  -2.199  -9.510
    8    HA   TRP   2           HA       TRP   2  19.912   0.209  -8.077
    9    HB2  TRP   2           HB2      TRP   2  17.227   0.331  -8.412
   10    HB3  TRP   2           HB1      TRP   2  18.350   0.714  -9.714
   11    HD1  TRP   2           HD1      TRP   2  17.650  -2.703  -8.383
   12    HE1  TRP   2           HE1      TRP   2  16.639  -4.189 -10.248
   13    HE3  TRP   2           HE3      TRP   2  17.105   0.788 -12.012
   14    HZ2  TRP   2           HZ2      TRP   2  15.718  -3.895 -12.936
   15    HZ3  TRP   2           HZ3      TRP   2  16.160   0.183 -14.224
   16    HH2  TRP   2           HH2      TRP   2  15.466  -2.154 -14.691
   17    H    TRP   3           HN       TRP   3  19.789  -2.676  -6.865
   18    HA   TRP   3           HA       TRP   3  17.843  -2.356  -4.771
   19    HB2  TRP   3           HB2      TRP   3  20.071  -4.352  -4.624
   20    HB3  TRP   3           HB1      TRP   3  18.421  -4.496  -4.030
   21    HD1  TRP   3           HD1      TRP   3  20.448  -5.966  -6.492
   22    HE1  TRP   3           HE1      TRP   3  19.136  -6.770  -8.554
   23    HE3  TRP   3           HE3      TRP   3  16.102  -3.380  -5.838
   24    HZ2  TRP   3           HZ2      TRP   3  16.591  -6.373  -9.760
   25    HZ3  TRP   3           HZ3      TRP   3  14.269  -3.601  -7.444
   26    HH2  TRP   3           HH2      TRP   3  14.486  -5.096  -9.415
   27    H    LEU   4           HN       LEU   4  21.359  -2.574  -4.858
   28    HA   LEU   4           HA       LEU   4  21.867  -1.880  -2.226
   29    HB2  LEU   4           HB2      LEU   4  23.623  -0.932  -4.494
   30    HB3  LEU   4           HB1      LEU   4  24.095  -1.431  -2.872
   31    HG   LEU   4           HG       LEU   4  22.859  -3.758  -3.810
   32   HD11  LEU   4          HD11      LEU   4  22.585  -3.080  -6.058
   33   HD12  LEU   4          HD12      LEU   4  23.960  -4.165  -6.053
   34   HD13  LEU   4          HD13      LEU   4  24.213  -2.425  -6.165
   35   HD21  LEU   4          HD21      LEU   4  25.779  -2.946  -4.004
   36   HD22  LEU   4          HD22      LEU   4  25.201  -4.598  -4.219
   37   HD23  LEU   4          HD23      LEU   4  24.997  -3.788  -2.664
   38    H    ALA   5           HN       ALA   5  20.881   0.003  -4.943
   39    HA   ALA   5           HA       ALA   5  21.584   2.594  -4.283
   40    HB1  ALA   5           HB1      ALA   5  19.814   3.295  -5.701
   41    HB2  ALA   5           HB2      ALA   5  18.866   1.843  -5.363
   42    HB3  ALA   5           HB3      ALA   5  20.329   1.733  -6.341
   43    H    LEU   6           HN       LEU   6  19.721   0.464  -2.454
   44    HA   LEU   6           HA       LEU   6  18.056   2.466  -1.168
   45    HB2  LEU   6           HB2      LEU   6  18.431  -0.472  -0.583
   46    HB3  LEU   6           HB1      LEU   6  17.197   0.573   0.116
   47    HG   LEU   6           HG       LEU   6  17.437   0.277  -2.884
   48   HD11  LEU   6          HD11      LEU   6  17.229  -1.998  -1.906
   49   HD12  LEU   6          HD12      LEU   6  15.792  -1.528  -2.812
   50   HD13  LEU   6          HD13      LEU   6  15.778  -1.477  -1.049
   51   HD21  LEU   6          HD21      LEU   6  15.186   1.012  -0.973
   52   HD22  LEU   6          HD22      LEU   6  14.957   0.748  -2.698
   53   HD23  LEU   6          HD23      LEU   6  15.976   2.070  -2.143
   54    H    ALA   7           HN       ALA   7  21.082   0.813  -0.635
   55    HA   ALA   7           HA       ALA   7  21.272   1.087   2.148
   56    HB1  ALA   7           HB1      ALA   7  23.044   0.374  -0.045
   57    HB2  ALA   7           HB2      ALA   7  23.141  -0.130   1.636
   58    HB3  ALA   7           HB3      ALA   7  23.918   1.366   1.122
   59    HA   PRO   8           HA       PRO   8  23.673   5.369   1.091
   60    HB2  PRO   8           HB2      PRO   8  21.632   5.942  -1.046
   61    HB3  PRO   8           HB1      PRO   8  23.281   6.574  -0.871
   62    HG2  PRO   8           HG2      PRO   8  22.818   4.631  -2.573
   63    HG3  PRO   8           HG1      PRO   8  24.269   4.578  -1.544
   64    HD2  PRO   8           HD2      PRO   8  21.772   2.955  -1.326
   65    HD3  PRO   8           HD1      PRO   8  23.431   2.534  -0.855
   66    H    ALA   9           HN       ALA   9  20.190   5.131   0.424
   67    HA   ALA   9           HA       ALA   9  19.419   7.387   1.940
   68    HB1  ALA   9           HB1      ALA   9  17.794   4.956   1.173
   69    HB2  ALA   9           HB2      ALA   9  17.990   6.416   0.203
   70    HB3  ALA   9           HB3      ALA   9  17.141   6.490   1.747
   71    H    LEU  10           HN       LEU  10  20.154   4.111   2.850
   72    HA   LEU  10           HA       LEU  10  18.915   4.344   5.454
   73    HB2  LEU  10           HB2      LEU  10  18.595   2.139   4.849
   74    HB3  LEU  10           HB1      LEU  10  19.899   2.203   3.683
   75    HG   LEU  10           HG       LEU  10  21.521   1.968   5.605
   76   HD11  LEU  10          HD11      LEU  10  19.288   0.910   7.329
   77   HD12  LEU  10          HD12      LEU  10  19.478   2.656   7.266
   78   HD13  LEU  10          HD13      LEU  10  20.822   1.647   7.794
   79   HD21  LEU  10          HD21      LEU  10  20.919  -0.485   5.944
   80   HD22  LEU  10          HD22      LEU  10  21.017   0.046   4.266
   81   HD23  LEU  10          HD23      LEU  10  19.444  -0.159   5.034
   82    H    ALA  11           HN       ALA  11  21.687   5.148   3.966
   83    HA   ALA  11           HA       ALA  11  23.796   4.653   5.651
   84    HB1  ALA  11           HB1      ALA  11  23.961   5.908   3.505
   85    HB2  ALA  11           HB2      ALA  11  24.842   6.676   4.827
   86    HB3  ALA  11           HB3      ALA  11  23.280   7.318   4.318
   87    H    LEU  12           HN       LEU  12  20.984   6.477   6.338
   88    HA   LEU  12           HA       LEU  12  22.093   8.165   8.351
   89    HB2  LEU  12           HB2      LEU  12  19.809   8.346   7.062
   90    HB3  LEU  12           HB1      LEU  12  19.204   7.303   8.344
   91    HG   LEU  12           HG       LEU  12  20.541  10.006   8.700
   92   HD11  LEU  12          HD11      LEU  12  18.185  10.031   7.880
   93   HD12  LEU  12          HD12      LEU  12  18.348  10.719   9.497
   94   HD13  LEU  12          HD13      LEU  12  17.712   9.086   9.293
   95   HD21  LEU  12          HD21      LEU  12  19.738   9.583  11.139
   96   HD22  LEU  12          HD22      LEU  12  21.187   8.738  10.605
   97   HD23  LEU  12          HD23      LEU  12  19.644   7.884  10.669
   98    H    ALA  13           HN       ALA  13  19.872   5.371   8.686
   99    HA   ALA  13           HA       ALA  13  20.314   5.035  11.434
  100    HB1  ALA  13           HB1      ALA  13  19.222   2.952  11.251
  101    HB2  ALA  13           HB2      ALA  13  19.752   2.717   9.587
  102    HB3  ALA  13           HB3      ALA  13  18.517   3.919   9.957
  103    H    LEU  14           HN       LEU  14  22.067   3.852   8.614
  104    HA   LEU  14           HA       LEU  14  23.698   1.967   9.830
  105    HB2  LEU  14           HB2      LEU  14  23.568   2.573   7.363
  106    HB3  LEU  14           HB1      LEU  14  24.632   3.928   7.720
  107    HG   LEU  14           HG       LEU  14  25.519   1.188   8.636
  108   HD11  LEU  14          HD11      LEU  14  25.810   2.129   5.773
  109   HD12  LEU  14          HD12      LEU  14  24.744   0.830   6.307
  110   HD13  LEU  14          HD13      LEU  14  26.491   0.660   6.470
  111   HD21  LEU  14          HD21      LEU  14  26.935   3.120   9.159
  112   HD22  LEU  14          HD22      LEU  14  26.937   3.613   7.469
  113   HD23  LEU  14          HD23      LEU  14  27.744   2.123   7.952
  114    H    ALA  15           HN       ALA  15  24.157   5.477   9.578
  115    HA   ALA  15           HA       ALA  15  26.612   5.593  10.939
  116    HB1  ALA  15           HB1      ALA  15  25.497   7.483   9.685
  117    HB2  ALA  15           HB2      ALA  15  26.153   7.931  11.261
  118    HB3  ALA  15           HB3      ALA  15  24.419   7.673  11.069
  119    H    LEU  16           HN       LEU  16  23.363   5.086  12.030
  120    HA   LEU  16           HA       LEU  16  23.806   5.769  14.756
  121    HB2  LEU  16           HB2      LEU  16  21.561   5.618  13.430
  122    HB3  LEU  16           HB1      LEU  16  21.612   3.920  13.888
  123    HG   LEU  16           HG       LEU  16  22.066   4.873  16.319
  124   HD11  LEU  16          HD11      LEU  16  20.728   7.214  14.922
  125   HD12  LEU  16          HD12      LEU  16  22.285   7.227  15.748
  126   HD13  LEU  16          HD13      LEU  16  20.801   7.015  16.671
  127   HD21  LEU  16          HD21      LEU  16  19.560   5.054  16.664
  128   HD22  LEU  16          HD22      LEU  16  20.077   3.592  15.826
  129   HD23  LEU  16          HD23      LEU  16  19.376   4.928  14.914
  130    H    TRP  17           HN       TRP  17  23.051   2.501  13.418
  131    HA   TRP  17           HA       TRP  17  24.131   1.299  15.789
  132    HB2  TRP  17           HB2      TRP  17  23.750  -0.851  14.578
  133    HB3  TRP  17           HB1      TRP  17  22.333   0.155  14.810
  134    HD1  TRP  17           HD1      TRP  17  21.364   1.407  12.635
  135    HE1  TRP  17           HE1      TRP  17  21.555   0.813  10.131
  136    HE3  TRP  17           HE3      TRP  17  25.278  -1.872  12.789
  137    HZ2  TRP  17           HZ2      TRP  17  23.146  -0.822   8.428
  138    HZ3  TRP  17           HZ3      TRP  17  26.110  -2.933  10.711
  139    HH2  TRP  17           HH2      TRP  17  25.050  -2.413   8.529
  140    H    TRP  18           HN       TRP  18  25.329   1.582  12.460
  141    HA   TRP  18           HA       TRP  18  27.531  -0.101  12.647
  142    HB2  TRP  18           HB2      TRP  18  26.755   1.289  10.623
  143    HB3  TRP  18           HB1      TRP  18  27.700   2.607  11.310
  144    HD1  TRP  18           HD1      TRP  18  28.145  -1.029  10.115
  145    HE1  TRP  18           HE1      TRP  18  30.577  -1.322   9.302
  146    HE3  TRP  18           HE3      TRP  18  30.041   3.555  11.323
  147    HZ2  TRP  18           HZ2      TRP  18  32.992   0.179   9.182
  148    HZ3  TRP  18           HZ3      TRP  18  32.413   4.097  10.847
  149    HH2  TRP  18           HH2      TRP  18  33.891   2.416   9.779
  150    H    ALA  19           HN       ALA  19  27.367   3.355  13.411
  151    HA   ALA  19           HA       ALA  19  29.926   3.254  14.815
  152    HB1  ALA  19           HB1      ALA  19  29.230   5.142  13.228
  153    HB2  ALA  19           HB2      ALA  19  29.879   5.620  14.797
  154    HB3  ALA  19           HB3      ALA  19  28.139   5.660  14.513
  155    HA1  ETA  20           HA1      ETA  20  26.050   2.919  17.791
  156    HA2  ETA  20           HA2      ETA  20  27.641   2.860  18.553
  157    H2   ETA  20           HN       ETA  20  27.534   1.878  15.807
  158    HB1  ETA  20           HB1      ETA  20  26.674   0.813  19.172
  159    HB2  ETA  20           HB2      ETA  20  27.642   0.373  17.771
  160    HO   ETA  20           HG       ETA  20  24.980   0.234  18.066
  Start of MODEL   10
    1    H1   ACE   0           HA2      ACE   0  22.243  -6.702  -4.452
    2    H2   ACE   0           HA3      ACE   0  23.863  -7.077  -5.044
    3    H3   ACE   0           HA1      ACE   0  22.552  -8.234  -5.268
    4    H    GLY   1           HN       GLY   1  21.659  -4.947  -5.665
    5    HA2  GLY   1           HA2      GLY   1  22.300  -4.671  -8.438
    6    HA3  GLY   1           HA1      GLY   1  20.620  -5.134  -8.168
    7    H    TRP   2           HN       TRP   2  19.539  -3.404  -8.529
    8    HA   TRP   2           HA       TRP   2  20.374  -0.771  -7.836
    9    HB2  TRP   2           HB2      TRP   2  17.750  -0.378  -8.377
   10    HB3  TRP   2           HB1      TRP   2  18.949  -0.566  -9.653
   11    HD1  TRP   2           HD1      TRP   2  17.689  -3.287  -7.428
   12    HE1  TRP   2           HE1      TRP   2  16.507  -5.109  -8.840
   13    HE3  TRP   2           HE3      TRP   2  17.794  -1.016 -11.954
   14    HZ2  TRP   2           HZ2      TRP   2  15.714  -5.513 -11.554
   15    HZ3  TRP   2           HZ3      TRP   2  16.823  -2.121 -13.950
   16    HH2  TRP   2           HH2      TRP   2  15.783  -4.366 -13.759
   17    H    TRP   3           HN       TRP   3  19.789  -3.104  -5.835
   18    HA   TRP   3           HA       TRP   3  17.863  -1.897  -4.069
   19    HB2  TRP   3           HB2      TRP   3  19.744  -4.055  -3.192
   20    HB3  TRP   3           HB1      TRP   3  18.082  -3.774  -2.693
   21    HD1  TRP   3           HD1      TRP   3  19.898  -6.193  -4.472
   22    HE1  TRP   3           HE1      TRP   3  18.518  -7.379  -6.292
   23    HE3  TRP   3           HE3      TRP   3  16.006  -2.927  -4.901
   24    HZ2  TRP   3           HZ2      TRP   3  16.093  -6.997  -7.729
   25    HZ3  TRP   3           HZ3      TRP   3  14.194  -3.351  -6.489
   26    HH2  TRP   3           HH2      TRP   3  14.212  -5.383  -7.916
   27    H    LEU   4           HN       LEU   4  21.306  -2.621  -3.861
   28    HA   LEU   4           HA       LEU   4  21.859  -1.254  -1.517
   29    HB2  LEU   4           HB2      LEU   4  23.781  -1.276  -3.848
   30    HB3  LEU   4           HB1      LEU   4  24.143  -1.322  -2.124
   31    HG   LEU   4           HG       LEU   4  22.596  -3.635  -2.407
   32   HD11  LEU   4          HD11      LEU   4  23.669  -4.843  -4.358
   33   HD12  LEU   4          HD12      LEU   4  24.170  -3.269  -4.965
   34   HD13  LEU   4          HD13      LEU   4  22.464  -3.639  -4.765
   35   HD21  LEU   4          HD21      LEU   4  24.685  -3.607  -1.174
   36   HD22  LEU   4          HD22      LEU   4  25.608  -3.320  -2.651
   37   HD23  LEU   4          HD23      LEU   4  24.796  -4.867  -2.405
   38    H    ALA   5           HN       ALA   5  21.225  -0.158  -4.720
   39    HA   ALA   5           HA       ALA   5  22.285   2.407  -4.778
   40    HB1  ALA   5           HB1      ALA   5  19.562   1.710  -5.877
   41    HB2  ALA   5           HB2      ALA   5  21.050   1.116  -6.614
   42    HB3  ALA   5           HB3      ALA   5  20.746   2.850  -6.522
   43    H    LEU   6           HN       LEU   6  19.721   1.161  -2.831
   44    HA   LEU   6           HA       LEU   6  18.639   3.804  -2.189
   45    HB2  LEU   6           HB2      LEU   6  17.720   1.151  -1.105
   46    HB3  LEU   6           HB1      LEU   6  16.820   2.662  -1.238
   47    HG   LEU   6           HG       LEU   6  17.755   0.925  -3.536
   48   HD11  LEU   6          HD11      LEU   6  15.805   0.015  -2.391
   49   HD12  LEU   6          HD12      LEU   6  15.299   0.705  -3.933
   50   HD13  LEU   6          HD13      LEU   6  15.009   1.588  -2.434
   51   HD21  LEU   6          HD21      LEU   6  16.439   3.652  -3.429
   52   HD22  LEU   6          HD22      LEU   6  16.303   2.612  -4.848
   53   HD23  LEU   6          HD23      LEU   6  17.887   3.175  -4.317
   54    H    ALA   7           HN       ALA   7  21.158   1.943  -1.166
   55    HA   ALA   7           HA       ALA   7  20.835   2.046   1.656
   56    HB1  ALA   7           HB1      ALA   7  22.419   0.555   0.211
   57    HB2  ALA   7           HB2      ALA   7  22.952   1.086   1.804
   58    HB3  ALA   7           HB3      ALA   7  23.542   1.905   0.361
   59    HA   PRO   8           HA       PRO   8  23.865   5.966   0.975
   60    HB2  PRO   8           HB2      PRO   8  22.000   7.072  -1.114
   61    HB3  PRO   8           HB1      PRO   8  23.745   7.330  -0.911
   62    HG2  PRO   8           HG2      PRO   8  22.929   5.686  -2.759
   63    HG3  PRO   8           HG1      PRO   8  24.285   5.202  -1.713
   64    HD2  PRO   8           HD2      PRO   8  21.425   4.316  -1.592
   65    HD3  PRO   8           HD1      PRO   8  22.901   3.359  -1.343
   66    H    ALA   9           HN       ALA   9  20.408   6.307   0.261
   67    HA   ALA   9           HA       ALA   9  19.941   8.522   1.948
   68    HB1  ALA   9           HB1      ALA   9  17.577   8.034   1.645
   69    HB2  ALA   9           HB2      ALA   9  17.962   6.417   1.056
   70    HB3  ALA   9           HB3      ALA   9  18.426   7.832   0.111
   71    H    LEU  10           HN       LEU  10  20.134   5.095   2.583
   72    HA   LEU  10           HA       LEU  10  18.953   5.327   5.215
   73    HB2  LEU  10           HB2      LEU  10  18.257   3.273   4.418
   74    HB3  LEU  10           HB1      LEU  10  19.575   3.196   3.268
   75    HG   LEU  10           HG       LEU  10  21.094   2.527   5.161
   76   HD11  LEU  10          HD11      LEU  10  18.694   1.783   6.823
   77   HD12  LEU  10          HD12      LEU  10  19.199   3.466   6.875
   78   HD13  LEU  10          HD13      LEU  10  20.332   2.197   7.329
   79   HD21  LEU  10          HD21      LEU  10  18.663   0.851   4.481
   80   HD22  LEU  10          HD22      LEU  10  20.070   0.209   5.330
   81   HD23  LEU  10          HD23      LEU  10  20.241   0.833   3.689
   82    H    ALA  11           HN       ALA  11  21.829   5.736   3.746
   83    HA   ALA  11           HA       ALA  11  23.809   4.752   5.376
   84    HB1  ALA  11           HB1      ALA  11  23.832   7.563   4.265
   85    HB2  ALA  11           HB2      ALA  11  24.161   6.124   3.298
   86    HB3  ALA  11           HB3      ALA  11  25.224   6.547   4.639
   87    H    LEU  12           HN       LEU  12  21.379   7.013   6.198
   88    HA   LEU  12           HA       LEU  12  22.763   8.346   8.306
   89    HB2  LEU  12           HB2      LEU  12  19.848   8.043   7.586
   90    HB3  LEU  12           HB1      LEU  12  20.349   8.872   9.060
   91    HG   LEU  12           HG       LEU  12  21.633  10.486   7.793
   92   HD11  LEU  12          HD11      LEU  12  22.563   9.232   6.009
   93   HD12  LEU  12          HD12      LEU  12  21.451  10.347   5.219
   94   HD13  LEU  12          HD13      LEU  12  20.982   8.665   5.470
   95   HD21  LEU  12          HD21      LEU  12  18.937  10.036   6.466
   96   HD22  LEU  12          HD22      LEU  12  19.820  11.561   6.527
   97   HD23  LEU  12          HD23      LEU  12  19.177  10.855   8.010
   98    H    ALA  13           HN       ALA  13  20.097   5.957   8.472
   99    HA   ALA  13           HA       ALA  13  20.452   5.388  11.196
  100    HB1  ALA  13           HB1      ALA  13  19.493   3.345   9.195
  101    HB2  ALA  13           HB2      ALA  13  18.488   4.706   9.689
  102    HB3  ALA  13           HB3      ALA  13  19.028   3.526  10.885
  103    H    LEU  14           HN       LEU  14  21.957   4.044   8.296
  104    HA   LEU  14           HA       LEU  14  23.227   1.861   9.462
  105    HB2  LEU  14           HB2      LEU  14  23.149   2.490   6.998
  106    HB3  LEU  14           HB1      LEU  14  24.450   3.625   7.329
  107    HG   LEU  14           HG       LEU  14  24.844   0.766   8.225
  108   HD11  LEU  14          HD11      LEU  14  25.733   0.156   5.996
  109   HD12  LEU  14          HD12      LEU  14  25.109   1.674   5.348
  110   HD13  LEU  14          HD13      LEU  14  23.995   0.452   5.965
  111   HD21  LEU  14          HD21      LEU  14  27.185   1.282   7.486
  112   HD22  LEU  14          HD22      LEU  14  26.603   2.404   8.709
  113   HD23  LEU  14          HD23      LEU  14  26.653   2.895   7.018
  114    H    ALA  15           HN       ALA  15  24.322   5.225   9.181
  115    HA   ALA  15           HA       ALA  15  26.783   4.886  10.492
  116    HB1  ALA  15           HB1      ALA  15  24.937   7.286  10.408
  117    HB2  ALA  15           HB2      ALA  15  26.266   6.943   9.300
  118    HB3  ALA  15           HB3      ALA  15  26.602   7.323  10.989
  119    H    LEU  16           HN       LEU  16  23.519   5.002  11.645
  120    HA   LEU  16           HA       LEU  16  24.137   5.594  14.359
  121    HB2  LEU  16           HB2      LEU  16  21.880   5.872  13.074
  122    HB3  LEU  16           HB1      LEU  16  21.616   4.196  13.538
  123    HG   LEU  16           HG       LEU  16  22.286   5.047  15.956
  124   HD11  LEU  16          HD11      LEU  16  21.398   7.599  14.571
  125   HD12  LEU  16          HD12      LEU  16  22.941   7.315  15.374
  126   HD13  LEU  16          HD13      LEU  16  21.458   7.392  16.319
  127   HD21  LEU  16          HD21      LEU  16  20.058   4.173  15.351
  128   HD22  LEU  16          HD22      LEU  16  19.616   5.743  14.680
  129   HD23  LEU  16          HD23      LEU  16  19.905   5.575  16.411
  130    H    TRP  17           HN       TRP  17  22.760   2.528  13.038
  131    HA   TRP  17           HA       TRP  17  23.627   1.141  15.397
  132    HB2  TRP  17           HB2      TRP  17  22.826  -0.888  14.245
  133    HB3  TRP  17           HB1      TRP  17  21.622   0.377  14.397
  134    HD1  TRP  17           HD1      TRP  17  20.776   1.523  12.176
  135    HE1  TRP  17           HE1      TRP  17  20.985   0.861   9.692
  136    HE3  TRP  17           HE3      TRP  17  24.439  -2.024  12.501
  137    HZ2  TRP  17           HZ2      TRP  17  22.495  -0.921   8.066
  138    HZ3  TRP  17           HZ3      TRP  17  25.243  -3.188  10.467
  139    HH2  TRP  17           HH2      TRP  17  24.278  -2.642   8.248
  140    H    TRP  18           HN       TRP  18  24.802   1.184  12.046
  141    HA   TRP  18           HA       TRP  18  26.661  -0.873  12.213
  142    HB2  TRP  18           HB2      TRP  18  26.111   0.627  10.190
  143    HB3  TRP  18           HB1      TRP  18  27.301   1.747  10.845
  144    HD1  TRP  18           HD1      TRP  18  27.021  -1.897   9.641
  145    HE1  TRP  18           HE1      TRP  18  29.338  -2.654   8.796
  146    HE3  TRP  18           HE3      TRP  18  29.789   2.217  10.851
  147    HZ2  TRP  18           HZ2      TRP  18  31.999  -1.653   8.652
  148    HZ3  TRP  18           HZ3      TRP  18  32.215   2.289  10.347
  149    HH2  TRP  18           HH2      TRP  18  33.325   0.361   9.250
  150    H    ALA  19           HN       ALA  19  27.152   2.562  12.936
  151    HA   ALA  19           HA       ALA  19  29.653   1.980  14.347
  152    HB1  ALA  19           HB1      ALA  19  28.430   4.697  13.908
  153    HB2  ALA  19           HB2      ALA  19  29.387   3.894  12.664
  154    HB3  ALA  19           HB3      ALA  19  30.118   4.295  14.218
  155    HA1  ETA  20           HA1      ETA  20  25.831   1.216  17.353
  156    HA2  ETA  20           HA2      ETA  20  26.224   2.930  17.481
  157    H2   ETA  20           HN       ETA  20  27.033   1.187  15.380
  158    HB1  ETA  20           HB1      ETA  20  27.116   1.581  19.380
  159    HB2  ETA  20           HB2      ETA  20  28.390   2.379  18.467
  160    HO   ETA  20           HG       ETA  20  29.032   0.536  17.613