*HEADER    CELL ADHESION                           24-JAN-11   2L8S              
*TITLE     SOLUTION NMR STRUCTURE OF TRANSMEMBRANE AND CYTOSOLIC REGIONS OF      
*TITLE    2 INTEGRIN ALPHA1 IN DETERGENT MICELLES                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INTEGRIN ALPHA-1;                                          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: TRANSMEMBRANE/CYTOPLASMIC REGION, UNP RESIDUES 1135-1179;  
*COMPND   5 SYNONYM: INTEGRIN ALPHA1, CD49 ANTIGEN-LIKE FAMILY MEMBER A, LAMININ 
*COMPND   6 AND COLLAGEN RECEPTOR, VLA-1;                                        
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET21B                                     
*KEYWDS    INTEGRIN ALPHA1, TRANSMEMBRANE REGION, DETERGENT MICELLE, CELL        
*KEYWDS   2 ADHESION                                                             
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    C.LAI, X.LIU, C.TIAN                                                  
*REVDAT   1   01-FEB-12 2L8S    0                                                


!remark phi angle constraints 

! 3
assign (resid 2 and name c ) (resid 3 and name n)
       (resid 3 and name ca) (resid 3 and name c) 1.0 -89.749 18.225 2

! 5
assign (resid 4 and name c ) (resid 5 and name n)
       (resid 5 and name ca) (resid 5 and name c) 1.0 72.721 15.746 2

! 6
assign (resid 5 and name c ) (resid 6 and name n)
       (resid 6 and name ca) (resid 6 and name c) 1.0 -82.340 57.688 2

! 7
assign (resid 6 and name c ) (resid 7 and name n)
       (resid 7 and name ca) (resid 7 and name c) 1.0 -104.829 21.735 2

! 8
assign (resid 7 and name c ) (resid 8 and name n)
       (resid 8 and name ca) (resid 8 and name c) 1.0 -58.738 10.000 2

! 9
assign (resid 8 and name c ) (resid 9 and name n)
       (resid 9 and name ca) (resid 9 and name c) 1.0 -56.520 10.000 2

! 10
assign (resid 9 and name c ) (resid 10 and name n)
       (resid 10 and name ca) (resid 10 and name c) 1.0 -66.928 10.000 2

! 11
assign (resid 10 and name c ) (resid 11 and name n)
       (resid 11 and name ca) (resid 11 and name c) 1.0 -64.680 10.000 2

! 12
assign (resid 11 and name c ) (resid 12 and name n)
       (resid 12 and name ca) (resid 12 and name c) 1.0 -64.493 10.000 2

! 13
assign (resid 12 and name c ) (resid 13 and name n)
       (resid 13 and name ca) (resid 13 and name c) 1.0 -59.783 10.000 2

! 14
assign (resid 13 and name c ) (resid 14 and name n)
       (resid 14 and name ca) (resid 14 and name c) 1.0 -62.389 10.000 2

! 15
assign (resid 14 and name c ) (resid 15 and name n)
       (resid 15 and name ca) (resid 15 and name c) 1.0 -66.651 10.032 2

! 16
assign (resid 15 and name c ) (resid 16 and name n)
       (resid 16 and name ca) (resid 16 and name c) 1.0 -61.318 10.000 2

! 17
assign (resid 16 and name c ) (resid 17 and name n)
       (resid 17 and name ca) (resid 17 and name c) 1.0 -66.904 10.000 2

! 18
assign (resid 17 and name c ) (resid 18 and name n)
       (resid 18 and name ca) (resid 18 and name c) 1.0 -63.859 10.000 2

! 19
assign (resid 18 and name c ) (resid 19 and name n)
       (resid 19 and name ca) (resid 19 and name c) 1.0 -65.447 10.000 2

! 20
assign (resid 19 and name c ) (resid 20 and name n)
       (resid 20 and name ca) (resid 20 and name c) 1.0 -57.454 10.000 2

! 21
assign (resid 20 and name c ) (resid 21 and name n)
       (resid 21 and name ca) (resid 21 and name c) 1.0 -64.498 10.000 2

! 22
assign (resid 21 and name c ) (resid 22 and name n)
       (resid 22 and name ca) (resid 22 and name c) 1.0 -63.194 10.000 2

! 23
assign (resid 22 and name c ) (resid 23 and name n)
       (resid 23 and name ca) (resid 23 and name c) 1.0 -62.331 10.000 2

! 24
assign (resid 23 and name c ) (resid 24 and name n)
       (resid 24 and name ca) (resid 24 and name c) 1.0 -63.010 10.000 2

! 25
assign (resid 24 and name c ) (resid 25 and name n)
       (resid 25 and name ca) (resid 25 and name c) 1.0 -63.788 10.000 2

! 26
assign (resid 25 and name c ) (resid 26 and name n)
       (resid 26 and name ca) (resid 26 and name c) 1.0 -68.671 10.000 2

! 27
assign (resid 26 and name c ) (resid 27 and name n)
       (resid 27 and name ca) (resid 27 and name c) 1.0 -63.620 10.000 2

! 28
assign (resid 27 and name c ) (resid 28 and name n)
       (resid 28 and name ca) (resid 28 and name c) 1.0 -58.780 10.000 2

! 29
assign (resid 28 and name c ) (resid 29 and name n)
       (resid 29 and name ca) (resid 29 and name c) 1.0 -63.326 10.000 2

! 30
assign (resid 29 and name c ) (resid 30 and name n)
       (resid 30 and name ca) (resid 30 and name c) 1.0 -61.382 10.000 2

! 31
assign (resid 30 and name c ) (resid 31 and name n)
       (resid 31 and name ca) (resid 31 and name c) 1.0 -62.596 10.000 2

! 32
assign (resid 31 and name c ) (resid 32 and name n)
       (resid 32 and name ca) (resid 32 and name c) 1.0 -64.358 10.000 2

! 33
assign (resid 32 and name c ) (resid 33 and name n)
       (resid 33 and name ca) (resid 33 and name c) 1.0 -83.992 15.972 2



!remark psi angle constraints 

! 3
assign (resid 3 and name n) (resid 3 and name ca)
       (resid 3 and name c) (resid 4 and name n ) 1.0 135.400 14.399 2

! 5
assign (resid 5 and name n) (resid 5 and name ca)
       (resid 5 and name c) (resid 6 and name n ) 1.0 9.200 22.735 2

! 6
assign (resid 6 and name n) (resid 6 and name ca)
       (resid 6 and name c) (resid 7 and name n ) 1.0 139.187 18.796 2

! 7
assign (resid 7 and name n) (resid 7 and name ca)
       (resid 7 and name c) (resid 8 and name n ) 1.0 124.150 28.296 2

! 8
assign (resid 8 and name n) (resid 8 and name ca)
       (resid 8 and name c) (resid 9 and name n ) 1.0 138.956 9.489 2

! 9
assign (resid 9 and name n) (resid 9 and name ca)
       (resid 9 and name c) (resid 10 and name n ) 1.0 -36.822 6.033 2

! 10
assign (resid 10 and name n) (resid 10 and name ca)
       (resid 10 and name c) (resid 11 and name n ) 1.0 -38.334 6.954 2

! 11
assign (resid 11 and name n) (resid 11 and name ca)
       (resid 11 and name c) (resid 12 and name n ) 1.0 -43.863 4.671 2

! 12
assign (resid 12 and name n) (resid 12 and name ca)
       (resid 12 and name c) (resid 13 and name n ) 1.0 -48.706 7.275 2

! 13
assign (resid 13 and name n) (resid 13 and name ca)
       (resid 13 and name c) (resid 14 and name n ) 1.0 -40.134 6.525 2

! 14
assign (resid 14 and name n) (resid 14 and name ca)
       (resid 14 and name c) (resid 15 and name n ) 1.0 -40.184 6.556 2

! 15
assign (resid 15 and name n) (resid 15 and name ca)
       (resid 15 and name c) (resid 16 and name n ) 1.0 -36.818 12.851 2

! 16
assign (resid 16 and name n) (resid 16 and name ca)
       (resid 16 and name c) (resid 17 and name n ) 1.0 -40.849 9.882 2

! 17
assign (resid 17 and name n) (resid 17 and name ca)
       (resid 17 and name c) (resid 18 and name n ) 1.0 -40.818 3.785 2

! 18
assign (resid 18 and name n) (resid 18 and name ca)
       (resid 18 and name c) (resid 19 and name n ) 1.0 -35.924 15.415 2

! 19
assign (resid 19 and name n) (resid 19 and name ca)
       (resid 19 and name c) (resid 20 and name n ) 1.0 -34.725 14.170 2

! 20
assign (resid 20 and name n) (resid 20 and name ca)
       (resid 20 and name c) (resid 21 and name n ) 1.0 -44.455 7.789 2

! 21
assign (resid 21 and name n) (resid 21 and name ca)
       (resid 21 and name c) (resid 22 and name n ) 1.0 -38.721 6.959 2

! 22
assign (resid 22 and name n) (resid 22 and name ca)
       (resid 22 and name c) (resid 23 and name n ) 1.0 -41.843 4.236 2

! 23
assign (resid 23 and name n) (resid 23 and name ca)
       (resid 23 and name c) (resid 24 and name n ) 1.0 -42.484 5.386 2

! 24
assign (resid 24 and name n) (resid 24 and name ca)
       (resid 24 and name c) (resid 25 and name n ) 1.0 -43.607 3.402 2

! 25
assign (resid 25 and name n) (resid 25 and name ca)
       (resid 25 and name c) (resid 26 and name n ) 1.0 -41.511 6.700 2

! 26
assign (resid 26 and name n) (resid 26 and name ca)
       (resid 26 and name c) (resid 27 and name n ) 1.0 -39.337 8.639 2

! 27
assign (resid 27 and name n) (resid 27 and name ca)
       (resid 27 and name c) (resid 28 and name n ) 1.0 -45.086 6.657 2

! 28
assign (resid 28 and name n) (resid 28 and name ca)
       (resid 28 and name c) (resid 29 and name n ) 1.0 -39.520 3.456 2

! 29
assign (resid 29 and name n) (resid 29 and name ca)
       (resid 29 and name c) (resid 30 and name n ) 1.0 -41.210 5.384 2

! 30
assign (resid 30 and name n) (resid 30 and name ca)
       (resid 30 and name c) (resid 31 and name n ) 1.0 -43.442 8.110 2

! 31
assign (resid 31 and name n) (resid 31 and name ca)
       (resid 31 and name c) (resid 32 and name n ) 1.0 -41.548 4.014 2

! 32
assign (resid 32 and name n) (resid 32 and name ca)
       (resid 32 and name c) (resid 33 and name n ) 1.0 -37.056 8.613 2

! 33
assign (resid 33 and name n) (resid 33 and name ca)
       (resid 33 and name c) (resid 34 and name n ) 1.0 -13.684 19.746 2



!!!!!!!!!!!!!!!!!!!!!!!!!!! N-NOE !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
! W10
assign (resid 10 and name hn)(resid 9 and name hn) 2.5 0.7 1.0
assign (resid 10 and name hn)(resid 9 and name ha) 3.5 1.7 1.0
assign (resid 10 and name hn)(resid 9 and name hb#) 3.5 1.7 1.0
assign (resid 10 and name hn)(resid 10 and name ha) 3.5 1.7 1.0
assign (resid 10 and name hn)(resid 10 and name hb#) 3.5 1.7 1.0
assign (resid 10 and name hn)(resid 11 and name hn) 4.5 2.7 1.0
assign (resid 10 and name hn)(resid 12 and name hn) 3.5 1.7 1.0
assign (resid 10 and name hn)(resid 13 and name hn) 4.5 2.7 1.0

! V11
assign (resid 11 and name hn)(resid 9 and name ha) 3.5 1.7 1.0
assign (resid 11 and name hn)(resid 9 and name hb#) 3.5 1.7 1.0
assign (resid 11 and name hn)(resid 10 and name hn) 2.5 0.7 1.0
assign (resid 11 and name hn)(resid 10 and name ha) 3.5 1.7 1.0
assign (resid 11 and name hn)(resid 10 and name hb#) 3.5 1.7 1.0
assign (resid 11 and name hn)(resid 11 and name ha) 3.5 1.7 1.0
assign (resid 11 and name hn)(resid 11 and name hb) 3.5 1.7 1.0
assign (resid 11 and name hn)(resid 11 and name hg#) 3.5 1.7 1.0
assign (resid 11 and name hn)(resid 12 and name hn) 2.5 0.7 1.0
assign (resid 11 and name hn)(resid 13 and name hn) 3.5 1.7 1.0

! I12
assign (resid 12 and name hn)(resid 10 and name ha) 3.5 1.7 1.0
assign (resid 12 and name hn)(resid 10 and name hb#) 3.5 1.7 1.0
assign (resid 12 and name hn)(resid 11 and name hn) 2.5 0.7 1.0
assign (resid 12 and name hn)(resid 11 and name ha) 3.5 1.7 1.0
assign (resid 12 and name hn)(resid 11 and name hb) 3.5 1.7 1.0
assign (resid 12 and name hn)(resid 11 and name hg#) 3.5 1.7 1.0
assign (resid 12 and name hn)(resid 13 and name hn) 2.5 0.7 1.0

! L13
assign (resid 13 and name hn)(resid 11 and name ha) 3.5 1.7 1.0
assign (resid 13 and name hn)(resid 12 and name hn) 3.5 1.7 1.0
assign (resid 13 and name hn)(resid 12 and name ha) 4.5 2.7 1.0
assign (resid 13 and name hn)(resid 12 and name hb) 3.5 1.7 1.0
assign (resid 13 and name hn)(resid 13 and name ha) 3.5 1.7 1.0
assign (resid 13 and name hn)(resid 13 and name hb#) 3.5 1.7 1.0
assign (resid 13 and name hn)(resid 14 and name hn) 2.5 0.7 1.0
assign (resid 13 and name hn)(resid 15 and name hn) 2.5 0.7 1.0

! L14
assign (resid 14 and name hn)(resid 13 and name hn) 2.5 0.7 1.0
assign (resid 14 and name hn)(resid 15 and name hn) 2.5 0.7 1.0

! S15
assign (resid 15 and name hn)(resid 13 and name hn) 3.5 1.7 1.0
assign (resid 15 and name hn)(resid 14 and name hn) 2.5 0.7 1.0
assign (resid 15 and name hn)(resid 15 and name ha) 3.5 1.7 1.0
assign (resid 15 and name hn)(resid 15 and name hb#) 3.5 1.7 1.0
assign (resid 15 and name hn)(resid 16 and name hn) 2.5 0.7 1.0
assign (resid 15 and name hn)(resid 17 and name hn) 2.5 0.7 1.0

! A16
assign (resid 16 and name hn)(resid 14 and name hn) 3.5 1.7 1.0
assign (resid 16 and name hn)(resid 15 and name hn) 2.5 0.7 1.0
assign (resid 16 and name hn)(resid 16 and name ha) 3.5 1.7 1.0
assign (resid 16 and name hn)(resid 16 and name hb#) 3.5 1.7 1.0
assign (resid 16 and name hn)(resid 17 and name hn) 2.5 0.7 1.0

! F17
assign (resid 17 and name hn)(resid 15 and name hn) 3.5 1.7 1.0
assign (resid 17 and name hn)(resid 16 and name hn) 2.5 0.7 1.0
assign (resid 17 and name hn)(resid 16 and name ha) 3.5 1.7 1.0
assign (resid 17 and name hn)(resid 16 and name hb#) 3.5 1.7 1.0
assign (resid 17 and name hn)(resid 17 and name ha) 3.5 1.7 1.0
assign (resid 17 and name hn)(resid 17 and name hb#) 3.5 1.7 1.0
assign (resid 17 and name hn)(resid 18 and name hn) 2.5 0.7 1.0
assign (resid 17 and name hn)(resid 19 and name hn) 3.5 1.7 1.0
assign (resid 17 and name hn)(resid 20 and name hn) 3.5 1.7 1.0

! A18
assign (resid 18 and name hn)(resid 15 and name hn) 3.5 1.7 1.0
assign (resid 18 and name hn)(resid 16 and name hn) 3.5 1.7 1.0
assign (resid 18 and name hn)(resid 17 and name hn) 2.5 0.7 1.0
assign (resid 18 and name hn)(resid 18 and name ha) 3.5 1.7 1.0
assign (resid 18 and name hn)(resid 18 and name hb#) 3.5 1.7 1.0
assign (resid 18 and name hn)(resid 19 and name hn) 2.5 0.7 1.0

! G19
assign (resid 19 and name hn)(resid 17 and name hn) 3.5 1.7 1.0
assign (resid 19 and name hn)(resid 18 and name hn) 2.5 0.7 1.0
assign (resid 19 and name hn)(resid 18 and name ha) 3.5 1.7 1.0
assign (resid 19 and name hn)(resid 18 and name hb#) 3.5 1.7 1.0
assign (resid 19 and name hn)(resid 19 and name ha3) 3.5 1.7 1.0
assign (resid 19 and name hn)(resid 19 and name ha2) 3.5 1.7 1.0
assign (resid 19 and name hn)(resid 20 and name hn) 2.5 0.7 1.0
assign (resid 19 and name hn)(resid 21 and name hn) 3.5 1.7 1.0

! L20
assign (resid 20 and name hn)(resid 18 and name ha) 3.5 0.7 1.0
assign (resid 20 and name hn)(resid 19 and name hn) 2.5 0.7 1.0
assign (resid 20 and name hn)(resid 19 and name ha3) 3.5 1.7 1.0
assign (resid 20 and name hn)(resid 19 and name ha2) 3.5 1.7 1.0
assign (resid 20 and name hn)(resid 20 and name ha) 3.5 1.7 1.0
assign (resid 20 and name hn)(resid 20 and name hb#) 3.5 1.7 1.0
assign (resid 20 and name hn)(resid 21 and name hn) 2.5 0.7 1.0
assign (resid 20 and name hn)(resid 22 and name hn) 3.5 1.7 1.0

! L21
assign (resid 21 and name hn)(resid 20 and name hn) 2.5 0.7 1.0
assign (resid 21 and name hn)(resid 20 and name ha) 3.5 1.7 1.0
assign (resid 21 and name hn)(resid 20 and name hb#) 3.5 1.7 1.0
assign (resid 21 and name hn)(resid 21 and name ha) 3.5 1.7 1.0
assign (resid 21 and name hn)(resid 21 and name hb#) 3.5 1.7 1.0
assign (resid 21 and name hn)(resid 22 and name hn) 2.5 0.7 1.0
assign (resid 21 and name hn)(resid 23 and name hn) 2.5 0.7 1.0

! L22
assign (resid 22 and name hn)(resid 20 and name hn) 3.5 1.7 1.0
assign (resid 22 and name hn)(resid 21 and name hn) 2.5 0.7 1.0
assign (resid 22 and name hn)(resid 22 and name ha) 3.5 1.7 1.0
assign (resid 22 and name hn)(resid 22 and name hb#) 3.5 1.7 1.0
assign (resid 22 and name hn)(resid 23 and name hn) 2.5 0.7 1.0
assign (resid 22 and name hn)(resid 24 and name hn) 3.5 1.7 1.0

! L23
assign (resid 23 and name hn)(resid 21 and name hn) 3.5 1.7 1.0
assign (resid 23 and name hn)(resid 22 and name hn) 2.5 0.7 1.0
assign (resid 23 and name hn)(resid 23 and name ha) 3.5 1.7 1.0
assign (resid 23 and name hn)(resid 23 and name hb#) 3.5 1.7 1.0
assign (resid 23 and name hn)(resid 24 and name hn) 2.5 0.7 1.0
assign (resid 23 and name hn)(resid 25 and name hn) 3.5 1.7 1.0

! M24
assign (resid 24 and name hn)(resid 22 and name hn) 3.5 1.7 1.0
assign (resid 24 and name hn)(resid 23 and name hn) 2.5 0.7 1.0
assign (resid 24 and name hn)(resid 24 and name ha) 3.5 1.7 1.0
assign (resid 24 and name hn)(resid 24 and name hb#) 3.5 1.7 1.0
assign (resid 24 and name hn)(resid 25 and name hn) 2.5 0.7 1.0
assign (resid 24 and name hn)(resid 26 and name hn) 3.5 1.7 1.0

! L25
assign (resid 25 and name hn)(resid 23 and name hn) 3.5 1.7 1.0
assign (resid 25 and name hn)(resid 24 and name hn) 2.5 0.7 1.0
assign (resid 25 and name hn)(resid 24 and name ha) 3.5 1.7 1.0
assign (resid 25 and name hn)(resid 26 and name hn) 2.5 0.7 1.0
assign (resid 25 and name hn)(resid 27 and name hn) 3.5 1.7 1.0
assign (resid 25 and name hn)(resid 29 and name hn) 4.5 2.7 1.0

! L26
assign (resid 26 and name hn)(resid 24 and name hn) 3.5 1.7 1.0
assign (resid 26 and name hn)(resid 25 and name hn) 2.5 0.7 1.0
assign (resid 26 and name hn)(resid 27 and name hn) 2.5 0.7 1.0

!I27
assign (resid 27 and name hn)(resid 26 and name hn) 2.5 0.7 1.0
assign (resid 27 and name hn)(resid 27 and name ha) 3.5 1.7 1.0
assign (resid 27 and name hn)(resid 28 and name hn) 2.5 0.7 1.0

! L28
!assign (resid 28 and name hn)(resid 26 and name ha) 3.5 1.7 1.0
assign (resid 28 and name hn)(resid 27 and name hn) 2.5 0.7 1.0
assign (resid 28 and name hn)(resid 28 and name ha) 3.5 1.7 1.0
assign (resid 28 and name hn)(resid 28 and name hb#) 3.5 1.7 1.0
!assign (resid 28 and name hn)(resid 28 and name hg) 3.5 1.7 1.0
assign (resid 28 and name hn)(resid 29 and name hn) 2.5 0.7 1.0
assign (resid 28 and name hn)(resid 30 and name hn) 3.5 1.7 1.0

! A29
assign (resid 29 and name hn)(resid 27 and name hn) 3.5 1.7 1.0
assign (resid 29 and name hn)(resid 27 and name ha) 3.5 0.7 2.0
assign (resid 29 and name hn)(resid 28 and name hn) 2.5 0.7 1.0
assign (resid 29 and name hn)(resid 28 and name ha) 3.5 0.7 2.0
assign (resid 29 and name hn)(resid 28 and name hb#) 3.5 0.7 1.0
assign (resid 29 and name hn)(resid 29 and name ha) 2.5 0.7 1.0
assign (resid 29 and name hn)(resid 29 and name hb#) 2.5 0.7 1.0
assign (resid 29 and name hn)(resid 30 and name hn) 2.5 0.7 1.0

! L30
assign (resid 30 and name hn)(resid 27 and name hn) 3.5 1.7 1.0
assign (resid 30 and name hn)(resid 29 and name hn) 2.5 0.7 1.0
assign (resid 30 and name hn)(resid 30 and name ha) 2.5 0.7 1.0
assign (resid 30 and name hn)(resid 30 and name hb#) 2.5 0.7 1.0
assign (resid 30 and name hn)(resid 31 and name hn) 3.5 1.7 1.0
assign (resid 30 and name hn)(resid 32 and name hn) 3.5 1.7 1.0
assign (resid 30 and name hn)(resid 33 and name hn) 4.5 2.7 1.0

! W31
assign (resid 31 and name hn)(resid 30 and name hn) 2.5 0.7 1.0
assign (resid 31 and name hn)(resid 31 and name ha) 3.5 1.7 1.0
assign (resid 31 and name hn)(resid 31 and name hb#) 3.5 1.7 1.0
assign (resid 31 and name hn)(resid 32 and name hn) 2.5 0.7 1.0

! K32
assign (resid 32 and name hn)(resid 28 and name ha) 4.5 2.7 1.0
assign (resid 32 and name hn)(resid 29 and name ha) 4.5 2.7 1.0
assign (resid 32 and name hn)(resid 31 and name ha) 3.5 1.7 1.0
assign (resid 32 and name hn)(resid 31 and name hb#) 3.5 1.7 1.0
assign (resid 32 and name hn)(resid 32 and name ha) 2.5 0.7 1.0
assign (resid 32 and name hn)(resid 32 and name hb#) 2.5 0.7 1.0
assign (resid 32 and name hn)(resid 32 and name he#) 3.5 1.7 1.0
assign (resid 32 and name hn)(resid 33 and name hn) 4.5 2.7 1.0
assign (resid 32 and name hn)(resid 36 and name hn) 4.5 2.7 1.0

! I33
assign (resid 33 and name hn)(resid 30 and name hn) 4.5 2.7 1.0
assign (resid 33 and name hn)(resid 30 and name ha) 3.5 1.7 1.0
assign (resid 33 and name hn)(resid 31 and name hn) 4.5 2.7 1.0
assign (resid 33 and name hn)(resid 31 and name ha) 3.5 1.7 1.0
assign (resid 33 and name hn)(resid 32 and name hn) 2.5 0.7 1.0
assign (resid 33 and name hn)(resid 32 and name ha) 3.5 1.7 1.0
assign (resid 33 and name hn)(resid 32 and name hb#) 3.5 1.7 1.0
assign (resid 33 and name hn)(resid 33 and name ha) 2.5 0.7 1.0
assign (resid 33 and name hn)(resid 33 and name hb) 2.5 0.7 1.0
assign (resid 33 and name hn)(resid 34 and name hn) 2.5 0.7 1.0

! G34
assign (resid 34 and name hn)(resid 32 and name hn) 4.5 2.7 1.0
assign (resid 34 and name hn)(resid 32 and name ha) 3.5 1.7 1.0
assign (resid 34 and name hn)(resid 33 and name hn) 2.5 0.7 1.0
assign (resid 34 and name hn)(resid 33 and name hb) 3.5 1.7 1.0
assign (resid 34 and name hn)(resid 34 and name ha3) 2.5 0.7 1.0
assign (resid 34 and name hn)(resid 34 and name ha2) 2.5 0.7 1.0
assign (resid 34 and name hn)(resid 35 and name hn) 2.5 0.7 1.0
assign (resid 34 and name hn)(resid 36 and name hn) 4.5 2.7 1.0
assign (resid 34 and name hn)(resid 37 and name hn) 3.5 1.7 1.0

! F35
assign (resid 35 and name hn)(resid 33 and name hn) 4.5 2.7 1.0
assign (resid 35 and name hn)(resid 34 and name hn) 2.5 0.7 1.0
assign (resid 35 and name hn)(resid 34 and name ha3) 3.5 1.7 1.0
assign (resid 35 and name hn)(resid 34 and name ha2) 3.5 1.7 1.0
assign (resid 35 and name hn)(resid 35 and name ha) 2.5 0.7 1.0
assign (resid 35 and name hn)(resid 35 and name hb3) 2.5 0.7 1.0
assign (resid 35 and name hn)(resid 35 and name hb2) 2.5 0.7 1.0
assign (resid 36 and name hn)(resid 35 and name hd1) 4.5 2.7 1.0
assign (resid 36 and name hn)(resid 35 and name hd2) 3.5 1.7 1.0
assign (resid 35 and name hn)(resid 36 and name hn) 3.5 1.7 1.0
assign (resid 35 and name hn)(resid 37 and name hn) 3.5 1.7 1.0

! F36
assign (resid 36 and name hn)(resid 34 and name hn) 3.5 1.7 1.0
assign (resid 36 and name hn)(resid 34 and name ha3) 3.5 1.7 1.0
assign (resid 36 and name hn)(resid 34 and name ha2) 3.5 1.7 1.0
assign (resid 36 and name hn)(resid 35 and name hn) 2.5 0.7 1.0
assign (resid 36 and name hn)(resid 35 and name ha) 3.5 1.7 1.0
assign (resid 36 and name hn)(resid 35 and name hb3) 3.5 1.7 1.0
assign (resid 36 and name hn)(resid 35 and name hb2) 3.5 1.7 1.0
assign (resid 36 and name hn)(resid 36 and name ha) 2.5 0.7 1.0
assign (resid 36 and name hn)(resid 36 and name hb3) 2.5 0.7 1.0
assign (resid 36 and name hn)(resid 36 and name hb2) 2.5 0.7 1.0
assign (resid 36 and name hn)(resid 36 and name hd1) 4.5 2.7 1.0
assign (resid 36 and name hn)(resid 36 and name hd2) 3.5 1.7 1.0
assign (resid 36 and name hn)(resid 37 and name hn) 2.5 0.7 1.0

! K37
assign (resid 37 and name hn)(resid 34 and name ha#) 4.5 2.7 1.0
assign (resid 37 and name hn)(resid 35 and name hn) 3.5 1.0 1.0
assign (resid 37 and name hn)(resid 35 and name ha) 3.5 1.7 1.0
assign (resid 37 and name hn)(resid 35 and name hb3) 4.5 2.7 1.0
assign (resid 37 and name hn)(resid 35 and name hb2) 4.5 2.7 1.0
assign (resid 37 and name hn)(resid 36 and name hn) 2.5 0.7 1.0
assign (resid 37 and name hn)(resid 36 and name ha) 3.5 1.7 1.0
assign (resid 37 and name hn)(resid 36 and name hb3) 3.5 1.7 1.0
assign (resid 37 and name hn)(resid 36 and name hb2) 3.5 1.7 1.0
assign (resid 37 and name hn)(resid 36 and name hd#) 4.0 2.2 1.0
assign (resid 37 and name hn)(resid 37 and name ha) 2.5 0.7 1.0
assign (resid 37 and name hn)(resid 37 and name hb#) 2.5 0.7 1.0
assign (resid 37 and name hn)(resid 37 and name hg#) 3.5 1.7 1.0
assign (resid 37 and name hn)(resid 38 and name hn) 3.5 1.7 1.0

! R38
assign (resid 38 and name hn)(resid 36 and name hn) 3.5 1.7 1.0
assign (resid 38 and name hn)(resid 36 and name ha) 3.5 1.7 1.0
assign (resid 38 and name hn)(resid 37 and name hn) 3.5 1.7 1.0
assign (resid 38 and name hn)(resid 37 and name ha) 3.5 1.7 1.0
assign (resid 38 and name hn)(resid 38 and name ha) 2.5 0.7 1.0
assign (resid 38 and name hn)(resid 38 and name hb3) 2.5 0.7 1.0
assign (resid 38 and name hn)(resid 38 and name hb2) 2.5 0.7 1.0
assign (resid 38 and name hn)(resid 38 and name hg#) 3.5 1.7 1.0


!remark dN RDC of InAa in 6.5% Gel

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 3    and name N   )
       ( resid 3    and name HN  )  4.600    0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 5    and name N   )
       ( resid 5    and name HN  )  1.100    0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 6    and name N   )
       ( resid 6    and name HN  )  -3.100   0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 7    and name N   )
       ( resid 7    and name HN  )  -0.100   0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 10   and name N   )
       ( resid 10   and name HN  )  -5.200   0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 11   and name N   )
       ( resid 11   and name HN  )  9.700   0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 13   and name N   )
       ( resid 13   and name HN  )  -5.000  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 14   and name N   )
       ( resid 14   and name HN  )  -3.100  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 15   and name N   )
       ( resid 15   and name HN  )  10.100  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 16   and name N   )
       ( resid 16   and name HN  )  12.100  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 17   and name N   )
       ( resid 17   and name HN  )  -3.600  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 19   and name N   )
       ( resid 19   and name HN  )  9.100  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 21   and name N   )
       ( resid 21   and name HN  )  0.300  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 23   and name N   )
       ( resid 23   and name HN  )  -6.300  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 24   and name N   )
       ( resid 24   and name HN  )  -3.600  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 25   and name N   )
       ( resid 25   and name HN  )  -13.500  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 26   and name N   )
       ( resid 26   and name HN  )  0.300  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 27   and name N   )
       ( resid 27   and name HN  )  -11.800  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 28   and name N   )
       ( resid 28   and name HN  )  3.400  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 29   and name N   )
       ( resid 29   and name HN  )  7.200  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 30   and name N   )
       ( resid 30   and name HN  )  7.700  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 31   and name N   )
       ( resid 31   and name HN  )  -7.000  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 32   and name N   )
       ( resid 32   and name HN  )  3.500  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 33   and name N   )
       ( resid 33   and name HN  )  3.200  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 36   and name N   )
       ( resid 36   and name HN  )  2.000  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 37   and name N   )
       ( resid 37   and name HN  )  -5.500  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 38   and name N   )
       ( resid 38   and name HN  )  -9.600  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 40   and name N   )
       ( resid 40   and name HN  )  11.700  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 41   and name N   )
       ( resid 41   and name HN  )  6.800  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 42   and name N   )
       ( resid 42   and name HN  )  10.100  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 43   and name N   )
       ( resid 43   and name HN  )  11.800  0.200

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name Y   )
       ( resid 600  and name X   )
       ( resid 46   and name N   )
       ( resid 46   and name HN  )  7.200  0.200

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1  21.959  -9.817 -28.702
    2    H2   MET   1           H2       MET   1  23.069  -8.567 -29.006
    3    H3   MET   1           H3       MET   1  21.719  -8.772 -30.017
    4    HA   MET   1           HA       MET   1  21.035  -7.026 -28.718
    5    HB3  MET   1           HB3      MET   1  19.321  -7.904 -27.279
    6    HG3  MET   1           HG3      MET   1  19.574  -8.653 -29.852
    7    HE1  MET   1           HE1      MET   1  17.585 -11.320 -29.980
    8    HE2  MET   1           HE2      MET   1  18.740 -12.422 -30.725
    9    HE3  MET   1           HE3      MET   1  18.656 -10.748 -31.266
   10    H    GLY   2           H        GLY   2  21.047  -5.875 -26.693
   11    HA2  GLY   2           HA3      GLY   2  21.964  -6.299 -24.267
   12    HA3  GLY   2           HA2      GLY   2  23.485  -6.396 -25.148
   13    H    LEU   3           H        LEU   3  21.247  -4.335 -23.663
   14    HA   LEU   3           HA       LEU   3  21.772  -1.938 -25.120
   15    HB3  LEU   3           HB3      LEU   3  20.841  -0.870 -22.972
   16    HG   LEU   3           HG       LEU   3  19.543  -2.629 -24.940
   17   HD11  LEU   3          HD11      LEU   3  18.202  -2.006 -22.293
   18   HD12  LEU   3          HD12      LEU   3  18.522  -3.605 -22.963
   19   HD13  LEU   3          HD13      LEU   3  17.343  -2.545 -23.735
   20   HD21  LEU   3          HD21      LEU   3  19.762  -0.167 -25.153
   21   HD22  LEU   3          HD22      LEU   3  18.797   0.037 -23.691
   22   HD23  LEU   3          HD23      LEU   3  18.069  -0.664 -25.136
   23    HA   PRO   4           HA       PRO   4  25.737  -0.889 -23.439
   24    HB3  PRO   4           HB3      PRO   4  25.871   0.934 -24.827
   25    HG3  PRO   4           HG3      PRO   4  23.974   2.022 -25.500
   26    HD3  PRO   4           HD3      PRO   4  23.174  -0.132 -25.787
   27    H    GLY   5           H        GLY   5  22.972  -0.739 -21.759
   28    HA2  GLY   5           HA3      GLY   5  22.747  -0.907 -19.419
   29    HA3  GLY   5           HA2      GLY   5  24.333  -0.163 -19.236
   30    H    ARG   6           H        ARG   6  22.416   1.450 -21.501
   31    HA   ARG   6           HA       ARG   6  22.395   3.909 -20.313
   32    HB3  ARG   6           HB3      ARG   6  21.720   3.743 -22.589
   33    HG3  ARG   6           HG3      ARG   6  19.252   2.230 -21.692
   34    HD3  ARG   6           HD3      ARG   6  18.571   2.431 -23.845
   35    HE   ARG   6           HE       ARG   6  20.726   4.355 -24.387
   36   HH11  ARG   6          HH11      ARG   6  17.500   3.679 -23.327
   37   HH12  ARG   6          HH12      ARG   6  17.017   5.339 -23.312
   38   HH21  ARG   6          HH21      ARG   6  20.108   6.532 -24.329
   39   HH22  ARG   6          HH22      ARG   6  18.490   6.954 -23.876
   40    H    VAL   7           H        VAL   7  20.593   5.167 -19.399
   41    HA   VAL   7           HA       VAL   7  18.856   3.530 -17.646
   42    HB   VAL   7           HB       VAL   7  19.274   5.865 -16.240
   43   HG11  VAL   7          HG11      VAL   7  19.183   3.592 -15.317
   44   HG12  VAL   7          HG12      VAL   7  20.637   4.418 -14.756
   45   HG13  VAL   7          HG13      VAL   7  20.745   3.219 -16.045
   46   HG21  VAL   7          HG21      VAL   7  21.654   6.277 -16.217
   47   HG22  VAL   7          HG22      VAL   7  21.123   6.370 -17.896
   48   HG23  VAL   7          HG23      VAL   7  21.951   4.926 -17.311
   49    HA   PRO   8           HA       PRO   8  16.187   6.330 -20.192
   50    HB3  PRO   8           HB3      PRO   8  14.447   4.983 -20.830
   51    HG3  PRO   8           HG3      PRO   8  16.060   3.403 -21.184
   52    HD3  PRO   8           HD3      PRO   8  17.758   3.032 -19.666
   53    H    LEU   9           H        LEU   9  15.270   8.140 -19.404
   54    HA   LEU   9           HA       LEU   9  15.102   8.837 -16.730
   55    HB3  LEU   9           HB3      LEU   9  13.594  10.643 -17.448
   56    HG   LEU   9           HG       LEU   9  15.779   9.982 -19.446
   57   HD11  LEU   9          HD11      LEU   9  14.685  11.714 -20.517
   58   HD12  LEU   9          HD12      LEU   9  15.730  12.645 -19.444
   59   HD13  LEU   9          HD13      LEU   9  14.040  12.376 -19.015
   60   HD21  LEU   9          HD21      LEU   9  16.913  10.151 -17.427
   61   HD22  LEU   9          HD22      LEU   9  15.714  11.231 -16.719
   62   HD23  LEU   9          HD23      LEU   9  16.871  11.848 -17.897
   63    H    TRP  10           H        TRP  10  12.903   7.024 -18.695
   64    HA   TRP  10           HA       TRP  10  10.554   7.210 -17.158
   65    HB3  TRP  10           HB3      TRP  10  10.086   4.917 -18.230
   66    HD1  TRP  10           HD1      TRP  10  11.826   7.406 -20.598
   67    HE1  TRP  10           HE1      TRP  10  10.014   8.695 -21.902
   68    HE3  TRP  10           HE3      TRP  10   7.633   5.571 -18.335
   69    HZ2  TRP  10           HZ2      TRP  10   7.163   8.918 -21.976
   70    HZ3  TRP  10           HZ3      TRP  10   5.385   6.336 -19.039
   71    HH2  TRP  10           HH2      TRP  10   5.144   8.007 -20.856
   72    H    VAL  11           H        VAL  11  13.471   5.383 -16.725
   73    HA   VAL  11           HA       VAL  11  12.681   3.282 -15.115
   74    HB   VAL  11           HB       VAL  11  14.875   3.365 -14.058
   75   HG11  VAL  11          HG11      VAL  11  16.121   4.096 -16.401
   76   HG12  VAL  11          HG12      VAL  11  14.495   3.685 -16.951
   77   HG13  VAL  11          HG13      VAL  11  15.454   2.500 -16.065
   78   HG21  VAL  11          HG21      VAL  11  16.270   5.478 -14.986
   79   HG22  VAL  11          HG22      VAL  11  15.421   5.507 -13.443
   80   HG23  VAL  11          HG23      VAL  11  14.675   6.220 -14.872
   81    H    ILE  12           H        ILE  12  13.034   6.683 -14.274
   82    HA   ILE  12           HA       ILE  12  12.630   6.355 -11.463
   83    HB   ILE  12           HB       ILE  12  12.298   8.739 -13.294
   84   HG13  ILE  12          HG13      ILE  12  14.593   7.562 -12.673
   85   HG21  ILE  12          HG21      ILE  12  12.471   9.936 -10.974
   86   HG22  ILE  12          HG22      ILE  12  11.894   8.399 -10.331
   87   HG23  ILE  12          HG23      ILE  12  10.910   9.296 -11.488
   88   HD11  ILE  12          HD11      ILE  12  14.773   9.516 -13.925
   89   HD12  ILE  12          HD12      ILE  12  15.528  10.019 -12.412
   90   HD13  ILE  12          HD13      ILE  12  13.858  10.468 -12.757
   91    H    LEU  13           H        LEU  13  10.529   7.031 -14.187
   92    HA   LEU  13           HA       LEU  13   8.147   7.369 -12.579
   93    HB3  LEU  13           HB3      LEU  13   7.266   6.686 -15.117
   94    HG   LEU  13           HG       LEU  13   7.127   9.170 -15.457
   95   HD11  LEU  13          HD11      LEU  13   5.961   7.572 -13.396
   96   HD12  LEU  13          HD12      LEU  13   5.277   8.987 -14.199
   97   HD13  LEU  13          HD13      LEU  13   6.245   9.184 -12.738
   98   HD21  LEU  13          HD21      LEU  13   8.123   9.749 -12.751
   99   HD22  LEU  13          HD22      LEU  13   8.386  10.627 -14.257
  100   HD23  LEU  13          HD23      LEU  13   9.384   9.227 -13.868
  101    H    LEU  14           H        LEU  14   9.214   4.870 -14.855
  102    HA   LEU  14           HA       LEU  14   7.278   2.969 -14.312
  103    HB3  LEU  14           HB3      LEU  14   9.555   1.478 -14.869
  104    HG   LEU  14           HG       LEU  14   7.385   1.314 -16.001
  105   HD11  LEU  14          HD11      LEU  14   7.449   3.268 -17.976
  106   HD12  LEU  14          HD12      LEU  14   7.947   4.135 -16.522
  107   HD13  LEU  14          HD13      LEU  14   6.408   3.276 -16.552
  108   HD21  LEU  14          HD21      LEU  14   8.201   1.019 -18.288
  109   HD22  LEU  14          HD22      LEU  14   9.445   0.494 -17.153
  110   HD23  LEU  14          HD23      LEU  14   9.585   2.058 -17.955
  111    H    SER  15           H        SER  15  10.249   3.688 -12.559
  112    HA   SER  15           HA       SER  15   9.974   1.315 -10.888
  113    HB3  SER  15           HB3      SER  15  11.675   3.796 -10.477
  114    HG   SER  15           HG       SER  15  12.323   2.821  -8.727
  115    H    ALA  16           H        ALA  16   9.831   4.811 -10.264
  116    HA   ALA  16           HA       ALA  16   8.754   4.826  -7.776
  117    HB1  ALA  16           HB1      ALA  16   9.307   6.889  -8.963
  118    HB2  ALA  16           HB2      ALA  16   7.650   6.971  -8.364
  119    HB3  ALA  16           HB3      ALA  16   7.955   6.639 -10.068
  120    H    PHE  17           H        PHE  17   7.001   4.270 -10.819
  121    HA   PHE  17           HA       PHE  17   4.425   4.135  -9.575
  122    HB3  PHE  17           HB3      PHE  17   4.039   2.739 -11.826
  123    HD1  PHE  17           HD1      PHE  17   5.536   6.140 -11.257
  124    HD2  PHE  17           HD2      PHE  17   2.155   3.862 -12.610
  125    HE1  PHE  17           HE1      PHE  17   4.302   8.242 -11.715
  126    HE2  PHE  17           HE2      PHE  17   0.921   5.962 -13.067
  127    HZ   PHE  17           HZ       PHE  17   1.995   8.153 -12.620
  128    H    ALA  18           H        ALA  18   6.904   1.775 -10.462
  129    HA   ALA  18           HA       ALA  18   5.401  -0.554  -9.907
  130    HB1  ALA  18           HB1      ALA  18   8.393  -0.241  -9.606
  131    HB2  ALA  18           HB2      ALA  18   7.590  -0.444 -11.163
  132    HB3  ALA  18           HB3      ALA  18   7.497  -1.720  -9.949
  133    H    GLY  19           H        GLY  19   7.791   1.203  -7.902
  134    HA2  GLY  19           HA3      GLY  19   7.461  -0.406  -5.606
  135    HA3  GLY  19           HA2      GLY  19   8.146   1.215  -5.636
  136    H    LEU  20           H        LEU  20   5.715   2.420  -6.790
  137    HA   LEU  20           HA       LEU  20   4.429   3.253  -4.473
  138    HB3  LEU  20           HB3      LEU  20   3.120   3.079  -7.190
  139    HG   LEU  20           HG       LEU  20   2.187   3.992  -4.716
  140   HD11  LEU  20          HD11      LEU  20   2.072   6.400  -4.916
  141   HD12  LEU  20          HD12      LEU  20   2.878   6.353  -6.484
  142   HD13  LEU  20          HD13      LEU  20   3.768   5.927  -5.022
  143   HD21  LEU  20          HD21      LEU  20   0.391   5.037  -6.170
  144   HD22  LEU  20          HD22      LEU  20   0.737   3.346  -6.533
  145   HD23  LEU  20          HD23      LEU  20   1.380   4.619  -7.570
  146    H    LEU  21           H        LEU  21   3.597   0.627  -6.658
  147    HA   LEU  21           HA       LEU  21   1.112  -0.086  -5.666
  148    HB3  LEU  21           HB3      LEU  21   2.187  -2.502  -6.384
  149    HG   LEU  21           HG       LEU  21   0.176  -1.529  -7.343
  150   HD11  LEU  21          HD11      LEU  21   0.943   0.202  -9.333
  151   HD12  LEU  21          HD12      LEU  21   2.068   0.622  -8.042
  152   HD13  LEU  21          HD13      LEU  21   0.329   0.701  -7.758
  153   HD21  LEU  21          HD21      LEU  21   0.484  -2.831  -9.158
  154   HD22  LEU  21          HD22      LEU  21   2.216  -2.831  -8.828
  155   HD23  LEU  21          HD23      LEU  21   1.522  -1.607  -9.890
  156    H    LEU  22           H        LEU  22   4.315  -1.302  -4.662
  157    HA   LEU  22           HA       LEU  22   3.191  -2.954  -2.597
  158    HB3  LEU  22           HB3      LEU  22   6.026  -2.029  -2.469
  159    HG   LEU  22           HG       LEU  22   4.721  -3.874  -1.078
  160   HD11  LEU  22          HD11      LEU  22   5.727  -5.485  -3.438
  161   HD12  LEU  22          HD12      LEU  22   4.035  -5.031  -3.244
  162   HD13  LEU  22          HD13      LEU  22   4.812  -6.068  -2.049
  163   HD21  LEU  22          HD21      LEU  22   7.078  -3.379  -0.765
  164   HD22  LEU  22          HD22      LEU  22   7.491  -4.197  -2.272
  165   HD23  LEU  22          HD23      LEU  22   6.895  -5.128  -0.898
  166    H    LEU  23           H        LEU  23   4.955   0.122  -2.688
  167    HA   LEU  23           HA       LEU  23   5.005   0.697   0.012
  168    HB3  LEU  23           HB3      LEU  23   4.613   2.616  -2.296
  169    HG   LEU  23           HG       LEU  23   5.874   4.214  -0.757
  170   HD11  LEU  23          HD11      LEU  23   3.151   3.845  -1.077
  171   HD12  LEU  23          HD12      LEU  23   3.917   5.216  -0.284
  172   HD13  LEU  23          HD13      LEU  23   3.347   3.857   0.674
  173   HD21  LEU  23          HD21      LEU  23   4.820   2.492   1.484
  174   HD22  LEU  23          HD22      LEU  23   5.960   3.830   1.569
  175   HD23  LEU  23          HD23      LEU  23   6.458   2.296   0.860
  176    H    MET  24           H        MET  24   2.349   0.972  -2.224
  177    HA   MET  24           HA       MET  24   0.611   2.365  -0.348
  178    HB3  MET  24           HB3      MET  24  -0.053   0.887  -2.910
  179    HG3  MET  24           HG3      MET  24  -1.682   2.164  -0.829
  180    HE1  MET  24           HE1      MET  24  -4.428   3.300  -3.857
  181    HE2  MET  24           HE2      MET  24  -4.362   2.266  -2.432
  182    HE3  MET  24           HE3      MET  24  -3.623   1.726  -3.937
  183    H    LEU  25           H        LEU  25   0.692  -0.871  -1.761
  184    HA   LEU  25           HA       LEU  25  -1.297  -2.102  -0.351
  185    HB3  LEU  25           HB3      LEU  25   0.747  -4.038  -0.492
  186    HG   LEU  25           HG       LEU  25  -1.650  -4.288  -1.090
  187   HD11  LEU  25          HD11      LEU  25  -2.584  -2.777  -2.473
  188   HD12  LEU  25          HD12      LEU  25  -1.596  -3.410  -3.789
  189   HD13  LEU  25          HD13      LEU  25  -1.002  -2.070  -2.807
  190   HD21  LEU  25          HD21      LEU  25  -0.041  -5.936  -1.928
  191   HD22  LEU  25          HD22      LEU  25   0.316  -4.909  -3.317
  192   HD23  LEU  25          HD23      LEU  25  -1.280  -5.640  -3.148
  193    H    LEU  26           H        LEU  26   1.982  -1.441   0.839
  194    HA   LEU  26           HA       LEU  26   1.733  -3.052   3.171
  195    HB3  LEU  26           HB3      LEU  26   3.454  -0.615   2.605
  196    HG   LEU  26           HG       LEU  26   4.901  -1.601   4.470
  197   HD11  LEU  26          HD11      LEU  26   4.055  -0.081   5.919
  198   HD12  LEU  26          HD12      LEU  26   2.447  -0.794   5.885
  199   HD13  LEU  26          HD13      LEU  26   2.942   0.320   4.614
  200   HD21  LEU  26          HD21      LEU  26   2.340  -2.894   5.407
  201   HD22  LEU  26          HD22      LEU  26   3.973  -3.116   6.031
  202   HD23  LEU  26          HD23      LEU  26   3.535  -3.781   4.458
  203    H    ILE  27           H        ILE  27   1.313   0.398   2.577
  204    HA   ILE  27           HA       ILE  27   0.438   1.193   5.106
  205    HB   ILE  27           HB       ILE  27  -0.047   2.277   2.341
  206   HG13  ILE  27          HG13      ILE  27   2.204   2.429   3.517
  207   HG21  ILE  27          HG21      ILE  27  -1.204   3.161   4.979
  208   HG22  ILE  27          HG22      ILE  27  -2.007   3.012   3.415
  209   HG23  ILE  27          HG23      ILE  27  -0.880   4.338   3.706
  210   HD11  ILE  27          HD11      ILE  27   0.917   5.139   3.131
  211   HD12  ILE  27          HD12      ILE  27   1.297   4.079   1.773
  212   HD13  ILE  27          HD13      ILE  27   2.588   4.674   2.815
  213    H    LEU  28           H        LEU  28  -1.418   0.051   2.304
  214    HA   LEU  28           HA       LEU  28  -3.961   0.321   3.616
  215    HB3  LEU  28           HB3      LEU  28  -4.356  -1.574   1.646
  216    HG   LEU  28           HG       LEU  28  -5.000   0.401   0.230
  217   HD11  LEU  28          HD11      LEU  28  -6.159   1.354   2.673
  218   HD12  LEU  28          HD12      LEU  28  -6.026  -0.401   2.768
  219   HD13  LEU  28          HD13      LEU  28  -6.899   0.346   1.430
  220   HD21  LEU  28          HD21      LEU  28  -4.448   2.291   2.425
  221   HD22  LEU  28          HD22      LEU  28  -4.271   2.507   0.683
  222   HD23  LEU  28          HD23      LEU  28  -3.005   1.694   1.604
  223    H    ALA  29           H        ALA  29  -1.737  -2.343   2.968
  224    HA   ALA  29           HA       ALA  29  -3.170  -4.459   4.028
  225    HB1  ALA  29           HB1      ALA  29  -1.072  -4.912   2.962
  226    HB2  ALA  29           HB2      ALA  29  -0.917  -5.440   4.639
  227    HB3  ALA  29           HB3      ALA  29  -0.200  -3.915   4.125
  228    H    LEU  30           H        LEU  30  -0.960  -2.238   5.795
  229    HA   LEU  30           HA       LEU  30  -1.269  -3.339   8.337
  230    HB3  LEU  30           HB3      LEU  30  -1.274  -0.464   8.524
  231    HG   LEU  30           HG       LEU  30   0.987  -0.831   9.399
  232   HD11  LEU  30          HD11      LEU  30  -0.236  -3.248  10.509
  233   HD12  LEU  30          HD12      LEU  30  -1.359  -1.892  10.422
  234   HD13  LEU  30          HD13      LEU  30   0.159  -1.724  11.302
  235   HD21  LEU  30          HD21      LEU  30   0.942  -3.022   7.582
  236   HD22  LEU  30          HD22      LEU  30   1.137  -3.693   9.201
  237   HD23  LEU  30          HD23      LEU  30   2.280  -2.492   8.602
  238    H    TRP  31           H        TRP  31  -3.133  -0.769   6.827
  239    HA   TRP  31           HA       TRP  31  -4.943  -0.155   8.785
  240    HB3  TRP  31           HB3      TRP  31  -5.883  -0.551   5.945
  241    HD1  TRP  31           HD1      TRP  31  -8.292  -0.716   7.204
  242    HE1  TRP  31           HE1      TRP  31  -9.805   1.148   8.144
  243    HE3  TRP  31           HE3      TRP  31  -4.915   3.105   7.478
  244    HZ2  TRP  31           HZ2      TRP  31  -9.607   3.897   8.910
  245    HZ3  TRP  31           HZ3      TRP  31  -5.603   5.333   8.316
  246    HH2  TRP  31           HH2      TRP  31  -7.943   5.734   9.032
  247    H    LYS  32           H        LYS  32  -5.275  -2.902   6.507
  248    HA   LYS  32           HA       LYS  32  -7.717  -3.869   7.526
  249    HB3  LYS  32           HB3      LYS  32  -6.605  -6.148   6.689
  250    HG3  LYS  32           HG3      LYS  32  -8.489  -4.972   5.613
  251    HD3  LYS  32           HD3      LYS  32  -6.260  -3.165   4.742
  252    HE3  LYS  32           HE3      LYS  32  -8.117  -2.316   3.061
  253    HZ1  LYS  32           HZ1      LYS  32  -6.796  -4.729   2.106
  254    HZ2  LYS  32           HZ2      LYS  32  -5.795  -3.534   2.781
  255    HZ3  LYS  32           HZ3      LYS  32  -6.793  -3.163   1.458
  256    H    ILE  33           H        ILE  33  -4.370  -4.544   8.372
  257    HA   ILE  33           HA       ILE  33  -5.060  -6.383  10.500
  258    HB   ILE  33           HB       ILE  33  -2.400  -5.013  10.039
  259   HG13  ILE  33          HG13      ILE  33  -1.827  -7.142   8.797
  260   HG21  ILE  33          HG21      ILE  33  -1.600  -7.192  11.095
  261   HG22  ILE  33          HG22      ILE  33  -3.284  -7.500  11.519
  262   HG23  ILE  33          HG23      ILE  33  -2.454  -6.088  12.172
  263   HD11  ILE  33          HD11      ILE  33  -4.798  -7.511   8.461
  264   HD12  ILE  33          HD12      ILE  33  -3.939  -8.309   9.777
  265   HD13  ILE  33          HD13      ILE  33  -3.497  -8.646   8.105
  266    H    GLY  34           H        GLY  34  -5.086  -3.051  10.146
  267    HA2  GLY  34           HA3      GLY  34  -4.560  -2.511  12.987
  268    HA3  GLY  34           HA2      GLY  34  -4.731  -1.302  11.718
  269    H    PHE  35           H        PHE  35  -6.970  -1.309  10.648
  270    HA   PHE  35           HA       PHE  35  -8.925  -0.498  12.379
  271    HB3  PHE  35           HB3      PHE  35  -9.514  -2.058   9.856
  272    HD1  PHE  35           HD1      PHE  35 -10.314   1.302  11.306
  273    HD2  PHE  35           HD2      PHE  35 -11.798  -2.534  10.068
  274    HE1  PHE  35           HE1      PHE  35 -12.638   2.077  11.693
  275    HE2  PHE  35           HE2      PHE  35 -14.122  -1.760  10.455
  276    HZ   PHE  35           HZ       PHE  35 -14.542   0.546  11.268
  277    H    PHE  36           H        PHE  36  -8.512  -3.775  11.055
  278    HA   PHE  36           HA       PHE  36 -10.637  -5.029  12.339
  279    HB3  PHE  36           HB3      PHE  36  -7.913  -6.138  11.628
  280    HD1  PHE  36           HD1      PHE  36  -7.840  -7.357  13.826
  281    HD2  PHE  36           HD2      PHE  36 -11.038  -7.888  11.012
  282    HE1  PHE  36           HE1      PHE  36  -8.512  -9.444  14.988
  283    HE2  PHE  36           HE2      PHE  36 -11.711  -9.975  12.171
  284    HZ   PHE  36           HZ       PHE  36 -10.448 -10.753  14.158
  285    H    LYS  37           H        LYS  37  -7.591  -3.974  13.644
  286    HA   LYS  37           HA       LYS  37  -7.937  -5.501  16.110
  287    HB3  LYS  37           HB3      LYS  37  -5.851  -3.962  16.718
  288    HG3  LYS  37           HG3      LYS  37  -4.496  -5.672  15.194
  289    HD3  LYS  37           HD3      LYS  37  -5.342  -7.483  16.946
  290    HE3  LYS  37           HE3      LYS  37  -3.899  -4.903  17.614
  291    HZ1  LYS  37           HZ1      LYS  37  -3.442  -7.387  19.075
  292    HZ2  LYS  37           HZ2      LYS  37  -4.856  -6.521  19.445
  293    HZ3  LYS  37           HZ3      LYS  37  -3.335  -5.781  19.607
  294    H    ARG  38           H        ARG  38  -9.958  -3.528  15.333
  295    HA   ARG  38           HA       ARG  38 -10.096  -2.121  17.868
  296    HB3  ARG  38           HB3      ARG  38 -10.163  -0.526  15.300
  297    HG3  ARG  38           HG3      ARG  38 -10.274   0.200  18.240
  298    HD3  ARG  38           HD3      ARG  38  -9.205   1.664  16.006
  299    HE   ARG  38           HE       ARG  38 -11.263   3.354  17.155
  300   HH11  ARG  38          HH11      ARG  38 -10.324   1.220  14.597
  301   HH12  ARG  38          HH12      ARG  38 -11.448   1.874  13.453
  302   HH21  ARG  38          HH21      ARG  38 -12.739   4.217  15.659
  303   HH22  ARG  38          HH22      ARG  38 -12.815   3.570  14.054
  304    HA   PRO  39           HA       PRO  39 -14.115  -3.795  16.139
  305    HB3  PRO  39           HB3      PRO  39 -14.874  -5.197  17.798
  306    HG3  PRO  39           HG3      PRO  39 -12.720  -5.967  17.789
  307    HD3  PRO  39           HD3      PRO  39 -10.914  -4.533  17.726
  308    H    LEU  40           H        LEU  40 -15.980  -2.598  15.904
  309    HA   LEU  40           HA       LEU  40 -15.976   0.090  16.900
  310    HB3  LEU  40           HB3      LEU  40 -16.960   0.108  14.839
  311    HG   LEU  40           HG       LEU  40 -16.899  -2.310  14.457
  312   HD11  LEU  40          HD11      LEU  40 -19.179  -2.263  16.427
  313   HD12  LEU  40          HD12      LEU  40 -17.752  -3.300  16.419
  314   HD13  LEU  40          HD13      LEU  40 -19.043  -3.567  15.248
  315   HD21  LEU  40          HD21      LEU  40 -18.444  -2.181  12.797
  316   HD22  LEU  40          HD22      LEU  40 -18.716  -0.543  13.392
  317   HD23  LEU  40          HD23      LEU  40 -19.760  -1.860  13.926
  318    H    LYS  41           H        LYS  41 -17.398   1.084  18.259
  319    HA   LYS  41           HA       LYS  41 -17.991   0.671  20.652
  320    HB3  LYS  41           HB3      LYS  41 -20.569   1.159  20.209
  321    HG3  LYS  41           HG3      LYS  41 -18.920   2.767  21.094
  322    HD3  LYS  41           HD3      LYS  41 -18.178   3.062  18.169
  323    HE3  LYS  41           HE3      LYS  41 -16.473   4.674  19.573
  324    HZ1  LYS  41           HZ1      LYS  41 -17.603   6.428  18.524
  325    HZ2  LYS  41           HZ2      LYS  41 -19.087   5.603  18.539
  326    HZ3  LYS  41           HZ3      LYS  41 -17.833   5.084  17.516
  327    H    LYS  42           H        LYS  42 -17.823  -1.334  21.531
  328    HA   LYS  42           HA       LYS  42 -18.989  -3.713  20.859
  329    HB3  LYS  42           HB3      LYS  42 -17.489  -3.599  22.746
  330    HG3  LYS  42           HG3      LYS  42 -19.649  -1.869  23.979
  331    HD3  LYS  42           HD3      LYS  42 -17.707  -1.889  25.837
  332    HE3  LYS  42           HE3      LYS  42 -20.047  -3.760  25.459
  333    HZ1  LYS  42           HZ1      LYS  42 -19.795  -4.379  27.747
  334    HZ2  LYS  42           HZ2      LYS  42 -18.420  -3.396  27.917
  335    HZ3  LYS  42           HZ3      LYS  42 -18.367  -4.772  26.921
  336    H    LYS  43           H        LYS  43 -20.877  -4.833  21.962
  337    HA   LYS  43           HA       LYS  43 -23.247  -3.225  21.541
  338    HB3  LYS  43           HB3      LYS  43 -23.050  -5.624  20.816
  339    HG3  LYS  43           HG3      LYS  43 -23.466  -6.237  23.750
  340    HD3  LYS  43           HD3      LYS  43 -23.017  -8.534  23.015
  341    HE3  LYS  43           HE3      LYS  43 -25.013  -7.537  21.019
  342    HZ1  LYS  43           HZ1      LYS  43 -24.559  -9.925  21.725
  343    HZ2  LYS  43           HZ2      LYS  43 -26.178  -9.409  21.711
  344    HZ3  LYS  43           HZ3      LYS  43 -25.333  -9.524  23.180
  345    H    MET  44           H        MET  44 -25.101  -3.825  23.248
  346    HA   MET  44           HA       MET  44 -24.022  -3.312  25.956
  347    HB3  MET  44           HB3      MET  44 -25.905  -1.765  26.341
  348    HG3  MET  44           HG3      MET  44 -24.442  -0.948  23.824
  349    HE1  MET  44           HE1      MET  44 -23.630   2.510  25.455
  350    HE2  MET  44           HE2      MET  44 -24.059   2.143  23.786
  351    HE3  MET  44           HE3      MET  44 -22.963   1.077  24.663
  352    H    GLU  45           H        GLU  45 -27.224  -3.027  26.216
  353    HA   GLU  45           HA       GLU  45 -28.894  -4.363  27.053
  354    HB3  GLU  45           HB3      GLU  45 -27.771  -6.720  25.587
  355    HG3  GLU  45           HG3      GLU  45 -29.968  -6.634  26.929
  356    H    LYS  46           H        LYS  46 -25.868  -4.536  28.001
  357    HA   LYS  46           HA       LYS  46 -24.951  -5.346  29.966
  358    HB3  LYS  46           HB3      LYS  46 -27.132  -7.312  30.429
  359    HG3  LYS  46           HG3      LYS  46 -25.886  -5.204  32.210
  360    HD3  LYS  46           HD3      LYS  46 -27.454  -7.746  32.721
  361    HE3  LYS  46           HE3      LYS  46 -27.173  -6.896  35.162
  362    HZ1  LYS  46           HZ1      LYS  46 -26.081  -8.815  35.021
  363    HZ2  LYS  46           HZ2      LYS  46 -24.671  -7.882  34.857
  364    HZ3  LYS  46           HZ3      LYS  46 -25.467  -8.475  33.477
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1  20.082 -13.495 -13.996
    2    H2   MET   1           H2       MET   1  18.793 -14.568 -13.727
    3    H3   MET   1           H3       MET   1  18.566 -12.897 -13.523
    4    HA   MET   1           HA       MET   1  18.598 -14.493 -15.950
    5    HB3  MET   1           HB3      MET   1  17.029 -12.665 -16.637
    6    HG3  MET   1           HG3      MET   1  16.719 -14.498 -14.368
    7    HE1  MET   1           HE1      MET   1  15.097 -10.827 -15.328
    8    HE2  MET   1           HE2      MET   1  13.472 -11.370 -14.918
    9    HE3  MET   1           HE3      MET   1  14.408 -12.249 -16.123
   10    H    GLY   2           H        GLY   2  18.405 -11.160 -16.453
   11    HA2  GLY   2           HA3      GLY   2  21.146 -10.502 -16.815
   12    HA3  GLY   2           HA2      GLY   2  20.443 -11.027 -18.342
   13    H    LEU   3           H        LEU   3  20.419  -8.571 -15.857
   14    HA   LEU   3           HA       LEU   3  18.305  -7.014 -17.000
   15    HB3  LEU   3           HB3      LEU   3  19.745  -5.233 -15.505
   16    HG   LEU   3           HG       LEU   3  17.364  -5.788 -15.238
   17   HD11  LEU   3          HD11      LEU   3  17.182  -7.883 -13.512
   18   HD12  LEU   3          HD12      LEU   3  18.542  -8.406 -14.503
   19   HD13  LEU   3          HD13      LEU   3  16.990  -8.042 -15.258
   20   HD21  LEU   3          HD21      LEU   3  17.327  -5.080 -13.065
   21   HD22  LEU   3          HD22      LEU   3  19.075  -4.977 -13.272
   22   HD23  LEU   3          HD23      LEU   3  18.358  -6.400 -12.515
   23    HA   PRO   4           HA       PRO   4  20.138  -4.863 -20.394
   24    HB3  PRO   4           HB3      PRO   4  19.311  -2.703 -20.487
   25    HG3  PRO   4           HG3      PRO   4  17.358  -3.728 -19.937
   26    HD3  PRO   4           HD3      PRO   4  17.434  -5.552 -18.578
   27    H    GLY   5           H        GLY   5  21.229  -4.292 -17.108
   28    HA2  GLY   5           HA3      GLY   5  23.476  -4.372 -16.406
   29    HA3  GLY   5           HA2      GLY   5  23.987  -4.000 -18.052
   30    H    ARG   6           H        ARG   6  21.678  -1.947 -17.949
   31    HA   ARG   6           HA       ARG   6  22.923   0.121 -16.263
   32    HB3  ARG   6           HB3      ARG   6  22.009   1.345 -18.679
   33    HG3  ARG   6           HG3      ARG   6  23.823   2.079 -17.018
   34    HD3  ARG   6           HD3      ARG   6  25.950   0.909 -18.599
   35    HE   ARG   6           HE       ARG   6  25.675   1.733 -16.004
   36   HH11  ARG   6          HH11      ARG   6  26.681  -1.172 -17.590
   37   HH12  ARG   6          HH12      ARG   6  27.811  -1.622 -16.357
   38   HH21  ARG   6          HH21      ARG   6  27.162   1.154 -14.383
   39   HH22  ARG   6          HH22      ARG   6  28.083  -0.304 -14.540
   40    H    VAL   7           H        VAL   7  21.392   1.496 -15.304
   41    HA   VAL   7           HA       VAL   7  18.593   0.854 -15.911
   42    HB   VAL   7           HB       VAL   7  18.218   2.016 -13.677
   43   HG11  VAL   7          HG11      VAL   7  19.647  -0.573 -14.142
   44   HG12  VAL   7          HG12      VAL   7  18.018  -0.288 -13.531
   45   HG13  VAL   7          HG13      VAL   7  19.410  -0.032 -12.480
   46   HG21  VAL   7          HG21      VAL   7  20.948   1.429 -12.819
   47   HG22  VAL   7          HG22      VAL   7  19.976   2.872 -12.538
   48   HG23  VAL   7          HG23      VAL   7  20.902   2.711 -14.029
   49    HA   PRO   8           HA       PRO   8  18.991   5.109 -17.649
   50    HB3  PRO   8           HB3      PRO   8  18.511   4.433 -19.776
   51    HG3  PRO   8           HG3      PRO   8  17.524   2.423 -20.139
   52    HD3  PRO   8           HD3      PRO   8  18.787   1.543 -18.449
   53    H    LEU   9           H        LEU   9  17.777   6.992 -17.313
   54    HA   LEU   9           HA       LEU   9  16.261   7.273 -15.064
   55    HB3  LEU   9           HB3      LEU   9  15.447   9.364 -15.969
   56    HG   LEU   9           HG       LEU   9  18.130   8.598 -15.860
   57   HD11  LEU   9          HD11      LEU   9  18.072   8.550 -18.371
   58   HD12  LEU   9          HD12      LEU   9  19.205   9.732 -17.716
   59   HD13  LEU   9          HD13      LEU   9  17.646  10.260 -18.349
   60   HD21  LEU   9          HD21      LEU   9  17.255  10.506 -14.678
   61   HD22  LEU   9          HD22      LEU   9  16.786  11.296 -16.183
   62   HD23  LEU   9          HD23      LEU   9  18.493  11.112 -15.778
   63    H    TRP  10           H        TRP  10  15.255   6.085 -18.166
   64    HA   TRP  10           HA       TRP  10  12.497   6.394 -18.106
   65    HB3  TRP  10           HB3      TRP  10  12.982   3.780 -19.032
   66    HD1  TRP  10           HD1      TRP  10  10.688   5.710 -19.543
   67    HE1  TRP  10           HE1      TRP  10  10.199   6.644 -21.896
   68    HE3  TRP  10           HE3      TRP  10  15.269   5.080 -21.710
   69    HZ2  TRP  10           HZ2      TRP  10  11.571   7.066 -24.371
   70    HZ3  TRP  10           HZ3      TRP  10  15.650   5.757 -24.064
   71    HH2  TRP  10           HH2      TRP  10  13.810   6.748 -25.395
   72    H    VAL  11           H        VAL  11  14.532   3.900 -16.652
   73    HA   VAL  11           HA       VAL  11  12.553   2.229 -15.610
   74    HB   VAL  11           HB       VAL  11  15.367   2.847 -14.750
   75   HG11  VAL  11          HG11      VAL  11  13.269   1.212 -13.340
   76   HG12  VAL  11          HG12      VAL  11  14.465   2.312 -12.652
   77   HG13  VAL  11          HG13      VAL  11  14.965   0.734 -13.259
   78   HG21  VAL  11          HG21      VAL  11  14.553   1.376 -16.787
   79   HG22  VAL  11          HG22      VAL  11  14.239   0.176 -15.533
   80   HG23  VAL  11          HG23      VAL  11  15.870   0.805 -15.762
   81    H    ILE  12           H        ILE  12  13.964   5.180 -14.268
   82    HA   ILE  12           HA       ILE  12  12.934   5.061 -11.685
   83    HB   ILE  12           HB       ILE  12  13.219   7.562 -13.354
   84   HG13  ILE  12          HG13      ILE  12  15.249   6.067 -13.348
   85   HG21  ILE  12          HG21      ILE  12  13.247   7.005 -10.371
   86   HG22  ILE  12          HG22      ILE  12  12.044   7.941 -11.257
   87   HG23  ILE  12          HG23      ILE  12  13.689   8.552 -11.091
   88   HD11  ILE  12          HD11      ILE  12  15.672   8.534 -11.651
   89   HD12  ILE  12          HD12      ILE  12  15.311   8.620 -13.376
   90   HD13  ILE  12          HD13      ILE  12  16.783   7.822 -12.823
   91    H    LEU  13           H        LEU  13  11.419   6.398 -14.601
   92    HA   LEU  13           HA       LEU  13   9.095   7.428 -13.496
   93    HB3  LEU  13           HB3      LEU  13   8.088   6.534 -15.793
   94    HG   LEU  13           HG       LEU  13  10.028   8.737 -15.197
   95   HD11  LEU  13          HD11      LEU  13   9.034   7.925 -17.937
   96   HD12  LEU  13          HD12      LEU  13  10.697   8.224 -17.434
   97   HD13  LEU  13          HD13      LEU  13   9.562   9.567 -17.568
   98   HD21  LEU  13          HD21      LEU  13   7.282   8.912 -16.428
   99   HD22  LEU  13          HD22      LEU  13   8.117  10.096 -15.423
  100   HD23  LEU  13          HD23      LEU  13   7.469   8.625 -14.698
  101    H    LEU  14           H        LEU  14   9.741   4.135 -14.642
  102    HA   LEU  14           HA       LEU  14   7.212   3.102 -13.830
  103    HB3  LEU  14           HB3      LEU  14   9.783   1.585 -14.323
  104    HG   LEU  14           HG       LEU  14   7.207   0.786 -13.476
  105   HD11  LEU  14          HD11      LEU  14   7.783  -0.025 -16.342
  106   HD12  LEU  14          HD12      LEU  14   6.489   1.061 -15.833
  107   HD13  LEU  14          HD13      LEU  14   6.465  -0.632 -15.340
  108   HD21  LEU  14          HD21      LEU  14   8.198  -1.504 -13.838
  109   HD22  LEU  14          HD22      LEU  14   9.248  -0.409 -12.939
  110   HD23  LEU  14          HD23      LEU  14   9.561  -0.727 -14.646
  111    H    SER  15           H        SER  15  10.349   3.471 -12.354
  112    HA   SER  15           HA       SER  15  10.108   1.677 -10.222
  113    HB3  SER  15           HB3      SER  15  11.780   2.969  -9.069
  114    HG   SER  15           HG       SER  15  13.279   3.050 -10.701
  115    H    ALA  16           H        ALA  16   9.293   5.184 -10.242
  116    HA   ALA  16           HA       ALA  16   8.063   5.173  -7.721
  117    HB1  ALA  16           HB1      ALA  16   8.815   7.168  -9.161
  118    HB2  ALA  16           HB2      ALA  16   7.302   7.345  -8.272
  119    HB3  ALA  16           HB3      ALA  16   7.275   6.985  -9.999
  120    H    PHE  17           H        PHE  17   6.932   4.319 -10.921
  121    HA   PHE  17           HA       PHE  17   4.140   4.394 -10.400
  122    HB3  PHE  17           HB3      PHE  17   5.582   2.527 -12.288
  123    HD1  PHE  17           HD1      PHE  17   2.806   4.852 -12.974
  124    HD2  PHE  17           HD2      PHE  17   3.901   0.796 -12.083
  125    HE1  PHE  17           HE1      PHE  17   0.539   4.095 -13.637
  126    HE2  PHE  17           HE2      PHE  17   1.635   0.038 -12.747
  127    HZ   PHE  17           HZ       PHE  17  -0.046   1.687 -13.524
  128    H    ALA  18           H        ALA  18   6.601   1.879 -10.013
  129    HA   ALA  18           HA       ALA  18   4.730  -0.111  -9.097
  130    HB1  ALA  18           HB1      ALA  18   6.731  -1.401  -8.508
  131    HB2  ALA  18           HB2      ALA  18   7.738   0.024  -8.763
  132    HB3  ALA  18           HB3      ALA  18   6.898  -0.718 -10.125
  133    H    GLY  19           H        GLY  19   6.783   2.318  -7.637
  134    HA2  GLY  19           HA3      GLY  19   6.530   1.453  -4.935
  135    HA3  GLY  19           HA2      GLY  19   7.021   3.060  -5.463
  136    H    LEU  20           H        LEU  20   4.780   3.840  -6.898
  137    HA   LEU  20           HA       LEU  20   3.055   4.775  -4.853
  138    HB3  LEU  20           HB3      LEU  20   1.620   5.072  -7.195
  139    HG   LEU  20           HG       LEU  20   2.725   7.329  -7.285
  140   HD11  LEU  20          HD11      LEU  20   1.222   7.839  -5.695
  141   HD12  LEU  20          HD12      LEU  20   2.340   7.279  -4.454
  142   HD13  LEU  20          HD13      LEU  20   1.193   6.153  -5.178
  143   HD21  LEU  20          HD21      LEU  20   4.892   6.017  -6.226
  144   HD22  LEU  20          HD22      LEU  20   4.226   6.809  -4.799
  145   HD23  LEU  20          HD23      LEU  20   4.679   7.767  -6.206
  146    H    LEU  21           H        LEU  21   2.932   2.065  -7.006
  147    HA   LEU  21           HA       LEU  21   0.169   1.387  -6.499
  148    HB3  LEU  21           HB3      LEU  21   1.647  -0.889  -7.388
  149    HG   LEU  21           HG       LEU  21  -0.163   1.094  -8.799
  150   HD11  LEU  21          HD11      LEU  21   1.283  -1.298  -9.712
  151   HD12  LEU  21          HD12      LEU  21   0.507  -0.024 -10.655
  152   HD13  LEU  21          HD13      LEU  21  -0.452  -1.363 -10.023
  153   HD21  LEU  21          HD21      LEU  21  -1.340  -1.464  -8.282
  154   HD22  LEU  21          HD22      LEU  21  -1.818   0.103  -7.632
  155   HD23  LEU  21          HD23      LEU  21  -0.627  -0.879  -6.779
  156    H    LEU  22           H        LEU  22   3.306   0.143  -5.443
  157    HA   LEU  22           HA       LEU  22   2.191  -1.790  -3.643
  158    HB3  LEU  22           HB3      LEU  22   4.992  -0.809  -3.338
  159    HG   LEU  22           HG       LEU  22   3.696  -2.841  -2.207
  160   HD11  LEU  22          HD11      LEU  22   4.025  -4.924  -3.440
  161   HD12  LEU  22          HD12      LEU  22   4.778  -4.048  -4.772
  162   HD13  LEU  22          HD13      LEU  22   3.065  -3.816  -4.420
  163   HD21  LEU  22          HD21      LEU  22   5.909  -4.040  -2.098
  164   HD22  LEU  22          HD22      LEU  22   6.016  -2.317  -1.738
  165   HD23  LEU  22          HD23      LEU  22   6.517  -2.920  -3.318
  166    H    LEU  23           H        LEU  23   3.359   1.467  -3.439
  167    HA   LEU  23           HA       LEU  23   3.729   1.762  -0.678
  168    HB3  LEU  23           HB3      LEU  23   2.541   4.125  -1.135
  169    HG   LEU  23           HG       LEU  23   5.237   3.076  -1.958
  170   HD11  LEU  23          HD11      LEU  23   3.989   5.683  -2.667
  171   HD12  LEU  23          HD12      LEU  23   5.276   4.793  -3.481
  172   HD13  LEU  23          HD13      LEU  23   5.637   5.746  -2.041
  173   HD21  LEU  23          HD21      LEU  23   4.208   3.748   0.461
  174   HD22  LEU  23          HD22      LEU  23   4.838   5.316  -0.044
  175   HD23  LEU  23          HD23      LEU  23   5.917   3.924   0.061
  176    H    MET  24           H        MET  24   0.688   2.381  -2.457
  177    HA   MET  24           HA       MET  24  -1.009   2.699  -0.337
  178    HB3  MET  24           HB3      MET  24  -2.032   0.964  -2.530
  179    HG3  MET  24           HG3      MET  24  -3.394   2.163  -0.728
  180    HE1  MET  24           HE1      MET  24  -5.183   4.589  -1.983
  181    HE2  MET  24           HE2      MET  24  -4.646   5.884  -0.916
  182    HE3  MET  24           HE3      MET  24  -4.933   4.273  -0.260
  183    H    LEU  25           H        LEU  25   0.026  -0.406  -1.754
  184    HA   LEU  25           HA       LEU  25  -1.519  -2.131  -0.213
  185    HB3  LEU  25           HB3      LEU  25   1.299  -2.921  -0.713
  186    HG   LEU  25           HG       LEU  25  -0.788  -4.354  -0.049
  187   HD11  LEU  25          HD11      LEU  25  -1.192  -4.678  -2.977
  188   HD12  LEU  25          HD12      LEU  25  -1.885  -3.227  -2.252
  189   HD13  LEU  25          HD13      LEU  25  -2.354  -4.821  -1.657
  190   HD21  LEU  25          HD21      LEU  25   1.260  -5.459  -0.526
  191   HD22  LEU  25          HD22      LEU  25   1.214  -4.983  -2.224
  192   HD23  LEU  25          HD23      LEU  25   0.092  -6.204  -1.619
  193    H    LEU  26           H        LEU  26   1.687  -0.774   0.480
  194    HA   LEU  26           HA       LEU  26   2.163  -2.036   2.919
  195    HB3  LEU  26           HB3      LEU  26   3.240   0.482   3.303
  196    HG   LEU  26           HG       LEU  26   5.304  -0.528   2.291
  197   HD11  LEU  26          HD11      LEU  26   5.514  -1.502   4.304
  198   HD12  LEU  26          HD12      LEU  26   4.516  -2.850   3.763
  199   HD13  LEU  26          HD13      LEU  26   3.765  -1.443   4.517
  200   HD21  LEU  26          HD21      LEU  26   3.973  -3.129   1.889
  201   HD22  LEU  26          HD22      LEU  26   5.225  -2.345   0.926
  202   HD23  LEU  26          HD23      LEU  26   3.534  -1.899   0.703
  203    H    ILE  27           H        ILE  27   0.177   0.762   2.193
  204    HA   ILE  27           HA       ILE  27  -0.357   1.339   5.005
  205    HB   ILE  27           HB       ILE  27  -1.406   2.402   2.388
  206   HG13  ILE  27          HG13      ILE  27   0.733   3.195   3.620
  207   HG21  ILE  27          HG21      ILE  27  -2.641   2.605   5.125
  208   HG22  ILE  27          HG22      ILE  27  -3.431   2.358   3.568
  209   HG23  ILE  27          HG23      ILE  27  -2.786   3.945   3.987
  210   HD11  ILE  27          HD11      ILE  27   0.054   5.639   3.218
  211   HD12  ILE  27          HD12      ILE  27  -1.534   5.008   2.781
  212   HD13  ILE  27          HD13      ILE  27  -0.111   4.540   1.850
  213    H    LEU  28           H        LEU  28  -2.287   0.328   2.257
  214    HA   LEU  28           HA       LEU  28  -4.619  -0.447   3.462
  215    HB3  LEU  28           HB3      LEU  28  -4.195  -2.483   1.576
  216    HG   LEU  28           HG       LEU  28  -6.211  -1.083   1.863
  217   HD11  LEU  28          HD11      LEU  28  -4.261   1.022   1.433
  218   HD12  LEU  28          HD12      LEU  28  -5.913   1.146   2.037
  219   HD13  LEU  28          HD13      LEU  28  -5.604   1.177   0.301
  220   HD21  LEU  28          HD21      LEU  28  -6.272  -2.152  -0.211
  221   HD22  LEU  28          HD22      LEU  28  -4.849  -1.297  -0.806
  222   HD23  LEU  28          HD23      LEU  28  -6.397  -0.461  -0.695
  223    H    ALA  29           H        ALA  29  -1.675  -2.439   3.167
  224    HA   ALA  29           HA       ALA  29  -2.753  -4.719   4.468
  225    HB1  ALA  29           HB1      ALA  29   0.147  -3.854   4.387
  226    HB2  ALA  29           HB2      ALA  29  -0.665  -4.706   3.071
  227    HB3  ALA  29           HB3      ALA  29  -0.467  -5.488   4.640
  228    H    LEU  30           H        LEU  30  -1.140  -1.833   5.555
  229    HA   LEU  30           HA       LEU  30  -0.505  -2.437   8.184
  230    HB3  LEU  30           HB3      LEU  30  -1.831   0.187   7.587
  231    HG   LEU  30           HG       LEU  30  -0.578  -0.668   9.772
  232   HD11  LEU  30          HD11      LEU  30   1.748   0.624   8.396
  233   HD12  LEU  30          HD12      LEU  30   1.461  -1.095   8.131
  234   HD13  LEU  30          HD13      LEU  30   1.735  -0.489   9.765
  235   HD21  LEU  30          HD21      LEU  30  -0.139   2.049   8.490
  236   HD22  LEU  30          HD22      LEU  30   0.077   1.692  10.204
  237   HD23  LEU  30          HD23      LEU  30  -1.524   1.578   9.474
  238    H    TRP  31           H        TRP  31  -3.621  -1.558   6.793
  239    HA   TRP  31           HA       TRP  31  -5.079  -1.451   9.220
  240    HB3  TRP  31           HB3      TRP  31  -7.015  -2.006   7.476
  241    HD1  TRP  31           HD1      TRP  31  -4.394   0.820   7.051
  242    HE1  TRP  31           HE1      TRP  31  -5.499   3.041   7.752
  243    HE3  TRP  31           HE3      TRP  31  -8.998  -0.890   8.450
  244    HZ2  TRP  31           HZ2      TRP  31  -8.005   3.968   8.772
  245    HZ3  TRP  31           HZ3      TRP  31 -10.724   0.682   9.283
  246    HH2  TRP  31           HH2      TRP  31 -10.233   3.108   9.445
  247    H    LYS  32           H        LYS  32  -4.261  -4.047   7.043
  248    HA   LYS  32           HA       LYS  32  -6.085  -5.998   8.098
  249    HB3  LYS  32           HB3      LYS  32  -4.592  -7.683   7.112
  250    HG3  LYS  32           HG3      LYS  32  -4.925  -5.222   5.369
  251    HD3  LYS  32           HD3      LYS  32  -3.430  -6.939   4.390
  252    HE3  LYS  32           HE3      LYS  32  -5.679  -8.704   5.251
  253    HZ1  LYS  32           HZ1      LYS  32  -4.934  -8.630   2.629
  254    HZ2  LYS  32           HZ2      LYS  32  -5.693  -9.932   3.414
  255    HZ3  LYS  32           HZ3      LYS  32  -4.001  -9.895   3.266
  256    H    ILE  33           H        ILE  33  -2.681  -5.320   8.671
  257    HA   ILE  33           HA       ILE  33  -2.423  -7.023  10.941
  258    HB   ILE  33           HB       ILE  33  -0.727  -4.654  10.104
  259   HG13  ILE  33          HG13      ILE  33  -1.031  -6.596   8.460
  260   HG21  ILE  33          HG21      ILE  33   0.942  -6.327  11.413
  261   HG22  ILE  33          HG22      ILE  33  -0.550  -6.665  12.289
  262   HG23  ILE  33          HG23      ILE  33   0.079  -5.019  12.219
  263   HD11  ILE  33          HD11      ILE  33   0.877  -5.483   7.889
  264   HD12  ILE  33          HD12      ILE  33   1.671  -6.914   8.550
  265   HD13  ILE  33          HD13      ILE  33   1.483  -5.472   9.546
  266    H    GLY  34           H        GLY  34  -4.393  -4.524  10.663
  267    HA2  GLY  34           HA3      GLY  34  -3.921  -3.539  13.417
  268    HA3  GLY  34           HA2      GLY  34  -4.572  -2.529  12.134
  269    H    PHE  35           H        PHE  35  -5.249  -5.730  13.541
  270    HA   PHE  35           HA       PHE  35  -7.279  -6.798  13.830
  271    HB3  PHE  35           HB3      PHE  35  -7.791  -4.189  15.277
  272    HD1  PHE  35           HD1      PHE  35  -8.053  -7.777  16.265
  273    HD2  PHE  35           HD2      PHE  35 -10.163  -4.181  15.244
  274    HE1  PHE  35           HE1      PHE  35 -10.188  -8.838  16.951
  275    HE2  PHE  35           HE2      PHE  35 -12.303  -5.240  15.932
  276    HZ   PHE  35           HZ       PHE  35 -12.313  -7.570  16.784
  277    H    PHE  36           H        PHE  36  -7.349  -5.871  11.306
  278    HA   PHE  36           HA       PHE  36 -10.105  -4.908  11.026
  279    HB3  PHE  36           HB3      PHE  36  -8.084  -4.371   8.889
  280    HD1  PHE  36           HD1      PHE  36 -10.261  -2.128  10.863
  281    HD2  PHE  36           HD2      PHE  36  -9.837  -4.413   7.255
  282    HE1  PHE  36           HE1      PHE  36 -12.304  -1.049   9.938
  283    HE2  PHE  36           HE2      PHE  36 -11.875  -3.342   6.332
  284    HZ   PHE  36           HZ       PHE  36 -13.109  -1.660   7.674
  285    H    LYS  37           H        LYS  37  -8.066  -7.406  10.807
  286    HA   LYS  37           HA       LYS  37  -8.595  -8.517   8.237
  287    HB3  LYS  37           HB3      LYS  37  -8.222 -10.592  10.173
  288    HG3  LYS  37           HG3      LYS  37  -6.036 -10.775   8.989
  289    HD3  LYS  37           HD3      LYS  37  -7.648 -10.255   6.650
  290    HE3  LYS  37           HE3      LYS  37  -7.597 -12.737   6.534
  291    HZ1  LYS  37           HZ1      LYS  37  -4.915 -12.192   7.432
  292    HZ2  LYS  37           HZ2      LYS  37  -5.527 -11.018   6.368
  293    HZ3  LYS  37           HZ3      LYS  37  -5.473 -12.649   5.897
  294    H    ARG  38           H        ARG  38  -9.989  -9.254  11.437
  295    HA   ARG  38           HA       ARG  38 -12.023 -10.112  12.058
  296    HB3  ARG  38           HB3      ARG  38 -12.989  -9.138   9.374
  297    HG3  ARG  38           HG3      ARG  38 -14.439  -9.094  12.017
  298    HD3  ARG  38           HD3      ARG  38 -15.186  -7.804   9.932
  299    HE   ARG  38           HE       ARG  38 -14.850 -10.199   8.624
  300   HH11  ARG  38          HH11      ARG  38 -17.472  -8.029   9.249
  301   HH12  ARG  38          HH12      ARG  38 -18.316  -8.410   7.785
  302   HH21  ARG  38          HH21      ARG  38 -15.952 -10.705   6.705
  303   HH22  ARG  38          HH22      ARG  38 -17.456  -9.925   6.345
  304    HA   PRO  39           HA       PRO  39 -11.449 -13.831   9.368
  305    HB3  PRO  39           HB3      PRO  39  -9.525 -14.474  10.462
  306    HG3  PRO  39           HG3      PRO  39  -9.070 -13.731  12.558
  307    HD3  PRO  39           HD3      PRO  39  -9.853 -11.650  12.030
  308    H    LEU  40           H        LEU  40 -12.076 -15.238  12.468
  309    HA   LEU  40           HA       LEU  40 -13.855 -16.913  12.618
  310    HB3  LEU  40           HB3      LEU  40 -13.765 -15.528  14.556
  311    HG   LEU  40           HG       LEU  40 -14.456 -13.455  12.664
  312   HD11  LEU  40          HD11      LEU  40 -16.201 -13.713  15.133
  313   HD12  LEU  40          HD12      LEU  40 -16.731 -13.575  13.456
  314   HD13  LEU  40          HD13      LEU  40 -15.979 -12.197  14.260
  315   HD21  LEU  40          HD21      LEU  40 -13.498 -12.037  14.384
  316   HD22  LEU  40          HD22      LEU  40 -12.558 -13.529  14.323
  317   HD23  LEU  40          HD23      LEU  40 -13.742 -13.284  15.607
  318    H    LYS  41           H        LYS  41 -14.671 -17.432  10.531
  319    HA   LYS  41           HA       LYS  41 -16.304 -15.922   8.915
  320    HB3  LYS  41           HB3      LYS  41 -17.402 -18.389   8.592
  321    HG3  LYS  41           HG3      LYS  41 -15.393 -18.778   7.044
  322    HD3  LYS  41           HD3      LYS  41 -17.420 -16.688   7.016
  323    HE3  LYS  41           HE3      LYS  41 -14.887 -16.214   5.417
  324    HZ1  LYS  41           HZ1      LYS  41 -17.383 -15.714   4.645
  325    HZ2  LYS  41           HZ2      LYS  41 -16.056 -14.750   4.202
  326    HZ3  LYS  41           HZ3      LYS  41 -17.053 -14.286   5.496
  327    H    LYS  42           H        LYS  42 -17.629 -18.441  11.074
  328    HA   LYS  42           HA       LYS  42 -19.730 -18.642  12.009
  329    HB3  LYS  42           HB3      LYS  42 -20.414 -16.614  13.335
  330    HG3  LYS  42           HG3      LYS  42 -18.034 -16.569  14.539
  331    HD3  LYS  42           HD3      LYS  42 -18.661 -19.047  15.265
  332    HE3  LYS  42           HE3      LYS  42 -20.697 -17.952  16.487
  333    HZ1  LYS  42           HZ1      LYS  42 -19.200 -17.410  18.036
  334    HZ2  LYS  42           HZ2      LYS  42 -18.361 -16.344  17.014
  335    HZ3  LYS  42           HZ3      LYS  42 -18.051 -18.013  16.944
  336    H    LYS  43           H        LYS  43 -21.109 -19.038  10.305
  337    HA   LYS  43           HA       LYS  43 -22.699 -16.732   9.399
  338    HB3  LYS  43           HB3      LYS  43 -22.705 -17.622   7.091
  339    HG3  LYS  43           HG3      LYS  43 -19.827 -17.298   7.910
  340    HD3  LYS  43           HD3      LYS  43 -20.991 -17.414   5.481
  341    HE3  LYS  43           HE3      LYS  43 -20.920 -14.458   6.131
  342    HZ1  LYS  43           HZ1      LYS  43 -21.395 -16.100   3.762
  343    HZ2  LYS  43           HZ2      LYS  43 -20.638 -14.586   3.897
  344    HZ3  LYS  43           HZ3      LYS  43 -22.332 -14.697   3.938
  345    H    MET  44           H        MET  44 -24.812 -17.097   9.577
  346    HA   MET  44           HA       MET  44 -25.812 -19.569  10.577
  347    HB3  MET  44           HB3      MET  44 -28.026 -18.501  10.340
  348    HG3  MET  44           HG3      MET  44 -25.699 -17.270  11.666
  349    HE1  MET  44           HE1      MET  44 -24.959 -14.999  11.213
  350    HE2  MET  44           HE2      MET  44 -25.958 -13.785  10.419
  351    HE3  MET  44           HE3      MET  44 -25.707 -15.351   9.649
  352    H    GLU  45           H        GLU  45 -26.819 -21.236   9.569
  353    HA   GLU  45           HA       GLU  45 -26.474 -21.498   6.719
  354    HB3  GLU  45           HB3      GLU  45 -28.087 -23.434   8.336
  355    HG3  GLU  45           HG3      GLU  45 -25.894 -23.727   6.259
  356    H    LYS  46           H        LYS  46 -29.056 -23.197   6.755
  357    HA   LYS  46           HA       LYS  46 -31.182 -21.256   6.859
  358    HB3  LYS  46           HB3      LYS  46 -31.374 -22.119   4.192
  359    HG3  LYS  46           HG3      LYS  46 -30.593 -19.488   5.473
  360    HD3  LYS  46           HD3      LYS  46 -29.750 -19.494   3.185
  361    HE3  LYS  46           HE3      LYS  46 -32.454 -20.688   2.633
  362    HZ1  LYS  46           HZ1      LYS  46 -32.626 -19.708   0.655
  363    HZ2  LYS  46           HZ2      LYS  46 -30.966 -19.865   0.322
  364    HZ3  LYS  46           HZ3      LYS  46 -31.531 -18.554   1.242
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1  32.137   1.386  -7.441
    2    H2   MET   1           H2       MET   1  33.362   0.433  -6.753
    3    H3   MET   1           H3       MET   1  31.860  -0.260  -7.144
    4    HA   MET   1           HA       MET   1  34.151  -0.009  -8.750
    5    HB3  MET   1           HB3      MET   1  32.877  -2.027  -8.738
    6    HG3  MET   1           HG3      MET   1  30.410  -1.403  -9.940
    7    HE1  MET   1           HE1      MET   1  30.220  -4.696  -8.366
    8    HE2  MET   1           HE2      MET   1  30.802  -3.736  -9.725
    9    HE3  MET   1           HE3      MET   1  29.107  -3.646  -9.253
   10    H    GLY   2           H        GLY   2  34.562   1.140 -10.572
   11    HA2  GLY   2           HA3      GLY   2  33.052   3.528 -11.067
   12    HA3  GLY   2           HA2      GLY   2  34.448   2.967 -11.982
   13    H    LEU   3           H        LEU   3  31.843   0.760 -11.550
   14    HA   LEU   3           HA       LEU   3  31.373   0.651 -14.382
   15    HB3  LEU   3           HB3      LEU   3  29.915  -0.775 -12.143
   16    HG   LEU   3           HG       LEU   3  30.190  -1.274 -15.122
   17   HD11  LEU   3          HD11      LEU   3  30.634  -3.356 -13.871
   18   HD12  LEU   3          HD12      LEU   3  29.096  -3.437 -14.730
   19   HD13  LEU   3          HD13      LEU   3  29.121  -3.143 -12.991
   20   HD21  LEU   3          HD21      LEU   3  27.982  -0.481 -13.283
   21   HD22  LEU   3          HD22      LEU   3  27.580  -1.698 -14.489
   22   HD23  LEU   3          HD23      LEU   3  28.202  -0.132 -14.996
   23    HA   PRO   4           HA       PRO   4  28.067   3.703 -14.044
   24    HB3  PRO   4           HB3      PRO   4  28.452   4.336 -16.225
   25    HG3  PRO   4           HG3      PRO   4  29.255   2.852 -17.771
   26    HD3  PRO   4           HD3      PRO   4  30.729   2.398 -16.039
   27    H    GLY   5           H        GLY   5  25.945   2.164 -16.194
   28    HA2  GLY   5           HA3      GLY   5  24.308   0.481 -15.836
   29    HA3  GLY   5           HA2      GLY   5  24.846   0.354 -14.164
   30    H    ARG   6           H        ARG   6  24.034   3.287 -15.927
   31    HA   ARG   6           HA       ARG   6  21.870   3.798 -13.958
   32    HB3  ARG   6           HB3      ARG   6  22.197   6.163 -14.383
   33    HG3  ARG   6           HG3      ARG   6  24.261   4.436 -13.346
   34    HD3  ARG   6           HD3      ARG   6  25.187   6.816 -14.954
   35    HE   ARG   6           HE       ARG   6  25.996   6.736 -12.396
   36   HH11  ARG   6          HH11      ARG   6  27.506   5.670 -15.323
   37   HH12  ARG   6          HH12      ARG   6  29.100   6.128 -14.830
   38   HH21  ARG   6          HH21      ARG   6  28.085   7.385 -11.764
   39   HH22  ARG   6          HH22      ARG   6  29.430   7.099 -12.820
   40    H    VAL   7           H        VAL   7  19.909   3.359 -14.818
   41    HA   VAL   7           HA       VAL   7  19.511   3.339 -17.665
   42    HB   VAL   7           HB       VAL   7  17.030   2.970 -16.706
   43   HG11  VAL   7          HG11      VAL   7  18.137   1.309 -18.018
   44   HG12  VAL   7          HG12      VAL   7  17.700   0.519 -16.504
   45   HG13  VAL   7          HG13      VAL   7  19.360   1.046 -16.775
   46   HG21  VAL   7          HG21      VAL   7  18.743   1.874 -14.481
   47   HG22  VAL   7          HG22      VAL   7  16.992   2.090 -14.522
   48   HG23  VAL   7          HG23      VAL   7  18.049   3.493 -14.373
   49    HA   PRO   8           HA       PRO   8  17.975   7.378 -18.443
   50    HB3  PRO   8           HB3      PRO   8  17.133   7.041 -20.510
   51    HG3  PRO   8           HG3      PRO   8  17.066   4.895 -21.189
   52    HD3  PRO   8           HD3      PRO   8  18.790   4.381 -19.757
   53    H    LEU   9           H        LEU   9  16.567   8.904 -17.662
   54    HA   LEU   9           HA       LEU   9  15.405   8.616 -15.202
   55    HB3  LEU   9           HB3      LEU   9  14.423  10.739 -15.537
   56    HG   LEU   9           HG       LEU   9  17.048  10.231 -16.234
   57   HD11  LEU   9          HD11      LEU   9  16.201  10.425 -18.657
   58   HD12  LEU   9          HD12      LEU   9  17.579  11.432 -18.215
   59   HD13  LEU   9          HD13      LEU   9  15.967  12.138 -18.312
   60   HD21  LEU   9          HD21      LEU   9  15.498  12.808 -15.911
   61   HD22  LEU   9          HD22      LEU   9  17.256  12.777 -16.050
   62   HD23  LEU   9          HD23      LEU   9  16.464  11.966 -14.699
   63    H    TRP  10           H        TRP  10  13.924   7.879 -18.326
   64    HA   TRP  10           HA       TRP  10  11.237   7.875 -17.547
   65    HB3  TRP  10           HB3      TRP  10  11.393   5.792 -19.338
   66    HD1  TRP  10           HD1      TRP  10   9.234   7.839 -18.741
   67    HE1  TRP  10           HE1      TRP  10   8.413   9.532 -20.502
   68    HE3  TRP  10           HE3      TRP  10  13.251   7.847 -21.895
   69    HZ2  TRP  10           HZ2      TRP  10   9.337  10.731 -22.928
   70    HZ3  TRP  10           HZ3      TRP  10  13.253   9.272 -23.923
   71    HH2  TRP  10           HH2      TRP  10  11.303  10.712 -24.443
   72    H    VAL  11           H        VAL  11  13.721   5.392 -17.279
   73    HA   VAL  11           HA       VAL  11  12.082   3.259 -16.443
   74    HB   VAL  11           HB       VAL  11  14.944   3.850 -15.638
   75   HG11  VAL  11          HG11      VAL  11  14.204   2.129 -14.208
   76   HG12  VAL  11          HG12      VAL  11  14.905   1.245 -15.564
   77   HG13  VAL  11          HG13      VAL  11  13.155   1.429 -15.442
   78   HG21  VAL  11          HG21      VAL  11  15.096   1.949 -17.553
   79   HG22  VAL  11          HG22      VAL  11  15.169   3.672 -17.919
   80   HG23  VAL  11          HG23      VAL  11  13.653   2.797 -18.106
   81    H    ILE  12           H        ILE  12  13.589   5.891 -14.695
   82    HA   ILE  12           HA       ILE  12  13.002   5.034 -12.069
   83    HB   ILE  12           HB       ILE  12  13.151   7.905 -12.996
   84   HG13  ILE  12          HG13      ILE  12  15.044   6.642 -13.955
   85   HG21  ILE  12          HG21      ILE  12  13.929   8.327 -10.765
   86   HG22  ILE  12          HG22      ILE  12  14.097   6.602 -10.432
   87   HG23  ILE  12          HG23      ILE  12  12.493   7.314 -10.613
   88   HD11  ILE  12          HD11      ILE  12  16.217   8.000 -11.556
   89   HD12  ILE  12          HD12      ILE  12  15.237   8.953 -12.670
   90   HD13  ILE  12          HD13      ILE  12  16.682   8.127 -13.251
   91    H    LEU  13           H        LEU  13  11.182   6.856 -14.454
   92    HA   LEU  13           HA       LEU  13   9.071   7.772 -12.864
   93    HB3  LEU  13           HB3      LEU  13   8.376   6.870 -15.593
   94    HG   LEU  13           HG       LEU  13   8.326   9.559 -14.191
   95   HD11  LEU  13          HD11      LEU  13   6.937  10.300 -15.974
   96   HD12  LEU  13          HD12      LEU  13   6.717   8.662 -16.585
   97   HD13  LEU  13          HD13      LEU  13   8.278   9.464 -16.758
   98   HD21  LEU  13          HD21      LEU  13   6.444   7.231 -14.290
   99   HD22  LEU  13          HD22      LEU  13   5.763   8.855 -14.283
  100   HD23  LEU  13          HD23      LEU  13   6.796   8.326 -12.955
  101    H    LEU  14           H        LEU  14   9.459   4.742 -14.664
  102    HA   LEU  14           HA       LEU  14   6.941   3.652 -13.806
  103    HB3  LEU  14           HB3      LEU  14   8.534   1.494 -14.503
  104    HG   LEU  14           HG       LEU  14   7.458   1.759 -16.759
  105   HD11  LEU  14          HD11      LEU  14   5.128   2.381 -15.218
  106   HD12  LEU  14          HD12      LEU  14   6.225   1.443 -14.206
  107   HD13  LEU  14          HD13      LEU  14   5.691   0.800 -15.757
  108   HD21  LEU  14          HD21      LEU  14   7.557   4.454 -16.184
  109   HD22  LEU  14          HD22      LEU  14   5.862   4.071 -15.881
  110   HD23  LEU  14          HD23      LEU  14   6.576   3.731 -17.458
  111    H    SER  15           H        SER  15  10.260   3.586 -12.731
  112    HA   SER  15           HA       SER  15  10.163   1.508 -10.874
  113    HB3  SER  15           HB3      SER  15  11.652   4.096 -10.399
  114    HG   SER  15           HG       SER  15  13.061   1.966  -9.862
  115    H    ALA  16           H        ALA  16   9.471   4.976 -10.388
  116    HA   ALA  16           HA       ALA  16   8.645   4.728  -7.702
  117    HB1  ALA  16           HB1      ALA  16   7.624   6.926  -8.027
  118    HB2  ALA  16           HB2      ALA  16   7.755   6.751  -9.777
  119    HB3  ALA  16           HB3      ALA  16   9.213   6.889  -8.793
  120    H    PHE  17           H        PHE  17   7.067   4.242 -10.789
  121    HA   PHE  17           HA       PHE  17   4.387   4.181  -9.789
  122    HB3  PHE  17           HB3      PHE  17   5.419   2.754 -12.244
  123    HD1  PHE  17           HD1      PHE  17   2.640   5.081 -11.313
  124    HD2  PHE  17           HD2      PHE  17   3.755   1.160 -12.667
  125    HE1  PHE  17           HE1      PHE  17   0.248   4.513 -11.636
  126    HE2  PHE  17           HE2      PHE  17   1.363   0.591 -12.991
  127    HZ   PHE  17           HZ       PHE  17  -0.390   2.268 -12.475
  128    H    ALA  18           H        ALA  18   6.796   1.651 -10.450
  129    HA   ALA  18           HA       ALA  18   5.128  -0.523  -9.688
  130    HB1  ALA  18           HB1      ALA  18   8.142  -0.447  -9.459
  131    HB2  ALA  18           HB2      ALA  18   7.315  -0.633 -11.006
  132    HB3  ALA  18           HB3      ALA  18   7.110  -1.849  -9.744
  133    H    GLY  19           H        GLY  19   7.693   1.220  -7.993
  134    HA2  GLY  19           HA3      GLY  19   7.552  -0.040  -5.515
  135    HA3  GLY  19           HA2      GLY  19   8.036   1.641  -5.738
  136    H    LEU  20           H        LEU  20   5.737   2.817  -6.650
  137    HA   LEU  20           HA       LEU  20   4.256   3.260  -4.298
  138    HB3  LEU  20           HB3      LEU  20   3.180   3.772  -7.068
  139    HG   LEU  20           HG       LEU  20   2.049   4.229  -4.667
  140   HD11  LEU  20          HD11      LEU  20   2.487   6.516  -3.944
  141   HD12  LEU  20          HD12      LEU  20   3.639   6.745  -5.261
  142   HD13  LEU  20          HD13      LEU  20   4.007   5.620  -3.955
  143   HD21  LEU  20          HD21      LEU  20   0.949   4.695  -6.777
  144   HD22  LEU  20          HD22      LEU  20   2.038   6.045  -7.099
  145   HD23  LEU  20          HD23      LEU  20   0.860   6.155  -5.790
  146    H    LEU  21           H        LEU  21   3.847   1.080  -6.939
  147    HA   LEU  21           HA       LEU  21   1.171   0.284  -6.590
  148    HB3  LEU  21           HB3      LEU  21   2.974  -1.905  -7.326
  149    HG   LEU  21           HG       LEU  21   0.481  -1.616  -7.806
  150   HD11  LEU  21          HD11      LEU  21   1.015  -0.171 -10.283
  151   HD12  LEU  21          HD12      LEU  21   1.364   0.817  -8.864
  152   HD13  LEU  21          HD13      LEU  21  -0.237   0.111  -9.073
  153   HD21  LEU  21          HD21      LEU  21   0.817  -2.434 -10.233
  154   HD22  LEU  21          HD22      LEU  21   1.609  -3.358  -8.958
  155   HD23  LEU  21          HD23      LEU  21   2.541  -2.222  -9.931
  156    H    LEU  22           H        LEU  22   4.148  -1.132  -5.260
  157    HA   LEU  22           HA       LEU  22   2.715  -2.953  -3.537
  158    HB3  LEU  22           HB3      LEU  22   5.238  -2.971  -2.556
  159    HG   LEU  22           HG       LEU  22   4.034  -4.902  -3.462
  160   HD11  LEU  22          HD11      LEU  22   4.411  -5.118  -6.093
  161   HD12  LEU  22          HD12      LEU  22   4.384  -3.358  -5.999
  162   HD13  LEU  22          HD13      LEU  22   2.998  -4.293  -5.439
  163   HD21  LEU  22          HD21      LEU  22   6.374  -5.063  -5.223
  164   HD22  LEU  22          HD22      LEU  22   5.978  -6.021  -3.796
  165   HD23  LEU  22          HD23      LEU  22   6.769  -4.456  -3.614
  166    H    LEU  23           H        LEU  23   4.283   0.112  -3.319
  167    HA   LEU  23           HA       LEU  23   4.549   0.443  -0.558
  168    HB3  LEU  23           HB3      LEU  23   3.429   2.705  -2.195
  169    HG   LEU  23           HG       LEU  23   4.168   2.634   0.373
  170   HD11  LEU  23          HD11      LEU  23   6.476   1.805  -0.443
  171   HD12  LEU  23          HD12      LEU  23   6.459   3.125   0.726
  172   HD13  LEU  23          HD13      LEU  23   6.736   3.463  -0.983
  173   HD21  LEU  23          HD21      LEU  23   3.304   4.607  -0.781
  174   HD22  LEU  23          HD22      LEU  23   4.843   4.827  -1.613
  175   HD23  LEU  23          HD23      LEU  23   4.745   5.054   0.133
  176    H    MET  24           H        MET  24   1.661   1.402  -2.459
  177    HA   MET  24           HA       MET  24  -0.002   2.079  -0.402
  178    HB3  MET  24           HB3      MET  24  -1.886   1.372  -1.879
  179    HG3  MET  24           HG3      MET  24  -0.768   2.664  -3.966
  180    HE1  MET  24           HE1      MET  24  -3.934   4.264  -3.057
  181    HE2  MET  24           HE2      MET  24  -3.161   2.819  -3.704
  182    HE3  MET  24           HE3      MET  24  -2.728   4.401  -4.344
  183    H    LEU  25           H        LEU  25   0.666  -1.220  -1.561
  184    HA   LEU  25           HA       LEU  25  -1.245  -2.615  -0.106
  185    HB3  LEU  25           HB3      LEU  25   1.272  -4.028  -0.071
  186    HG   LEU  25           HG       LEU  25  -1.069  -4.948  -0.240
  187   HD11  LEU  25          HD11      LEU  25  -2.434  -4.283  -1.905
  188   HD12  LEU  25          HD12      LEU  25  -1.238  -4.738  -3.120
  189   HD13  LEU  25          HD13      LEU  25  -1.193  -3.130  -2.397
  190   HD21  LEU  25          HD21      LEU  25   0.957  -6.271  -0.853
  191   HD22  LEU  25          HD22      LEU  25   0.798  -5.699  -2.514
  192   HD23  LEU  25          HD23      LEU  25  -0.453  -6.727  -1.811
  193    H    LEU  26           H        LEU  26   2.010  -1.596   0.879
  194    HA   LEU  26           HA       LEU  26   2.056  -2.741   3.429
  195    HB3  LEU  26           HB3      LEU  26   3.440  -0.378   3.759
  196    HG   LEU  26           HG       LEU  26   4.317  -2.619   4.178
  197   HD11  LEU  26          HD11      LEU  26   5.234  -3.586   1.768
  198   HD12  LEU  26          HD12      LEU  26   3.660  -2.924   1.325
  199   HD13  LEU  26          HD13      LEU  26   3.777  -4.149   2.589
  200   HD21  LEU  26          HD21      LEU  26   5.866  -0.979   2.154
  201   HD22  LEU  26          HD22      LEU  26   6.565  -2.355   3.009
  202   HD23  LEU  26          HD23      LEU  26   6.019  -0.942   3.912
  203    H    ILE  27           H        ILE  27   0.556   0.218   2.303
  204    HA   ILE  27           HA       ILE  27  -0.179   1.092   4.994
  205    HB   ILE  27           HB       ILE  27  -0.617   2.106   2.219
  206   HG13  ILE  27          HG13      ILE  27   0.025   3.434   4.869
  207   HG21  ILE  27          HG21      ILE  27  -2.479   2.599   4.551
  208   HG22  ILE  27          HG22      ILE  27  -2.894   2.181   2.887
  209   HG23  ILE  27          HG23      ILE  27  -2.271   3.785   3.263
  210   HD11  ILE  27          HD11      ILE  27   2.314   3.625   3.597
  211   HD12  ILE  27          HD12      ILE  27   1.708   2.244   2.683
  212   HD13  ILE  27          HD13      ILE  27   1.911   2.125   4.430
  213    H    LEU  28           H        LEU  28  -1.945   0.155   2.122
  214    HA   LEU  28           HA       LEU  28  -4.463  -0.254   3.088
  215    HB3  LEU  28           HB3      LEU  28  -4.169  -2.465   1.430
  216    HG   LEU  28           HG       LEU  28  -5.886  -0.706   1.275
  217   HD11  LEU  28          HD11      LEU  28  -5.074   1.407   1.468
  218   HD12  LEU  28          HD12      LEU  28  -4.806   1.294  -0.272
  219   HD13  LEU  28          HD13      LEU  28  -3.487   0.950   0.848
  220   HD21  LEU  28          HD21      LEU  28  -4.379  -1.802  -0.961
  221   HD22  LEU  28          HD22      LEU  28  -5.143  -0.272  -1.391
  222   HD23  LEU  28          HD23      LEU  28  -6.123  -1.606  -0.782
  223    H    ALA  29           H        ALA  29  -1.730  -2.502   3.368
  224    HA   ALA  29           HA       ALA  29  -3.172  -4.601   4.632
  225    HB1  ALA  29           HB1      ALA  29  -0.861  -5.298   5.421
  226    HB2  ALA  29           HB2      ALA  29  -0.243  -3.862   4.604
  227    HB3  ALA  29           HB3      ALA  29  -1.049  -5.128   3.676
  228    H    LEU  30           H        LEU  30  -1.347  -1.837   5.871
  229    HA   LEU  30           HA       LEU  30  -1.300  -2.404   8.583
  230    HB3  LEU  30           HB3      LEU  30  -2.026   0.384   7.927
  231    HG   LEU  30           HG       LEU  30  -0.969  -0.577  10.071
  232   HD11  LEU  30          HD11      LEU  30   1.134  -1.425  10.013
  233   HD12  LEU  30          HD12      LEU  30   1.698  -0.179   8.903
  234   HD13  LEU  30          HD13      LEU  30   0.869  -1.603   8.279
  235   HD21  LEU  30          HD21      LEU  30   0.493   1.453  10.297
  236   HD22  LEU  30          HD22      LEU  30  -1.109   1.819   9.659
  237   HD23  LEU  30          HD23      LEU  30   0.278   1.748   8.571
  238    H    TRP  31           H        TRP  31  -3.959  -1.126   6.650
  239    HA   TRP  31           HA       TRP  31  -5.765  -0.550   8.736
  240    HB3  TRP  31           HB3      TRP  31  -7.403  -1.269   6.666
  241    HD1  TRP  31           HD1      TRP  31  -8.913   0.721   7.128
  242    HE1  TRP  31           HE1      TRP  31  -8.590   3.265   7.392
  243    HE3  TRP  31           HE3      TRP  31  -3.840   1.022   6.658
  244    HZ2  TRP  31           HZ2      TRP  31  -6.461   5.176   7.406
  245    HZ3  TRP  31           HZ3      TRP  31  -2.687   3.212   6.806
  246    HH2  TRP  31           HH2      TRP  31  -3.992   5.288   7.176
  247    H    LYS  32           H        LYS  32  -4.866  -3.494   7.203
  248    HA   LYS  32           HA       LYS  32  -7.106  -5.072   8.117
  249    HB3  LYS  32           HB3      LYS  32  -4.335  -6.065   7.389
  250    HG3  LYS  32           HG3      LYS  32  -6.739  -7.350   8.285
  251    HD3  LYS  32           HD3      LYS  32  -6.833  -9.046   6.379
  252    HE3  LYS  32           HE3      LYS  32  -8.228  -7.375   4.928
  253    HZ1  LYS  32           HZ1      LYS  32  -9.209  -7.288   7.642
  254    HZ2  LYS  32           HZ2      LYS  32  -8.734  -8.833   7.118
  255    HZ3  LYS  32           HZ3      LYS  32  -9.912  -7.964   6.254
  256    H    ILE  33           H        ILE  33  -3.758  -4.647   9.137
  257    HA   ILE  33           HA       ILE  33  -4.243  -6.027  11.662
  258    HB   ILE  33           HB       ILE  33  -1.654  -4.676  11.207
  259   HG13  ILE  33          HG13      ILE  33  -1.980  -5.286   8.930
  260   HG21  ILE  33          HG21      ILE  33  -2.235  -7.587  11.743
  261   HG22  ILE  33          HG22      ILE  33  -2.350  -6.381  13.022
  262   HG23  ILE  33          HG23      ILE  33  -0.814  -6.651  12.201
  263   HD11  ILE  33          HD11      ILE  33  -0.260  -6.821   8.594
  264   HD12  ILE  33          HD12      ILE  33  -0.772  -7.842   9.939
  265   HD13  ILE  33          HD13      ILE  33   0.050  -6.313  10.254
  266    H    GLY  34           H        GLY  34  -5.005  -3.056  10.676
  267    HA2  GLY  34           HA3      GLY  34  -4.201  -1.741  13.208
  268    HA3  GLY  34           HA2      GLY  34  -4.508  -0.884  11.702
  269    H    PHE  35           H        PHE  35  -6.710  -0.829  10.892
  270    HA   PHE  35           HA       PHE  35  -8.624   0.038  12.630
  271    HB3  PHE  35           HB3      PHE  35 -10.231  -1.045  10.800
  272    HD1  PHE  35           HD1      PHE  35  -7.143   1.013  10.249
  273    HD2  PHE  35           HD2      PHE  35 -11.426   0.917  10.467
  274    HE1  PHE  35           HE1      PHE  35  -7.220   3.439   9.731
  275    HE2  PHE  35           HE2      PHE  35 -11.509   3.348   9.946
  276    HZ   PHE  35           HZ       PHE  35  -9.404   4.605   9.579
  277    H    PHE  36           H        PHE  36  -7.577  -3.134  12.148
  278    HA   PHE  36           HA       PHE  36  -9.901  -4.465  13.266
  279    HB3  PHE  36           HB3      PHE  36  -7.083  -5.513  12.856
  280    HD1  PHE  36           HD1      PHE  36 -10.584  -6.719  12.378
  281    HD2  PHE  36           HD2      PHE  36  -6.867  -7.210  14.470
  282    HE1  PHE  36           HE1      PHE  36 -11.454  -8.789  13.441
  283    HE2  PHE  36           HE2      PHE  36  -7.735  -9.277  15.533
  284    HZ   PHE  36           HZ       PHE  36 -10.029 -10.066  15.018
  285    H    LYS  37           H        LYS  37  -6.598  -3.758  14.222
  286    HA   LYS  37           HA       LYS  37  -6.867  -4.622  16.935
  287    HB3  LYS  37           HB3      LYS  37  -4.696  -3.279  17.207
  288    HG3  LYS  37           HG3      LYS  37  -3.575  -4.913  15.415
  289    HD3  LYS  37           HD3      LYS  37  -4.232  -6.810  17.146
  290    HE3  LYS  37           HE3      LYS  37  -2.539  -4.368  17.442
  291    HZ1  LYS  37           HZ1      LYS  37  -3.133  -4.499  19.652
  292    HZ2  LYS  37           HZ2      LYS  37  -1.770  -5.512  19.601
  293    HZ3  LYS  37           HZ3      LYS  37  -3.331  -6.183  19.621
  294    H    ARG  38           H        ARG  38  -8.998  -2.922  16.330
  295    HA   ARG  38           HA       ARG  38  -9.704  -0.613  16.671
  296    HB3  ARG  38           HB3      ARG  38 -11.002  -0.898  18.587
  297    HG3  ARG  38           HG3      ARG  38 -10.767  -2.963  16.795
  298    HD3  ARG  38           HD3      ARG  38  -9.288  -4.181  18.379
  299    HE   ARG  38           HE       ARG  38  -9.921  -3.988  20.596
  300   HH11  ARG  38          HH11      ARG  38 -12.678  -4.570  18.587
  301   HH12  ARG  38          HH12      ARG  38 -13.784  -4.723  19.912
  302   HH21  ARG  38          HH21      ARG  38 -11.366  -4.190  22.339
  303   HH22  ARG  38          HH22      ARG  38 -13.040  -4.507  22.035
  304    HA   PRO  39           HA       PRO  39  -5.768   1.154  18.468
  305    HB3  PRO  39           HB3      PRO  39  -5.174   2.782  16.949
  306    HG3  PRO  39           HG3      PRO  39  -5.557   1.090  15.449
  307    HD3  PRO  39           HD3      PRO  39  -7.439  -0.243  15.573
  308    H    LEU  40           H        LEU  40  -5.528   3.223  19.723
  309    HA   LEU  40           HA       LEU  40  -7.757   3.540  21.511
  310    HB3  LEU  40           HB3      LEU  40  -5.248   5.220  21.437
  311    HG   LEU  40           HG       LEU  40  -7.457   5.429  23.011
  312   HD11  LEU  40          HD11      LEU  40  -5.515   3.749  24.616
  313   HD12  LEU  40          HD12      LEU  40  -6.954   3.072  23.851
  314   HD13  LEU  40          HD13      LEU  40  -7.117   4.307  25.099
  315   HD21  LEU  40          HD21      LEU  40  -5.787   6.414  24.723
  316   HD22  LEU  40          HD22      LEU  40  -5.765   7.087  23.093
  317   HD23  LEU  40          HD23      LEU  40  -4.533   5.924  23.584
  318    H    LYS  41           H        LYS  41  -6.474   6.533  21.472
  319    HA   LYS  41           HA       LYS  41  -7.208   8.597  20.754
  320    HB3  LYS  41           HB3      LYS  41  -8.552   7.566  18.338
  321    HG3  LYS  41           HG3      LYS  41  -6.252   9.494  18.768
  322    HD3  LYS  41           HD3      LYS  41  -8.194   9.219  16.458
  323    HE3  LYS  41           HE3      LYS  41  -6.885  11.433  17.179
  324    HZ1  LYS  41           HZ1      LYS  41  -4.852  11.234  15.511
  325    HZ2  LYS  41           HZ2      LYS  41  -4.895   9.627  16.058
  326    HZ3  LYS  41           HZ3      LYS  41  -4.707  10.901  17.166
  327    H    LYS  42           H        LYS  42  -8.996   9.839  21.128
  328    HA   LYS  42           HA       LYS  42 -11.547   8.401  21.539
  329    HB3  LYS  42           HB3      LYS  42 -12.095  10.275  23.086
  330    HG3  LYS  42           HG3      LYS  42  -9.882   9.630  24.586
  331    HD3  LYS  42           HD3      LYS  42 -12.334   7.941  24.012
  332    HE3  LYS  42           HE3      LYS  42 -10.550   6.704  25.211
  333    HZ1  LYS  42           HZ1      LYS  42  -9.924   7.515  27.420
  334    HZ2  LYS  42           HZ2      LYS  42 -10.799   8.945  27.146
  335    HZ3  LYS  42           HZ3      LYS  42  -9.437   8.584  26.197
  336    H    LYS  43           H        LYS  43 -10.009  10.475  19.445
  337    HA   LYS  43           HA       LYS  43 -10.706  12.079  17.932
  338    HB3  LYS  43           HB3      LYS  43 -12.487  11.336  16.530
  339    HG3  LYS  43           HG3      LYS  43 -11.837   8.630  17.430
  340    HD3  LYS  43           HD3      LYS  43 -10.885   8.516  15.174
  341    HE3  LYS  43           HE3      LYS  43 -13.529   9.034  15.819
  342    HZ1  LYS  43           HZ1      LYS  43 -12.526  11.208  14.343
  343    HZ2  LYS  43           HZ2      LYS  43 -14.108  10.943  14.901
  344    HZ3  LYS  43           HZ3      LYS  43 -13.632  10.359  13.377
  345    H    MET  44           H        MET  44 -13.346  12.892  17.272
  346    HA   MET  44           HA       MET  44 -13.943  14.547  19.635
  347    HB3  MET  44           HB3      MET  44 -13.476  15.921  17.757
  348    HG3  MET  44           HG3      MET  44 -14.859  13.744  16.309
  349    HE1  MET  44           HE1      MET  44 -15.007  17.877  14.344
  350    HE2  MET  44           HE2      MET  44 -13.715  16.687  14.214
  351    HE3  MET  44           HE3      MET  44 -14.015  17.485  15.757
  352    H    GLU  45           H        GLU  45 -16.380  15.258  19.613
  353    HA   GLU  45           HA       GLU  45 -17.908  12.795  19.870
  354    HB3  GLU  45           HB3      GLU  45 -17.991  14.526  21.639
  355    HG3  GLU  45           HG3      GLU  45 -19.670  16.224  19.825
  356    H    LYS  46           H        LYS  46 -20.263  12.894  19.170
  357    HA   LYS  46           HA       LYS  46 -21.010  14.483  16.925
  358    HB3  LYS  46           HB3      LYS  46 -20.963  11.793  15.872
  359    HG3  LYS  46           HG3      LYS  46 -19.626  14.364  14.978
  360    HD3  LYS  46           HD3      LYS  46 -20.371  11.815  13.517
  361    HE3  LYS  46           HE3      LYS  46 -19.544  12.931  11.504
  362    HZ1  LYS  46           HZ1      LYS  46 -21.311  15.019  12.297
  363    HZ2  LYS  46           HZ2      LYS  46 -21.882  13.504  12.810
  364    HZ3  LYS  46           HZ3      LYS  46 -21.552  13.778  11.166
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1  23.343   8.798 -29.688
    2    H2   MET   1           H2       MET   1  22.839   7.688 -30.872
    3    H3   MET   1           H3       MET   1  23.614   9.129 -31.329
    4    HA   MET   1           HA       MET   1  25.188   7.368 -31.516
    5    HB3  MET   1           HB3      MET   1  26.327   8.297 -29.051
    6    HG3  MET   1           HG3      MET   1  27.801   9.520 -30.625
    7    HE1  MET   1           HE1      MET   1  29.220   8.499 -32.716
    8    HE2  MET   1           HE2      MET   1  30.012   6.986 -32.286
    9    HE3  MET   1           HE3      MET   1  29.996   8.320 -31.136
   10    H    GLY   2           H        GLY   2  23.383   7.411 -28.521
   11    HA2  GLY   2           HA3      GLY   2  22.683   5.153 -27.734
   12    HA3  GLY   2           HA2      GLY   2  24.373   4.688 -27.897
   13    H    LEU   3           H        LEU   3  23.118   4.332 -25.490
   14    HA   LEU   3           HA       LEU   3  23.931   6.591 -23.806
   15    HB3  LEU   3           HB3      LEU   3  22.750   5.256 -22.000
   16    HG   LEU   3           HG       LEU   3  21.596   6.578 -24.370
   17   HD11  LEU   3          HD11      LEU   3  20.096   4.703 -24.389
   18   HD12  LEU   3          HD12      LEU   3  19.249   6.017 -23.575
   19   HD13  LEU   3          HD13      LEU   3  19.964   4.712 -22.630
   20   HD21  LEU   3          HD21      LEU   3  20.473   7.882 -22.609
   21   HD22  LEU   3          HD22      LEU   3  22.193   7.728 -22.252
   22   HD23  LEU   3          HD23      LEU   3  21.022   6.729 -21.392
   23    HA   PRO   4           HA       PRO   4  27.547   4.310 -22.542
   24    HB3  PRO   4           HB3      PRO   4  28.348   6.326 -21.731
   25    HG3  PRO   4           HG3      PRO   4  26.959   7.847 -20.713
   26    HD3  PRO   4           HD3      PRO   4  25.650   7.476 -22.567
   27    H    GLY   5           H        GLY   5  24.977   3.108 -21.963
   28    HA2  GLY   5           HA3      GLY   5  24.329   1.172 -20.851
   29    HA3  GLY   5           HA2      GLY   5  25.787   1.283 -19.871
   30    H    ARG   6           H        ARG   6  24.062   4.195 -19.979
   31    HA   ARG   6           HA       ARG   6  23.362   3.972 -17.187
   32    HB3  ARG   6           HB3      ARG   6  22.293   6.270 -18.668
   33    HG3  ARG   6           HG3      ARG   6  22.559   6.026 -16.168
   34    HD3  ARG   6           HD3      ARG   6  25.289   6.856 -16.008
   35    HE   ARG   6           HE       ARG   6  23.704   5.329 -14.476
   36   HH11  ARG   6          HH11      ARG   6  26.661   4.659 -16.145
   37   HH12  ARG   6          HH12      ARG   6  27.182   3.449 -15.021
   38   HH21  ARG   6          HH21      ARG   6  24.376   3.738 -13.002
   39   HH22  ARG   6          HH22      ARG   6  25.889   2.928 -13.242
   40    H    VAL   7           H        VAL   7  21.264   4.328 -16.335
   41    HA   VAL   7           HA       VAL   7  19.251   2.886 -17.817
   42    HB   VAL   7           HB       VAL   7  17.897   3.194 -15.717
   43   HG11  VAL   7          HG11      VAL   7  19.529   1.779 -14.341
   44   HG12  VAL   7          HG12      VAL   7  20.663   1.985 -15.675
   45   HG13  VAL   7          HG13      VAL   7  19.122   1.168 -15.944
   46   HG21  VAL   7          HG21      VAL   7  20.373   4.076 -14.317
   47   HG22  VAL   7          HG22      VAL   7  18.685   4.409 -13.927
   48   HG23  VAL   7          HG23      VAL   7  19.491   5.316 -15.206
   49    HA   PRO   8           HA       PRO   8  17.229   6.527 -19.420
   50    HB3  PRO   8           HB3      PRO   8  16.190   5.150 -20.944
   51    HG3  PRO   8           HG3      PRO   8  15.566   3.010 -20.387
   52    HD3  PRO   8           HD3      PRO   8  17.731   2.943 -19.580
   53    H    LEU   9           H        LEU   9  15.814   8.172 -18.802
   54    HA   LEU   9           HA       LEU   9  15.150   8.458 -16.092
   55    HB3  LEU   9           HB3      LEU   9  13.557  10.265 -17.045
   56    HG   LEU   9           HG       LEU   9  15.801  10.747 -16.153
   57   HD11  LEU   9          HD11      LEU   9  17.230   9.269 -17.326
   58   HD12  LEU   9          HD12      LEU   9  17.665  10.862 -17.943
   59   HD13  LEU   9          HD13      LEU   9  16.629   9.798 -18.896
   60   HD21  LEU   9          HD21      LEU   9  15.869  12.233 -18.726
   61   HD22  LEU   9          HD22      LEU   9  15.869  12.847 -17.073
   62   HD23  LEU   9          HD23      LEU   9  14.359  12.326 -17.820
   63    H    TRP  10           H        TRP  10  13.440   7.121 -18.765
   64    HA   TRP  10           HA       TRP  10  10.793   7.143 -17.856
   65    HB3  TRP  10           HB3      TRP  10  10.980   4.647 -19.008
   66    HD1  TRP  10           HD1      TRP  10  11.532   8.190 -20.480
   67    HE1  TRP  10           HE1      TRP  10   9.453   8.811 -21.872
   68    HE3  TRP  10           HE3      TRP  10   8.725   3.978 -19.801
   69    HZ2  TRP  10           HZ2      TRP  10   6.932   7.672 -22.601
   70    HZ3  TRP  10           HZ3      TRP  10   6.492   3.772 -20.855
   71    HH2  TRP  10           HH2      TRP  10   5.592   5.612 -22.253
   72    H    VAL  11           H        VAL  11  13.375   4.849 -17.214
   73    HA   VAL  11           HA       VAL  11  12.086   2.976 -15.681
   74    HB   VAL  11           HB       VAL  11  14.637   3.274 -16.344
   75   HG11  VAL  11          HG11      VAL  11  14.854   5.199 -14.663
   76   HG12  VAL  11          HG12      VAL  11  16.059   3.925 -14.546
   77   HG13  VAL  11          HG13      VAL  11  14.730   3.976 -13.398
   78   HG21  VAL  11          HG21      VAL  11  14.011   1.152 -15.627
   79   HG22  VAL  11          HG22      VAL  11  13.347   1.749 -14.105
   80   HG23  VAL  11          HG23      VAL  11  15.094   1.634 -14.323
   81    H    ILE  12           H        ILE  12  13.163   6.192 -14.649
   82    HA   ILE  12           HA       ILE  12  12.824   5.917 -11.898
   83    HB   ILE  12           HB       ILE  12  12.256   8.342 -13.617
   84   HG13  ILE  12          HG13      ILE  12  14.594   7.334 -13.643
   85   HG21  ILE  12          HG21      ILE  12  12.196   7.841 -10.676
   86   HG22  ILE  12          HG22      ILE  12  11.238   8.960 -11.643
   87   HG23  ILE  12          HG23      ILE  12  12.902   9.359 -11.225
   88   HD11  ILE  12          HD11      ILE  12  15.688   9.551 -13.011
   89   HD12  ILE  12          HD12      ILE  12  14.088  10.092 -12.505
   90   HD13  ILE  12          HD13      ILE  12  14.380   9.654 -14.189
   91    H    LEU  13           H        LEU  13  10.415   6.851 -14.344
   92    HA   LEU  13           HA       LEU  13   8.293   7.157 -12.490
   93    HB3  LEU  13           HB3      LEU  13   8.019   6.358 -15.394
   94    HG   LEU  13           HG       LEU  13   5.995   6.390 -13.819
   95   HD11  LEU  13          HD11      LEU  13   6.793   9.301 -13.783
   96   HD12  LEU  13          HD12      LEU  13   6.275   8.279 -12.444
   97   HD13  LEU  13          HD13      LEU  13   5.102   8.835 -13.633
   98   HD21  LEU  13          HD21      LEU  13   4.836   8.098 -15.570
   99   HD22  LEU  13          HD22      LEU  13   5.278   6.444 -15.994
  100   HD23  LEU  13          HD23      LEU  13   6.348   7.781 -16.420
  101    H    LEU  14           H        LEU  14   8.973   4.435 -14.770
  102    HA   LEU  14           HA       LEU  14   7.076   2.684 -13.870
  103    HB3  LEU  14           HB3      LEU  14   9.061   0.962 -14.422
  104    HG   LEU  14           HG       LEU  14   7.030   1.204 -15.744
  105   HD11  LEU  14          HD11      LEU  14   8.254   3.865 -16.335
  106   HD12  LEU  14          HD12      LEU  14   6.565   3.446 -16.050
  107   HD13  LEU  14          HD13      LEU  14   7.307   3.101 -17.611
  108   HD21  LEU  14          HD21      LEU  14   8.039   1.024 -18.048
  109   HD22  LEU  14          HD22      LEU  14   8.828   0.004 -16.843
  110   HD23  LEU  14          HD23      LEU  14   9.584   1.515 -17.352
  111    H    SER  15           H        SER  15  10.081   3.632 -12.374
  112    HA   SER  15           HA       SER  15  10.028   1.464 -10.434
  113    HB3  SER  15           HB3      SER  15  11.762   2.910  -9.261
  114    HG   SER  15           HG       SER  15  12.158   2.319 -12.014
  115    H    ALA  16           H        ALA  16   9.584   5.000 -10.244
  116    HA   ALA  16           HA       ALA  16   8.573   5.143  -7.671
  117    HB1  ALA  16           HB1      ALA  16   9.123   7.148  -8.936
  118    HB2  ALA  16           HB2      ALA  16   7.440   7.233  -8.412
  119    HB3  ALA  16           HB3      ALA  16   7.824   6.817 -10.083
  120    H    PHE  17           H        PHE  17   6.999   4.132 -10.630
  121    HA   PHE  17           HA       PHE  17   4.342   4.181  -9.514
  122    HB3  PHE  17           HB3      PHE  17   4.076   2.598 -11.683
  123    HD1  PHE  17           HD1      PHE  17   5.341   6.071 -11.050
  124    HD2  PHE  17           HD2      PHE  17   2.258   3.616 -12.758
  125    HE1  PHE  17           HE1      PHE  17   4.041   8.103 -11.624
  126    HE2  PHE  17           HE2      PHE  17   0.959   5.648 -13.332
  127    HZ   PHE  17           HZ       PHE  17   1.850   7.891 -12.765
  128    H    ALA  18           H        ALA  18   6.871   1.776 -10.018
  129    HA   ALA  18           HA       ALA  18   5.250  -0.450  -9.206
  130    HB1  ALA  18           HB1      ALA  18   7.356  -0.534 -10.654
  131    HB2  ALA  18           HB2      ALA  18   7.231  -1.748  -9.379
  132    HB3  ALA  18           HB3      ALA  18   8.264  -0.335  -9.156
  133    H    GLY  19           H        GLY  19   7.640   1.637  -7.635
  134    HA2  GLY  19           HA3      GLY  19   7.683   0.273  -5.142
  135    HA3  GLY  19           HA2      GLY  19   8.210   1.931  -5.425
  136    H    LEU  20           H        LEU  20   5.821   3.031  -6.380
  137    HA   LEU  20           HA       LEU  20   4.493   3.708  -3.994
  138    HB3  LEU  20           HB3      LEU  20   3.456   3.925  -6.830
  139    HG   LEU  20           HG       LEU  20   2.320   4.570  -4.262
  140   HD11  LEU  20          HD11      LEU  20   1.813   6.945  -4.654
  141   HD12  LEU  20          HD12      LEU  20   2.814   6.930  -6.106
  142   HD13  LEU  20          HD13      LEU  20   3.554   6.701  -4.520
  143   HD21  LEU  20          HD21      LEU  20   0.393   5.199  -5.710
  144   HD22  LEU  20          HD22      LEU  20   1.085   3.643  -6.169
  145   HD23  LEU  20          HD23      LEU  20   1.441   5.084  -7.123
  146    H    LEU  21           H        LEU  21   3.849   1.255  -6.428
  147    HA   LEU  21           HA       LEU  21   1.274   0.511  -5.399
  148    HB3  LEU  21           HB3      LEU  21   2.746  -1.545  -6.887
  149    HG   LEU  21           HG       LEU  21   0.205   0.023  -7.429
  150   HD11  LEU  21          HD11      LEU  21   1.578  -1.449  -9.231
  151   HD12  LEU  21          HD12      LEU  21  -0.183  -1.370  -9.208
  152   HD13  LEU  21          HD13      LEU  21   0.648  -2.731  -8.455
  153   HD21  LEU  21          HD21      LEU  21  -0.415  -1.113  -5.533
  154   HD22  LEU  21          HD22      LEU  21   0.868  -2.309  -5.707
  155   HD23  LEU  21          HD23      LEU  21  -0.601  -2.446  -6.672
  156    H    LEU  22           H        LEU  22   4.563  -0.787  -5.184
  157    HA   LEU  22           HA       LEU  22   3.970  -2.996  -3.527
  158    HB3  LEU  22           HB3      LEU  22   6.527  -2.183  -2.813
  159    HG   LEU  22           HG       LEU  22   5.478  -3.910  -5.062
  160   HD11  LEU  22          HD11      LEU  22   8.342  -3.675  -4.086
  161   HD12  LEU  22          HD12      LEU  22   7.750  -3.064  -5.630
  162   HD13  LEU  22          HD13      LEU  22   7.747  -4.798  -5.308
  163   HD21  LEU  22          HD21      LEU  22   5.544  -4.254  -2.318
  164   HD22  LEU  22          HD22      LEU  22   7.014  -5.073  -2.842
  165   HD23  LEU  22          HD23      LEU  22   5.452  -5.559  -3.501
  166    H    LEU  23           H        LEU  23   4.672   0.388  -2.914
  167    HA   LEU  23           HA       LEU  23   4.784   0.116  -0.043
  168    HB3  LEU  23           HB3      LEU  23   4.398   2.581  -1.756
  169    HG   LEU  23           HG       LEU  23   4.417   2.115   1.114
  170   HD11  LEU  23          HD11      LEU  23   6.777   2.580   1.045
  171   HD12  LEU  23          HD12      LEU  23   5.976   4.056   1.581
  172   HD13  LEU  23          HD13      LEU  23   6.539   3.914  -0.083
  173   HD21  LEU  23          HD21      LEU  23   2.788   3.512  -0.107
  174   HD22  LEU  23          HD22      LEU  23   4.087   4.602  -0.593
  175   HD23  LEU  23          HD23      LEU  23   3.645   4.461   1.108
  176    H    MET  24           H        MET  24   2.448   1.489  -2.310
  177    HA   MET  24           HA       MET  24   0.490   2.367  -0.636
  178    HB3  MET  24           HB3      MET  24  -1.149   1.461  -2.495
  179    HG3  MET  24           HG3      MET  24  -0.029   3.299  -4.040
  180    HE1  MET  24           HE1      MET  24  -1.432   6.523  -2.307
  181    HE2  MET  24           HE2      MET  24  -0.269   5.876  -3.461
  182    HE3  MET  24           HE3      MET  24   0.145   5.949  -1.750
  183    H    LEU  25           H        LEU  25   0.707  -1.049  -1.789
  184    HA   LEU  25           HA       LEU  25  -1.509  -1.958  -0.296
  185    HB3  LEU  25           HB3      LEU  25   0.374  -4.063  -0.433
  186    HG   LEU  25           HG       LEU  25  -1.906  -3.230  -2.249
  187   HD11  LEU  25          HD11      LEU  25  -1.800  -5.909  -2.486
  188   HD12  LEU  25          HD12      LEU  25  -0.085  -5.585  -2.238
  189   HD13  LEU  25          HD13      LEU  25  -0.939  -4.830  -3.582
  190   HD21  LEU  25          HD21      LEU  25  -1.807  -4.196   0.428
  191   HD22  LEU  25          HD22      LEU  25  -2.401  -5.516  -0.579
  192   HD23  LEU  25          HD23      LEU  25  -3.233  -3.963  -0.582
  193    H    LEU  26           H        LEU  26   1.837  -1.467   0.455
  194    HA   LEU  26           HA       LEU  26   2.078  -2.835   2.886
  195    HB3  LEU  26           HB3      LEU  26   3.402  -0.174   2.630
  196    HG   LEU  26           HG       LEU  26   3.820  -2.097   4.357
  197   HD11  LEU  26          HD11      LEU  26   4.949  -3.965   3.661
  198   HD12  LEU  26          HD12      LEU  26   5.814  -3.096   2.393
  199   HD13  LEU  26          HD13      LEU  26   4.148  -3.607   2.131
  200   HD21  LEU  26          HD21      LEU  26   6.006  -0.706   2.778
  201   HD22  LEU  26          HD22      LEU  26   6.281  -1.528   4.314
  202   HD23  LEU  26          HD23      LEU  26   5.221  -0.120   4.243
  203    H    ILE  27           H        ILE  27   0.973   0.491   2.261
  204    HA   ILE  27           HA       ILE  27   0.391   0.983   5.058
  205    HB   ILE  27           HB       ILE  27  -0.605   2.580   2.693
  206   HG13  ILE  27          HG13      ILE  27   1.482   3.968   3.087
  207   HG21  ILE  27          HG21      ILE  27  -0.663   4.397   4.287
  208   HG22  ILE  27          HG22      ILE  27   0.134   3.410   5.510
  209   HG23  ILE  27          HG23      ILE  27  -1.510   3.024   5.000
  210   HD11  ILE  27          HD11      ILE  27   2.593   1.482   4.384
  211   HD12  ILE  27          HD12      ILE  27   1.892   2.779   5.350
  212   HD13  ILE  27          HD13      ILE  27   3.294   3.098   4.329
  213    H    LEU  28           H        LEU  28  -1.514   0.690   2.121
  214    HA   LEU  28           HA       LEU  28  -4.075   0.723   3.206
  215    HB3  LEU  28           HB3      LEU  28  -4.282  -1.289   1.275
  216    HG   LEU  28           HG       LEU  28  -4.404   1.730   1.106
  217   HD11  LEU  28          HD11      LEU  28  -4.534  -0.292  -0.984
  218   HD12  LEU  28          HD12      LEU  28  -4.519   1.466  -1.131
  219   HD13  LEU  28          HD13      LEU  28  -6.042   0.614  -0.869
  220   HD21  LEU  28          HD21      LEU  28  -6.452   1.488   2.027
  221   HD22  LEU  28          HD22      LEU  28  -6.051  -0.201   2.336
  222   HD23  LEU  28          HD23      LEU  28  -6.885   0.251   0.849
  223    H    ALA  29           H        ALA  29  -1.992  -2.145   2.765
  224    HA   ALA  29           HA       ALA  29  -3.638  -4.030   3.948
  225    HB1  ALA  29           HB1      ALA  29  -0.613  -3.892   3.996
  226    HB2  ALA  29           HB2      ALA  29  -1.603  -4.621   2.730
  227    HB3  ALA  29           HB3      ALA  29  -1.578  -5.327   4.345
  228    H    LEU  30           H        LEU  30  -1.501  -1.670   5.457
  229    HA   LEU  30           HA       LEU  30  -1.338  -2.729   8.019
  230    HB3  LEU  30           HB3      LEU  30  -0.572  -0.358   6.822
  231    HG   LEU  30           HG       LEU  30  -2.794   0.638   7.598
  232   HD11  LEU  30          HD11      LEU  30  -3.427   0.354   9.747
  233   HD12  LEU  30          HD12      LEU  30  -1.952   1.152  10.288
  234   HD13  LEU  30          HD13      LEU  30  -1.973  -0.595  10.051
  235   HD21  LEU  30          HD21      LEU  30  -1.656   2.648   8.576
  236   HD22  LEU  30          HD22      LEU  30  -0.910   2.057   7.090
  237   HD23  LEU  30          HD23      LEU  30  -0.167   1.705   8.650
  238    H    TRP  31           H        TRP  31  -3.934  -0.845   6.565
  239    HA   TRP  31           HA       TRP  31  -5.525  -0.444   8.805
  240    HB3  TRP  31           HB3      TRP  31  -7.275  -0.931   6.636
  241    HD1  TRP  31           HD1      TRP  31  -4.933   1.999   7.620
  242    HE1  TRP  31           HE1      TRP  31  -6.396   3.924   8.511
  243    HE3  TRP  31           HE3      TRP  31  -9.550  -0.153   7.240
  244    HZ2  TRP  31           HZ2      TRP  31  -9.161   4.479   9.000
  245    HZ3  TRP  31           HZ3      TRP  31 -11.577   1.095   7.925
  246    HH2  TRP  31           HH2      TRP  31 -11.391   3.407   8.803
  247    H    LYS  32           H        LYS  32  -5.247  -3.328   6.813
  248    HA   LYS  32           HA       LYS  32  -7.532  -4.642   7.967
  249    HB3  LYS  32           HB3      LYS  32  -6.096  -6.711   7.061
  250    HG3  LYS  32           HG3      LYS  32  -7.708  -4.632   5.603
  251    HD3  LYS  32           HD3      LYS  32  -6.143  -5.450   3.927
  252    HE3  LYS  32           HE3      LYS  32  -6.864  -8.133   5.110
  253    HZ1  LYS  32           HZ1      LYS  32  -5.224  -7.995   2.709
  254    HZ2  LYS  32           HZ2      LYS  32  -6.895  -7.770   2.493
  255    HZ3  LYS  32           HZ3      LYS  32  -6.313  -9.194   3.215
  256    H    ILE  33           H        ILE  33  -4.047  -4.918   8.442
  257    HA   ILE  33           HA       ILE  33  -4.334  -6.727  10.671
  258    HB   ILE  33           HB       ILE  33  -1.854  -6.298  10.973
  259   HG13  ILE  33          HG13      ILE  33  -2.013  -4.016   9.850
  260   HG21  ILE  33          HG21      ILE  33  -2.786  -8.183   9.653
  261   HG22  ILE  33          HG22      ILE  33  -1.272  -7.592   8.970
  262   HG23  ILE  33          HG23      ILE  33  -2.808  -7.150   8.224
  263   HD11  ILE  33          HD11      ILE  33   0.201  -4.359   8.659
  264   HD12  ILE  33          HD12      ILE  33   0.014  -6.085   8.968
  265   HD13  ILE  33          HD13      ILE  33   0.150  -4.956  10.316
  266    H    GLY  34           H        GLY  34  -5.215  -3.687  10.473
  267    HA2  GLY  34           HA3      GLY  34  -4.399  -3.027  13.243
  268    HA3  GLY  34           HA2      GLY  34  -4.568  -1.804  11.987
  269    H    PHE  35           H        PHE  35  -6.813  -1.942  10.839
  270    HA   PHE  35           HA       PHE  35  -8.800  -1.160  12.600
  271    HB3  PHE  35           HB3      PHE  35  -9.241  -2.479   9.913
  272    HD1  PHE  35           HD1      PHE  35 -10.363   0.642  11.641
  273    HD2  PHE  35           HD2      PHE  35 -11.483  -3.179  10.032
  274    HE1  PHE  35           HE1      PHE  35 -12.754   1.184  12.018
  275    HE2  PHE  35           HE2      PHE  35 -13.872  -2.638  10.407
  276    HZ   PHE  35           HZ       PHE  35 -14.509  -0.456  11.400
  277    H    PHE  36           H        PHE  36  -8.161  -4.385  11.271
  278    HA   PHE  36           HA       PHE  36 -10.424  -5.577  12.623
  279    HB3  PHE  36           HB3      PHE  36  -8.239  -7.336  11.698
  280    HD1  PHE  36           HD1      PHE  36  -9.706  -8.873  13.039
  281    HD2  PHE  36           HD2      PHE  36 -11.169  -6.696   9.638
  282    HE1  PHE  36           HE1      PHE  36 -11.668 -10.380  12.921
  283    HE2  PHE  36           HE2      PHE  36 -13.132  -8.207   9.517
  284    HZ   PHE  36           HZ       PHE  36 -13.381 -10.048  11.158
  285    H    LYS  37           H        LYS  37  -7.645  -4.343  13.746
  286    HA   LYS  37           HA       LYS  37  -6.204  -4.793  15.514
  287    HB3  LYS  37           HB3      LYS  37  -7.456  -5.191  17.606
  288    HG3  LYS  37           HG3      LYS  37  -8.983  -3.353  15.744
  289    HD3  LYS  37           HD3      LYS  37  -9.509  -3.934  18.336
  290    HE3  LYS  37           HE3      LYS  37  -7.788  -1.462  18.515
  291    HZ1  LYS  37           HZ1      LYS  37  -9.416  -3.074  20.264
  292    HZ2  LYS  37           HZ2      LYS  37  -8.931  -1.454  20.416
  293    HZ3  LYS  37           HZ3      LYS  37  -7.887  -2.705  20.900
  294    H    ARG  38           H        ARG  38  -6.289  -6.969  13.672
  295    HA   ARG  38           HA       ARG  38  -5.727  -9.193  15.527
  296    HB3  ARG  38           HB3      ARG  38  -7.251  -9.411  12.921
  297    HG3  ARG  38           HG3      ARG  38  -5.795 -11.347  14.600
  298    HD3  ARG  38           HD3      ARG  38  -8.671 -11.796  13.774
  299    HE   ARG  38           HE       ARG  38  -7.213 -14.046  14.858
  300   HH11  ARG  38          HH11      ARG  38  -8.177 -12.311  12.024
  301   HH12  ARG  38          HH12      ARG  38  -8.044 -13.681  10.972
  302   HH21  ARG  38          HH21      ARG  38  -7.038 -15.846  13.485
  303   HH22  ARG  38          HH22      ARG  38  -7.399 -15.682  11.799
  304    HA   PRO  39           HA       PRO  39  -2.375  -8.548  12.336
  305    HB3  PRO  39           HB3      PRO  39  -1.684  -6.548  13.311
  306    HG3  PRO  39           HG3      PRO  39  -1.915  -6.162  15.572
  307    HD3  PRO  39           HD3      PRO  39  -4.100  -6.784  15.192
  308    H    LEU  40           H        LEU  40   0.240  -9.171  13.172
  309    HA   LEU  40           HA       LEU  40   0.165 -11.653  14.693
  310    HB3  LEU  40           HB3      LEU  40   1.720 -12.280  12.436
  311    HG   LEU  40           HG       LEU  40  -1.047 -13.148  13.313
  312   HD11  LEU  40          HD11      LEU  40  -0.859 -13.766  11.006
  313   HD12  LEU  40          HD12      LEU  40  -0.461 -15.214  11.933
  314   HD13  LEU  40          HD13      LEU  40   0.825 -14.251  11.205
  315   HD21  LEU  40          HD21      LEU  40   0.048 -14.411  14.832
  316   HD22  LEU  40          HD22      LEU  40   1.523 -13.539  14.410
  317   HD23  LEU  40          HD23      LEU  40   1.126 -15.051  13.591
  318    H    LYS  41           H        LYS  41   1.768  -9.108  12.985
  319    HA   LYS  41           HA       LYS  41   4.423  -9.700  14.006
  320    HB3  LYS  41           HB3      LYS  41   5.162  -8.053  12.586
  321    HG3  LYS  41           HG3      LYS  41   2.369  -8.350  11.454
  322    HD3  LYS  41           HD3      LYS  41   3.534  -8.148   9.307
  323    HE3  LYS  41           HE3      LYS  41   3.938  -5.836   9.389
  324    HZ1  LYS  41           HZ1      LYS  41   1.775  -6.416  10.328
  325    HZ2  LYS  41           HZ2      LYS  41   2.384  -4.980  11.005
  326    HZ3  LYS  41           HZ3      LYS  41   2.444  -6.430  11.885
  327    H    LYS  42           H        LYS  42   5.593  -7.894  15.258
  328    HA   LYS  42           HA       LYS  42   3.832  -6.270  16.919
  329    HB3  LYS  42           HB3      LYS  42   4.870  -7.171  19.017
  330    HG3  LYS  42           HG3      LYS  42   3.368  -9.275  17.435
  331    HD3  LYS  42           HD3      LYS  42   2.261  -9.395  19.826
  332    HE3  LYS  42           HE3      LYS  42   4.142 -11.013  20.488
  333    HZ1  LYS  42           HZ1      LYS  42   2.222 -11.085  18.474
  334    HZ2  LYS  42           HZ2      LYS  42   2.890 -12.395  19.324
  335    HZ3  LYS  42           HZ3      LYS  42   3.594 -11.875  17.868
  336    H    LYS  43           H        LYS  43   5.038  -4.873  18.380
  337    HA   LYS  43           HA       LYS  43   7.204  -3.579  17.045
  338    HB3  LYS  43           HB3      LYS  43   7.313  -2.164  19.091
  339    HG3  LYS  43           HG3      LYS  43   4.393  -2.508  18.538
  340    HD3  LYS  43           HD3      LYS  43   6.310  -0.157  18.480
  341    HE3  LYS  43           HE3      LYS  43   3.946   1.011  18.663
  342    HZ1  LYS  43           HZ1      LYS  43   3.917   0.895  16.114
  343    HZ2  LYS  43           HZ2      LYS  43   5.326  -0.041  16.280
  344    HZ3  LYS  43           HZ3      LYS  43   5.284   1.550  16.876
  345    H    MET  44           H        MET  44   7.738  -6.382  17.716
  346    HA   MET  44           HA       MET  44   9.277  -7.731  18.803
  347    HB3  MET  44           HB3      MET  44  11.549  -7.060  18.285
  348    HG3  MET  44           HG3      MET  44   9.408  -7.147  16.437
  349    HE1  MET  44           HE1      MET  44  10.073  -5.407  13.166
  350    HE2  MET  44           HE2      MET  44  10.177  -6.989  13.932
  351    HE3  MET  44           HE3      MET  44  11.649  -6.082  13.598
  352    H    GLU  45           H        GLU  45  11.680  -6.977  20.090
  353    HA   GLU  45           HA       GLU  45  10.791  -6.699  22.747
  354    HB3  GLU  45           HB3      GLU  45  12.887  -7.789  22.287
  355    HG3  GLU  45           HG3      GLU  45  13.995  -5.136  21.338
  356    H    LYS  46           H        LYS  46  13.226  -4.637  23.006
  357    HA   LYS  46           HA       LYS  46  11.914  -2.166  22.244
  358    HB3  LYS  46           HB3      LYS  46  10.736  -2.703  24.331
  359    HG3  LYS  46           HG3      LYS  46  13.389  -2.534  25.750
  360    HD3  LYS  46           HD3      LYS  46  10.823  -3.908  26.563
  361    HE3  LYS  46           HE3      LYS  46  11.763  -3.894  28.738
  362    HZ1  LYS  46           HZ1      LYS  46  14.067  -4.272  26.907
  363    HZ2  LYS  46           HZ2      LYS  46  12.837  -5.420  27.145
  364    HZ3  LYS  46           HZ3      LYS  46  13.851  -4.979  28.433
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1  24.936   7.851 -27.575
    2    H2   MET   1           H2       MET   1  24.127   8.294 -29.001
    3    H3   MET   1           H3       MET   1  25.341   9.298 -28.363
    4    HA   MET   1           HA       MET   1  25.565   6.957 -30.031
    5    HB3  MET   1           HB3      MET   1  27.672   8.073 -30.638
    6    HG3  MET   1           HG3      MET   1  25.074   9.091 -30.962
    7    HE1  MET   1           HE1      MET   1  25.389  12.635 -32.057
    8    HE2  MET   1           HE2      MET   1  24.050  12.284 -30.967
    9    HE3  MET   1           HE3      MET   1  24.554  11.077 -32.147
   10    H    GLY   2           H        GLY   2  25.320   5.606 -27.898
   11    HA2  GLY   2           HA3      GLY   2  26.430   3.927 -26.729
   12    HA3  GLY   2           HA2      GLY   2  27.961   4.608 -27.267
   13    H    LEU   3           H        LEU   3  25.488   4.686 -24.801
   14    HA   LEU   3           HA       LEU   3  26.707   6.836 -23.316
   15    HB3  LEU   3           HB3      LEU   3  24.990   6.264 -21.612
   16    HG   LEU   3           HG       LEU   3  24.580   7.082 -24.346
   17   HD11  LEU   3          HD11      LEU   3  22.285   5.605 -23.021
   18   HD12  LEU   3          HD12      LEU   3  23.089   5.151 -24.524
   19   HD13  LEU   3          HD13      LEU   3  22.132   6.630 -24.449
   20   HD21  LEU   3          HD21      LEU   3  23.036   8.650 -23.280
   21   HD22  LEU   3          HD22      LEU   3  24.493   8.502 -22.297
   22   HD23  LEU   3          HD23      LEU   3  23.014   7.669 -21.813
   23    HA   PRO   4           HA       PRO   4  29.590   4.281 -21.098
   24    HB3  PRO   4           HB3      PRO   4  30.577   6.268 -20.448
   25    HG3  PRO   4           HG3      PRO   4  29.315   8.104 -19.844
   26    HD3  PRO   4           HD3      PRO   4  28.344   7.631 -21.886
   27    H    GLY   5           H        GLY   5  26.852   3.419 -20.798
   28    HA2  GLY   5           HA3      GLY   5  25.828   1.777 -19.514
   29    HA3  GLY   5           HA2      GLY   5  27.120   1.945 -18.330
   30    H    ARG   6           H        ARG   6  25.184   4.648 -19.487
   31    HA   ARG   6           HA       ARG   6  24.324   5.153 -16.742
   32    HB3  ARG   6           HB3      ARG   6  23.428   7.295 -17.819
   33    HG3  ARG   6           HG3      ARG   6  25.944   8.019 -18.325
   34    HD3  ARG   6           HD3      ARG   6  26.296   8.236 -15.904
   35    HE   ARG   6           HE       ARG   6  23.887   9.087 -17.146
   36   HH11  ARG   6          HH11      ARG   6  25.421   8.685 -14.070
   37   HH12  ARG   6          HH12      ARG   6  24.521   9.948 -13.301
   38   HH21  ARG   6          HH21      ARG   6  22.696  10.741 -16.141
   39   HH22  ARG   6          HH22      ARG   6  22.977  11.113 -14.473
   40    H    VAL   7           H        VAL   7  22.385   4.633 -16.003
   41    HA   VAL   7           HA       VAL   7  20.427   3.451 -17.738
   42    HB   VAL   7           HB       VAL   7  20.865   3.733 -14.832
   43   HG11  VAL   7          HG11      VAL   7  18.084   3.581 -16.027
   44   HG12  VAL   7          HG12      VAL   7  18.675   4.705 -14.801
   45   HG13  VAL   7          HG13      VAL   7  18.458   3.002 -14.407
   46   HG21  VAL   7          HG21      VAL   7  21.350   1.699 -16.203
   47   HG22  VAL   7          HG22      VAL   7  19.623   1.551 -16.531
   48   HG23  VAL   7          HG23      VAL   7  20.225   1.386 -14.881
   49    HA   PRO   8           HA       PRO   8  18.296   7.326 -18.476
   50    HB3  PRO   8           HB3      PRO   8  17.482   6.439 -20.429
   51    HG3  PRO   8           HG3      PRO   8  17.073   4.195 -20.626
   52    HD3  PRO   8           HD3      PRO   8  19.139   3.995 -19.621
   53    H    LEU   9           H        LEU   9  16.719   8.620 -17.589
   54    HA   LEU   9           HA       LEU   9  15.845   8.153 -14.980
   55    HB3  LEU   9           HB3      LEU   9  14.178  10.044 -15.562
   56    HG   LEU   9           HG       LEU   9  16.311  10.425 -14.411
   57   HD11  LEU   9          HD11      LEU   9  18.280  11.070 -15.956
   58   HD12  LEU   9          HD12      LEU   9  17.392  10.226 -17.222
   59   HD13  LEU   9          HD13      LEU   9  17.917   9.353 -15.782
   60   HD21  LEU   9          HD21      LEU   9  16.226  12.436 -16.653
   61   HD22  LEU   9          HD22      LEU   9  16.506  12.711 -14.935
   62   HD23  LEU   9          HD23      LEU   9  14.886  12.319 -15.512
   63    H    TRP  10           H        TRP  10  14.421   7.324 -18.037
   64    HA   TRP  10           HA       TRP  10  11.737   7.028 -17.460
   65    HB3  TRP  10           HB3      TRP  10  12.264   4.789 -18.962
   66    HD1  TRP  10           HD1      TRP  10   9.799   5.923 -19.380
   67    HE1  TRP  10           HE1      TRP  10   9.067   7.603 -21.194
   68    HE3  TRP  10           HE3      TRP  10  14.357   7.753 -20.779
   69    HZ2  TRP  10           HZ2      TRP  10  10.259   9.475 -23.000
   70    HZ3  TRP  10           HZ3      TRP  10  14.529   9.482 -22.546
   71    HH2  TRP  10           HH2      TRP  10  12.488  10.344 -23.657
   72    H    VAL  11           H        VAL  11  14.426   4.891 -16.642
   73    HA   VAL  11           HA       VAL  11  12.953   2.682 -15.724
   74    HB   VAL  11           HB       VAL  11  15.654   3.767 -14.923
   75   HG11  VAL  11          HG11      VAL  11  14.111   1.375 -13.928
   76   HG12  VAL  11          HG12      VAL  11  15.021   2.560 -12.995
   77   HG13  VAL  11          HG13      VAL  11  15.874   1.358 -13.964
   78   HG21  VAL  11          HG21      VAL  11  16.467   1.912 -16.266
   79   HG22  VAL  11          HG22      VAL  11  15.301   2.819 -17.228
   80   HG23  VAL  11          HG23      VAL  11  14.830   1.295 -16.475
   81    H    ILE  12           H        ILE  12  13.900   5.683 -14.138
   82    HA   ILE  12           HA       ILE  12  12.997   4.966 -11.530
   83    HB   ILE  12           HB       ILE  12  13.178   7.765 -12.630
   84   HG13  ILE  12          HG13      ILE  12  15.560   7.664 -11.769
   85   HG21  ILE  12          HG21      ILE  12  12.410   6.769 -10.159
   86   HG22  ILE  12          HG22      ILE  12  12.977   8.409 -10.472
   87   HG23  ILE  12          HG23      ILE  12  14.110   7.175  -9.918
   88   HD11  ILE  12          HD11      ILE  12  15.040   5.490 -10.459
   89   HD12  ILE  12          HD12      ILE  12  16.591   5.593 -11.291
   90   HD13  ILE  12          HD13      ILE  12  15.268   4.670 -12.003
   91    H    LEU  13           H        LEU  13  11.509   6.644 -14.249
   92    HA   LEU  13           HA       LEU  13   9.156   7.507 -13.048
   93    HB3  LEU  13           HB3      LEU  13   8.931   6.393 -15.795
   94    HG   LEU  13           HG       LEU  13   8.392   9.110 -14.558
   95   HD11  LEU  13          HD11      LEU  13   8.667   9.386 -16.917
   96   HD12  LEU  13          HD12      LEU  13   6.928   9.310 -16.637
   97   HD13  LEU  13          HD13      LEU  13   7.782   7.899 -17.262
   98   HD21  LEU  13          HD21      LEU  13   6.846   7.680 -13.536
   99   HD22  LEU  13          HD22      LEU  13   6.757   6.613 -14.938
  100   HD23  LEU  13          HD23      LEU  13   5.967   8.190 -14.978
  101    H    LEU  14           H        LEU  14   9.958   4.390 -14.514
  102    HA   LEU  14           HA       LEU  14   7.407   3.196 -14.001
  103    HB3  LEU  14           HB3      LEU  14   9.202   1.108 -14.160
  104    HG   LEU  14           HG       LEU  14   8.629   1.122 -16.612
  105   HD11  LEU  14          HD11      LEU  14   5.995   1.688 -15.676
  106   HD12  LEU  14          HD12      LEU  14   6.886   0.943 -14.350
  107   HD13  LEU  14          HD13      LEU  14   6.755   0.113 -15.899
  108   HD21  LEU  14          HD21      LEU  14   6.785   3.400 -16.261
  109   HD22  LEU  14          HD22      LEU  14   7.778   2.960 -17.649
  110   HD23  LEU  14          HD23      LEU  14   8.493   3.842 -16.301
  111    H    SER  15           H        SER  15  10.473   3.461 -12.330
  112    HA   SER  15           HA       SER  15  10.118   1.535 -10.329
  113    HB3  SER  15           HB3      SER  15  11.788   2.682  -9.060
  114    HG   SER  15           HG       SER  15  12.471   1.825 -11.072
  115    H    ALA  16           H        ALA  16   9.252   4.984 -10.293
  116    HA   ALA  16           HA       ALA  16   7.987   4.890  -7.744
  117    HB1  ALA  16           HB1      ALA  16   8.748   6.950  -9.179
  118    HB2  ALA  16           HB2      ALA  16   7.320   7.085  -8.154
  119    HB3  ALA  16           HB3      ALA  16   7.140   6.815  -9.888
  120    H    PHE  17           H        PHE  17   6.968   4.310 -11.045
  121    HA   PHE  17           HA       PHE  17   4.173   4.210 -10.571
  122    HB3  PHE  17           HB3      PHE  17   5.652   2.536 -12.615
  123    HD1  PHE  17           HD1      PHE  17   2.728   4.874 -12.519
  124    HD2  PHE  17           HD2      PHE  17   4.096   0.838 -13.063
  125    HE1  PHE  17           HE1      PHE  17   0.427   4.176 -13.126
  126    HE2  PHE  17           HE2      PHE  17   1.794   0.140 -13.671
  127    HZ   PHE  17           HZ       PHE  17  -0.041   1.809 -13.702
  128    H    ALA  18           H        ALA  18   6.730   1.777 -10.325
  129    HA   ALA  18           HA       ALA  18   4.929  -0.353  -9.615
  130    HB1  ALA  18           HB1      ALA  18   6.867  -1.684  -9.308
  131    HB2  ALA  18           HB2      ALA  18   7.889  -0.276  -9.029
  132    HB3  ALA  18           HB3      ALA  18   7.262  -0.603 -10.645
  133    H    GLY  19           H        GLY  19   7.231   1.676  -7.803
  134    HA2  GLY  19           HA3      GLY  19   6.819   0.620  -5.255
  135    HA3  GLY  19           HA2      GLY  19   7.287   2.288  -5.580
  136    H    LEU  20           H        LEU  20   5.144   3.300  -6.870
  137    HA   LEU  20           HA       LEU  20   3.337   3.971  -4.837
  138    HB3  LEU  20           HB3      LEU  20   2.645   4.056  -7.772
  139    HG   LEU  20           HG       LEU  20   1.125   4.771  -5.727
  140   HD11  LEU  20          HD11      LEU  20   3.241   6.287  -5.057
  141   HD12  LEU  20          HD12      LEU  20   1.586   6.795  -4.727
  142   HD13  LEU  20          HD13      LEU  20   2.435   7.419  -6.141
  143   HD21  LEU  20          HD21      LEU  20   0.458   6.837  -7.224
  144   HD22  LEU  20          HD22      LEU  20   0.253   5.202  -7.850
  145   HD23  LEU  20          HD23      LEU  20   1.650   6.165  -8.336
  146    H    LEU  21           H        LEU  21   3.427   1.349  -7.004
  147    HA   LEU  21           HA       LEU  21   0.665   0.536  -6.803
  148    HB3  LEU  21           HB3      LEU  21   2.585  -1.601  -7.392
  149    HG   LEU  21           HG       LEU  21   0.354  -0.284  -8.972
  150   HD11  LEU  21          HD11      LEU  21   0.994  -1.624 -10.661
  151   HD12  LEU  21          HD12      LEU  21   0.739  -3.026  -9.622
  152   HD13  LEU  21          HD13      LEU  21   2.321  -2.250  -9.682
  153   HD21  LEU  21          HD21      LEU  21   0.435  -2.327  -6.813
  154   HD22  LEU  21          HD22      LEU  21  -0.608  -2.693  -8.184
  155   HD23  LEU  21          HD23      LEU  21  -0.856  -1.213  -7.259
  156    H    LEU  22           H        LEU  22   3.690  -0.582  -5.308
  157    HA   LEU  22           HA       LEU  22   2.357  -2.447  -3.565
  158    HB3  LEU  22           HB3      LEU  22   4.519  -2.920  -2.693
  159    HG   LEU  22           HG       LEU  22   4.917  -2.085  -5.581
  160   HD11  LEU  22          HD11      LEU  22   6.384  -4.183  -5.508
  161   HD12  LEU  22          HD12      LEU  22   6.244  -4.097  -3.753
  162   HD13  LEU  22          HD13      LEU  22   6.999  -2.775  -4.643
  163   HD21  LEU  22          HD21      LEU  22   2.954  -3.388  -5.633
  164   HD22  LEU  22          HD22      LEU  22   3.493  -4.418  -4.305
  165   HD23  LEU  22          HD23      LEU  22   4.227  -4.579  -5.902
  166    H    LEU  23           H        LEU  23   3.639   0.774  -3.324
  167    HA   LEU  23           HA       LEU  23   3.680   1.158  -0.566
  168    HB3  LEU  23           HB3      LEU  23   2.420   3.486  -1.708
  169    HG   LEU  23           HG       LEU  23   4.051   3.346   0.196
  170   HD11  LEU  23          HD11      LEU  23   6.452   3.430  -1.374
  171   HD12  LEU  23          HD12      LEU  23   5.573   1.953  -1.764
  172   HD13  LEU  23          HD13      LEU  23   6.019   2.296  -0.095
  173   HD21  LEU  23          HD21      LEU  23   3.931   5.541  -0.486
  174   HD22  LEU  23          HD22      LEU  23   4.324   5.151  -2.160
  175   HD23  LEU  23          HD23      LEU  23   5.604   5.225  -0.948
  176    H    MET  24           H        MET  24   0.844   1.763  -2.679
  177    HA   MET  24           HA       MET  24  -1.037   2.302  -0.761
  178    HB3  MET  24           HB3      MET  24  -1.842   0.481  -2.983
  179    HG3  MET  24           HG3      MET  24  -2.928   3.209  -2.362
  180    HE1  MET  24           HE1      MET  24  -4.749   3.894  -3.686
  181    HE2  MET  24           HE2      MET  24  -5.238   2.988  -5.115
  182    HE3  MET  24           HE3      MET  24  -3.535   3.351  -4.852
  183    H    LEU  25           H        LEU  25   0.187  -0.860  -1.723
  184    HA   LEU  25           HA       LEU  25  -1.699  -2.382  -0.208
  185    HB3  LEU  25           HB3      LEU  25   0.467  -4.029  -0.370
  186    HG   LEU  25           HG       LEU  25  -1.707  -3.332  -2.341
  187   HD11  LEU  25          HD11      LEU  25   0.455  -5.436  -2.581
  188   HD12  LEU  25          HD12      LEU  25   0.033  -4.183  -3.750
  189   HD13  LEU  25          HD13      LEU  25  -1.070  -5.528  -3.461
  190   HD21  LEU  25          HD21      LEU  25  -1.473  -6.014  -1.123
  191   HD22  LEU  25          HD22      LEU  25  -2.884  -4.969  -1.277
  192   HD23  LEU  25          HD23      LEU  25  -1.733  -4.708   0.033
  193    H    LEU  26           H        LEU  26   1.581  -1.181   0.413
  194    HA   LEU  26           HA       LEU  26   1.986  -2.325   2.939
  195    HB3  LEU  26           HB3      LEU  26   2.935   0.464   2.400
  196    HG   LEU  26           HG       LEU  26   3.527  -1.228   4.364
  197   HD11  LEU  26          HD11      LEU  26   5.768  -1.915   2.500
  198   HD12  LEU  26          HD12      LEU  26   4.274  -2.848   2.396
  199   HD13  LEU  26          HD13      LEU  26   5.175  -2.793   3.910
  200   HD21  LEU  26          HD21      LEU  26   4.545   0.915   4.329
  201   HD22  LEU  26          HD22      LEU  26   5.375   0.587   2.808
  202   HD23  LEU  26          HD23      LEU  26   5.904  -0.208   4.289
  203    H    ILE  27           H        ILE  27   0.131   0.430   1.912
  204    HA   ILE  27           HA       ILE  27  -0.405   1.376   4.623
  205    HB   ILE  27           HB       ILE  27  -1.526   2.097   1.912
  206   HG13  ILE  27          HG13      ILE  27   0.767   2.888   3.059
  207   HG21  ILE  27          HG21      ILE  27  -3.426   2.345   3.297
  208   HG22  ILE  27          HG22      ILE  27  -2.696   3.951   3.294
  209   HG23  ILE  27          HG23      ILE  27  -2.460   2.877   4.674
  210   HD11  ILE  27          HD11      ILE  27   0.074   3.628   0.869
  211   HD12  ILE  27          HD12      ILE  27   0.472   5.063   1.815
  212   HD13  ILE  27          HD13      ILE  27  -1.215   4.616   1.558
  213    H    LEU  28           H        LEU  28  -2.457   0.146   2.019
  214    HA   LEU  28           HA       LEU  28  -4.739  -0.451   3.390
  215    HB3  LEU  28           HB3      LEU  28  -4.541  -2.628   1.680
  216    HG   LEU  28           HG       LEU  28  -5.445   0.232   1.277
  217   HD11  LEU  28          HD11      LEU  28  -5.963  -2.143  -0.536
  218   HD12  LEU  28          HD12      LEU  28  -4.868  -0.812  -0.911
  219   HD13  LEU  28          HD13      LEU  28  -6.597  -0.509  -0.741
  220   HD21  LEU  28          HD21      LEU  28  -6.485  -1.879   2.752
  221   HD22  LEU  28          HD22      LEU  28  -7.392  -1.958   1.244
  222   HD23  LEU  28          HD23      LEU  28  -7.392  -0.474   2.196
  223    H    ALA  29           H        ALA  29  -1.758  -2.312   3.342
  224    HA   ALA  29           HA       ALA  29  -2.816  -4.581   4.756
  225    HB1  ALA  29           HB1      ALA  29  -0.278  -4.916   5.246
  226    HB2  ALA  29           HB2      ALA  29  -0.052  -3.577   4.119
  227    HB3  ALA  29           HB3      ALA  29  -0.845  -5.059   3.581
  228    H    LEU  30           H        LEU  30  -0.984  -1.707   5.651
  229    HA   LEU  30           HA       LEU  30  -0.463  -2.146   8.304
  230    HB3  LEU  30           HB3      LEU  30  -1.492   0.560   7.853
  231    HG   LEU  30           HG       LEU  30   0.171  -0.309   9.604
  232   HD11  LEU  30          HD11      LEU  30   2.424   0.168   7.802
  233   HD12  LEU  30          HD12      LEU  30   1.487  -1.253   7.335
  234   HD13  LEU  30          HD13      LEU  30   2.173  -1.139   8.957
  235   HD21  LEU  30          HD21      LEU  30   0.757   2.055   7.808
  236   HD22  LEU  30          HD22      LEU  30   1.635   1.763   9.307
  237   HD23  LEU  30          HD23      LEU  30  -0.104   2.054   9.346
  238    H    TRP  31           H        TRP  31  -3.574  -1.212   6.889
  239    HA   TRP  31           HA       TRP  31  -4.866  -0.784   9.424
  240    HB3  TRP  31           HB3      TRP  31  -6.961  -1.127   7.883
  241    HD1  TRP  31           HD1      TRP  31  -3.834   1.108   7.417
  242    HE1  TRP  31           HE1      TRP  31  -4.557   3.568   7.686
  243    HE3  TRP  31           HE3      TRP  31  -8.858   0.483   8.089
  244    HZ2  TRP  31           HZ2      TRP  31  -6.949   5.072   8.127
  245    HZ3  TRP  31           HZ3      TRP  31 -10.334   2.445   8.431
  246    HH2  TRP  31           HH2      TRP  31  -9.387   4.735   8.451
  247    H    LYS  32           H        LYS  32  -4.887  -3.344   7.038
  248    HA   LYS  32           HA       LYS  32  -6.620  -5.147   8.267
  249    HB3  LYS  32           HB3      LYS  32  -5.360  -6.988   7.188
  250    HG3  LYS  32           HG3      LYS  32  -5.127  -5.034   5.039
  251    HD3  LYS  32           HD3      LYS  32  -5.669  -7.507   4.906
  252    HE3  LYS  32           HE3      LYS  32  -7.662  -6.758   6.755
  253    HZ1  LYS  32           HZ1      LYS  32  -9.600  -7.722   5.428
  254    HZ2  LYS  32           HZ2      LYS  32  -8.702  -7.303   4.046
  255    HZ3  LYS  32           HZ3      LYS  32  -9.182  -6.102   5.149
  256    H    ILE  33           H        ILE  33  -3.088  -4.944   8.735
  257    HA   ILE  33           HA       ILE  33  -3.127  -6.705  10.995
  258    HB   ILE  33           HB       ILE  33  -0.967  -4.841   9.988
  259   HG13  ILE  33          HG13      ILE  33  -1.864  -6.678   8.434
  260   HG21  ILE  33          HG21      ILE  33   0.334  -6.849  11.230
  261   HG22  ILE  33          HG22      ILE  33  -1.131  -6.818  12.209
  262   HG23  ILE  33          HG23      ILE  33  -0.136  -5.369  12.062
  263   HD11  ILE  33          HD11      ILE  33   1.027  -6.778   9.350
  264   HD12  ILE  33          HD12      ILE  33   0.358  -5.667   8.153
  265   HD13  ILE  33          HD13      ILE  33   0.427  -7.396   7.809
  266    H    GLY  34           H        GLY  34  -4.380  -3.711  10.850
  267    HA2  GLY  34           HA3      GLY  34  -3.709  -3.172  13.676
  268    HA3  GLY  34           HA2      GLY  34  -3.577  -1.873  12.497
  269    H    PHE  35           H        PHE  35  -5.624  -1.531  11.166
  270    HA   PHE  35           HA       PHE  35  -7.686  -0.562  12.633
  271    HB3  PHE  35           HB3      PHE  35  -8.235  -1.965  10.034
  272    HD1  PHE  35           HD1      PHE  35  -8.293   1.571  11.222
  273    HD2  PHE  35           HD2      PHE  35 -10.589  -1.892  10.146
  274    HE1  PHE  35           HE1      PHE  35 -10.376   2.917  11.342
  275    HE2  PHE  35           HE2      PHE  35 -12.673  -0.549  10.268
  276    HZ   PHE  35           HZ       PHE  35 -12.565   1.855  10.866
  277    H    PHE  36           H        PHE  36  -6.987  -3.850  12.098
  278    HA   PHE  36           HA       PHE  36  -9.649  -4.729  12.983
  279    HB3  PHE  36           HB3      PHE  36  -7.854  -6.920  12.703
  280    HD1  PHE  36           HD1      PHE  36 -10.246  -7.622  13.294
  281    HD2  PHE  36           HD2      PHE  36  -9.196  -5.771   9.562
  282    HE1  PHE  36           HE1      PHE  36 -12.358  -8.446  12.291
  283    HE2  PHE  36           HE2      PHE  36 -11.308  -6.594   8.560
  284    HZ   PHE  36           HZ       PHE  36 -12.890  -7.931   9.923
  285    H    LYS  37           H        LYS  37  -6.244  -4.815  13.803
  286    HA   LYS  37           HA       LYS  37  -5.131  -5.228  15.785
  287    HB3  LYS  37           HB3      LYS  37  -7.579  -4.482  17.334
  288    HG3  LYS  37           HG3      LYS  37  -4.660  -3.669  17.466
  289    HD3  LYS  37           HD3      LYS  37  -6.240  -1.992  18.396
  290    HE3  LYS  37           HE3      LYS  37  -7.335  -4.445  19.672
  291    HZ1  LYS  37           HZ1      LYS  37  -6.390  -3.171  21.527
  292    HZ2  LYS  37           HZ2      LYS  37  -8.087  -3.233  21.581
  293    HZ3  LYS  37           HZ3      LYS  37  -7.301  -1.820  21.056
  294    H    ARG  38           H        ARG  38  -6.344  -7.451  14.604
  295    HA   ARG  38           HA       ARG  38  -8.020  -9.032  16.122
  296    HB3  ARG  38           HB3      ARG  38  -6.334 -10.882  15.080
  297    HG3  ARG  38           HG3      ARG  38  -8.447  -9.150  13.807
  298    HD3  ARG  38           HD3      ARG  38  -6.585 -11.076  12.494
  299    HE   ARG  38           HE       ARG  38  -9.173 -10.951  11.209
  300   HH11  ARG  38          HH11      ARG  38  -7.111 -12.627  13.427
  301   HH12  ARG  38          HH12      ARG  38  -7.934 -14.142  13.261
  302   HH21  ARG  38          HH21      ARG  38 -10.259 -12.933  10.990
  303   HH22  ARG  38          HH22      ARG  38  -9.716 -14.315  11.880
  304    HA   PRO  39           HA       PRO  39  -6.006 -10.281  19.856
  305    HB3  PRO  39           HB3      PRO  39  -7.434 -12.009  20.286
  306    HG3  PRO  39           HG3      PRO  39  -8.611 -12.941  18.562
  307    HD3  PRO  39           HD3      PRO  39  -8.736 -10.674  17.997
  308    H    LEU  40           H        LEU  40  -4.530 -12.918  20.064
  309    HA   LEU  40           HA       LEU  40  -2.088 -12.122  18.602
  310    HB3  LEU  40           HB3      LEU  40  -1.364 -13.873  20.667
  311    HG   LEU  40           HG       LEU  40  -0.422 -11.809  21.708
  312   HD11  LEU  40          HD11      LEU  40   1.217 -12.114  20.205
  313   HD12  LEU  40          HD12      LEU  40   0.341 -11.095  19.063
  314   HD13  LEU  40          HD13      LEU  40   0.075 -12.836  19.075
  315   HD21  LEU  40          HD21      LEU  40  -1.195  -9.733  21.222
  316   HD22  LEU  40          HD22      LEU  40  -2.604 -10.566  20.566
  317   HD23  LEU  40          HD23      LEU  40  -1.291 -10.079  19.495
  318    H    LYS  41           H        LYS  41  -0.617 -14.446  18.925
  319    HA   LYS  41           HA       LYS  41  -2.156 -16.346  17.276
  320    HB3  LYS  41           HB3      LYS  41   0.276 -17.181  16.796
  321    HG3  LYS  41           HG3      LYS  41  -0.788 -14.534  15.768
  322    HD3  LYS  41           HD3      LYS  41   0.637 -15.877  13.761
  323    HE3  LYS  41           HE3      LYS  41   1.517 -13.587  15.542
  324    HZ1  LYS  41           HZ1      LYS  41   2.400 -14.631  12.937
  325    HZ2  LYS  41           HZ2      LYS  41   3.335 -14.120  14.260
  326    HZ3  LYS  41           HZ3      LYS  41   2.548 -12.977  13.278
  327    H    LYS  42           H        LYS  42  -2.487 -18.385  17.972
  328    HA   LYS  42           HA       LYS  42  -0.795 -19.663  19.911
  329    HB3  LYS  42           HB3      LYS  42  -3.614 -19.239  20.853
  330    HG3  LYS  42           HG3      LYS  42  -1.126 -19.564  22.510
  331    HD3  LYS  42           HD3      LYS  42  -3.895 -20.693  22.929
  332    HE3  LYS  42           HE3      LYS  42  -1.879 -19.778  24.979
  333    HZ1  LYS  42           HZ1      LYS  42  -3.178 -20.950  26.421
  334    HZ2  LYS  42           HZ2      LYS  42  -3.750 -22.021  25.234
  335    HZ3  LYS  42           HZ3      LYS  42  -4.363 -20.438  25.321
  336    H    LYS  43           H        LYS  43  -3.840 -19.575  18.150
  337    HA   LYS  43           HA       LYS  43  -5.199 -21.271  17.350
  338    HB3  LYS  43           HB3      LYS  43  -4.008 -22.847  15.923
  339    HG3  LYS  43           HG3      LYS  43  -2.220 -20.526  15.597
  340    HD3  LYS  43           HD3      LYS  43  -4.477 -21.542  13.856
  341    HE3  LYS  43           HE3      LYS  43  -3.471 -20.338  12.149
  342    HZ1  LYS  43           HZ1      LYS  43  -4.098 -18.912  14.136
  343    HZ2  LYS  43           HZ2      LYS  43  -3.093 -18.202  12.964
  344    HZ3  LYS  43           HZ3      LYS  43  -2.434 -18.764  14.425
  345    H    MET  44           H        MET  44  -3.172 -23.917  17.544
  346    HA   MET  44           HA       MET  44  -4.456 -24.844  20.044
  347    HB3  MET  44           HB3      MET  44  -4.047 -27.166  18.891
  348    HG3  MET  44           HG3      MET  44  -6.209 -25.177  18.166
  349    HE1  MET  44           HE1      MET  44  -8.688 -26.796  18.199
  350    HE2  MET  44           HE2      MET  44  -7.893 -28.072  19.118
  351    HE3  MET  44           HE3      MET  44  -8.669 -28.454  17.583
  352    H    GLU  45           H        GLU  45  -3.220 -26.863  20.893
  353    HA   GLU  45           HA       GLU  45  -0.677 -26.024  21.754
  354    HB3  GLU  45           HB3      GLU  45  -2.106 -27.636  22.978
  355    HG3  GLU  45           HG3      GLU  45  -1.206 -29.626  20.879
  356    H    LYS  46           H        LYS  46   0.756 -28.545  21.467
  357    HA   LYS  46           HA       LYS  46   1.299 -28.707  18.589
  358    HB3  LYS  46           HB3      LYS  46   2.808 -26.954  19.337
  359    HG3  LYS  46           HG3      LYS  46   4.539 -28.362  21.096
  360    HD3  LYS  46           HD3      LYS  46   2.550 -26.119  21.564
  361    HE3  LYS  46           HE3      LYS  46   4.683 -25.718  23.251
  362    HZ1  LYS  46           HZ1      LYS  46   1.955 -26.354  23.407
  363    HZ2  LYS  46           HZ2      LYS  46   2.913 -25.524  24.538
  364    HZ3  LYS  46           HZ3      LYS  46   2.769 -27.215  24.620
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1  33.681  -7.313 -21.419
    2    H2   MET   1           H2       MET   1  33.393  -5.702 -21.875
    3    H3   MET   1           H3       MET   1  32.683  -6.330 -20.463
    4    HA   MET   1           HA       MET   1  35.191  -6.776 -19.843
    5    HB3  MET   1           HB3      MET   1  35.879  -5.802 -22.078
    6    HG3  MET   1           HG3      MET   1  35.457  -3.080 -20.939
    7    HE1  MET   1           HE1      MET   1  33.506  -2.974 -24.160
    8    HE2  MET   1           HE2      MET   1  34.632  -1.660 -24.492
    9    HE3  MET   1           HE3      MET   1  33.957  -1.847 -22.875
   10    H    GLY   2           H        GLY   2  32.437  -5.780 -19.161
   11    HA2  GLY   2           HA3      GLY   2  32.122  -4.881 -16.878
   12    HA3  GLY   2           HA2      GLY   2  33.241  -3.596 -17.323
   13    H    LEU   3           H        LEU   3  30.045  -4.339 -16.947
   14    HA   LEU   3           HA       LEU   3  28.896  -2.869 -19.125
   15    HB3  LEU   3           HB3      LEU   3  26.823  -3.384 -18.166
   16    HG   LEU   3           HG       LEU   3  28.668  -5.397 -18.300
   17   HD11  LEU   3          HD11      LEU   3  27.348  -5.778 -15.616
   18   HD12  LEU   3          HD12      LEU   3  28.924  -4.999 -15.736
   19   HD13  LEU   3          HD13      LEU   3  28.714  -6.655 -16.304
   20   HD21  LEU   3          HD21      LEU   3  26.395  -5.586 -19.103
   21   HD22  LEU   3          HD22      LEU   3  25.758  -5.493 -17.460
   22   HD23  LEU   3          HD23      LEU   3  26.677  -6.908 -17.970
   23    HA   PRO   4           HA       PRO   4  29.387   1.237 -17.514
   24    HB3  PRO   4           HB3      PRO   4  28.463   2.149 -19.397
   25    HG3  PRO   4           HG3      PRO   4  26.938   0.967 -20.624
   26    HD3  PRO   4           HD3      PRO   4  28.417  -0.770 -20.232
   27    H    GLY   5           H        GLY   5  26.493  -0.588 -16.760
   28    HA2  GLY   5           HA3      GLY   5  25.297  -0.761 -14.807
   29    HA3  GLY   5           HA2      GLY   5  26.501   0.268 -14.041
   30    H    ARG   6           H        ARG   6  25.840   2.222 -16.413
   31    HA   ARG   6           HA       ARG   6  24.274   3.997 -14.965
   32    HB3  ARG   6           HB3      ARG   6  24.135   4.010 -17.961
   33    HG3  ARG   6           HG3      ARG   6  24.245   6.029 -15.754
   34    HD3  ARG   6           HD3      ARG   6  24.913   7.656 -17.738
   35    HE   ARG   6           HE       ARG   6  26.306   7.710 -15.813
   36   HH11  ARG   6          HH11      ARG   6  27.080   5.147 -18.011
   37   HH12  ARG   6          HH12      ARG   6  28.632   4.843 -17.316
   38   HH21  ARG   6          HH21      ARG   6  28.333   7.308 -14.897
   39   HH22  ARG   6          HH22      ARG   6  29.343   6.063 -15.554
   40    H    VAL   7           H        VAL   7  22.198   4.001 -14.425
   41    HA   VAL   7           HA       VAL   7  20.360   2.159 -15.763
   42    HB   VAL   7           HB       VAL   7  19.571   3.771 -13.382
   43   HG11  VAL   7          HG11      VAL   7  18.014   2.159 -14.426
   44   HG12  VAL   7          HG12      VAL   7  18.458   1.649 -12.798
   45   HG13  VAL   7          HG13      VAL   7  19.195   0.871 -14.199
   46   HG21  VAL   7          HG21      VAL   7  20.692   1.940 -11.983
   47   HG22  VAL   7          HG22      VAL   7  21.772   3.141 -12.695
   48   HG23  VAL   7          HG23      VAL   7  21.620   1.545 -13.430
   49    HA   PRO   8           HA       PRO   8  18.940   5.813 -18.147
   50    HB3  PRO   8           HB3      PRO   8  17.594   4.924 -19.800
   51    HG3  PRO   8           HG3      PRO   8  19.334   3.446 -19.943
   52    HD3  PRO   8           HD3      PRO   8  20.308   2.558 -18.063
   53    H    LEU   9           H        LEU   9  17.373   7.375 -17.813
   54    HA   LEU   9           HA       LEU   9  16.224   7.610 -15.262
   55    HB3  LEU   9           HB3      LEU   9  15.126   9.588 -16.134
   56    HG   LEU   9           HG       LEU   9  17.922   8.985 -16.446
   57   HD11  LEU   9          HD11      LEU   9  16.772  10.949 -18.455
   58   HD12  LEU   9          HD12      LEU   9  17.554   9.416 -18.842
   59   HD13  LEU   9          HD13      LEU   9  18.489  10.724 -18.117
   60   HD21  LEU   9          HD21      LEU   9  16.829  10.512 -14.789
   61   HD22  LEU   9          HD22      LEU   9  16.489  11.637 -16.104
   62   HD23  LEU   9          HD23      LEU   9  18.157  11.280 -15.658
   63    H    TRP  10           H        TRP  10  14.944   6.259 -18.235
   64    HA   TRP  10           HA       TRP  10  12.209   6.397 -17.762
   65    HB3  TRP  10           HB3      TRP  10  12.400   3.974 -18.926
   66    HD1  TRP  10           HD1      TRP  10  14.189   6.785 -20.795
   67    HE1  TRP  10           HE1      TRP  10  12.538   7.851 -22.465
   68    HE3  TRP  10           HE3      TRP  10   9.885   4.401 -19.426
   69    HZ2  TRP  10           HZ2      TRP  10   9.760   7.712 -23.131
   70    HZ3  TRP  10           HZ3      TRP  10   7.753   4.887 -20.594
   71    HH2  TRP  10           HH2      TRP  10   7.685   6.537 -22.442
   72    H    VAL  11           H        VAL  11  14.597   4.094 -16.554
   73    HA   VAL  11           HA       VAL  11  12.911   2.215 -15.380
   74    HB   VAL  11           HB       VAL  11  15.645   3.214 -14.578
   75   HG11  VAL  11          HG11      VAL  11  13.897   1.076 -13.360
   76   HG12  VAL  11          HG12      VAL  11  14.799   2.353 -12.544
   77   HG13  VAL  11          HG13      VAL  11  15.656   0.990 -13.262
   78   HG21  VAL  11          HG21      VAL  11  16.409   1.653 -16.036
   79   HG22  VAL  11          HG22      VAL  11  14.766   1.617 -16.672
   80   HG23  VAL  11          HG23      VAL  11  15.265   0.442 -15.457
   81    H    ILE  12           H        ILE  12  14.006   5.331 -14.163
   82    HA   ILE  12           HA       ILE  12  13.004   5.066 -11.526
   83    HB   ILE  12           HB       ILE  12  13.607   7.520 -13.181
   84   HG13  ILE  12          HG13      ILE  12  15.477   5.910 -12.564
   85   HG21  ILE  12          HG21      ILE  12  13.690   8.567 -10.818
   86   HG22  ILE  12          HG22      ILE  12  12.750   7.166 -10.306
   87   HG23  ILE  12          HG23      ILE  12  12.097   8.273 -11.514
   88   HD11  ILE  12          HD11      ILE  12  15.495   8.693 -11.360
   89   HD12  ILE  12          HD12      ILE  12  15.947   8.264 -13.011
   90   HD13  ILE  12          HD13      ILE  12  16.934   7.719 -11.655
   91    H    LEU  13           H        LEU  13  11.551   6.300 -14.492
   92    HA   LEU  13           HA       LEU  13   9.284   7.509 -13.365
   93    HB3  LEU  13           HB3      LEU  13   8.633   6.282 -15.887
   94    HG   LEU  13           HG       LEU  13   7.822   8.463 -14.901
   95   HD11  LEU  13          HD11      LEU  13  10.042   9.998 -16.000
   96   HD12  LEU  13          HD12      LEU  13  10.566   8.961 -14.676
   97   HD13  LEU  13          HD13      LEU  13   9.271  10.130 -14.420
   98   HD21  LEU  13          HD21      LEU  13   8.545   9.655 -17.281
   99   HD22  LEU  13          HD22      LEU  13   7.189   8.546 -17.077
  100   HD23  LEU  13          HD23      LEU  13   8.745   7.941 -17.642
  101    H    LEU  14           H        LEU  14   9.776   4.218 -14.585
  102    HA   LEU  14           HA       LEU  14   7.160   3.301 -13.931
  103    HB3  LEU  14           HB3      LEU  14   8.169   1.028 -14.142
  104    HG   LEU  14           HG       LEU  14   8.293   3.175 -16.155
  105   HD11  LEU  14          HD11      LEU  14  10.503   2.306 -16.578
  106   HD12  LEU  14          HD12      LEU  14   9.434   1.634 -17.809
  107   HD13  LEU  14          HD13      LEU  14   9.933   0.643 -16.438
  108   HD21  LEU  14          HD21      LEU  14   6.900   1.663 -17.371
  109   HD22  LEU  14          HD22      LEU  14   6.423   1.489 -15.683
  110   HD23  LEU  14          HD23      LEU  14   7.463   0.278 -16.435
  111    H    SER  15           H        SER  15  10.255   3.323 -12.321
  112    HA   SER  15           HA       SER  15   9.729   1.767 -10.090
  113    HB3  SER  15           HB3      SER  15  11.470   2.987  -8.914
  114    HG   SER  15           HG       SER  15  12.899   3.212 -10.980
  115    H    ALA  16           H        ALA  16   9.201   5.291 -10.401
  116    HA   ALA  16           HA       ALA  16   7.967   5.573  -7.873
  117    HB1  ALA  16           HB1      ALA  16   7.481   7.256 -10.341
  118    HB2  ALA  16           HB2      ALA  16   8.859   7.463  -9.261
  119    HB3  ALA  16           HB3      ALA  16   7.221   7.732  -8.664
  120    H    PHE  17           H        PHE  17   6.826   4.549 -11.017
  121    HA   PHE  17           HA       PHE  17   4.023   4.815 -10.408
  122    HB3  PHE  17           HB3      PHE  17   5.346   3.074 -12.498
  123    HD1  PHE  17           HD1      PHE  17   2.323   5.242 -11.988
  124    HD2  PHE  17           HD2      PHE  17   3.853   1.388 -13.113
  125    HE1  PHE  17           HE1      PHE  17   0.019   4.471 -12.486
  126    HE2  PHE  17           HE2      PHE  17   1.550   0.619 -13.610
  127    HZ   PHE  17           HZ       PHE  17  -0.367   2.160 -13.297
  128    H    ALA  18           H        ALA  18   6.285   2.060 -10.421
  129    HA   ALA  18           HA       ALA  18   4.314   0.211  -9.408
  130    HB1  ALA  18           HB1      ALA  18   6.221  -1.331  -9.185
  131    HB2  ALA  18           HB2      ALA  18   7.336  -0.008  -9.529
  132    HB3  ALA  18           HB3      ALA  18   6.218  -0.567 -10.774
  133    H    GLY  19           H        GLY  19   6.916   2.138  -8.179
  134    HA2  GLY  19           HA3      GLY  19   7.134   1.232  -5.549
  135    HA3  GLY  19           HA2      GLY  19   7.442   2.895  -6.044
  136    H    LEU  20           H        LEU  20   4.875   3.570  -6.967
  137    HA   LEU  20           HA       LEU  20   3.595   4.248  -4.511
  138    HB3  LEU  20           HB3      LEU  20   1.748   4.605  -6.622
  139    HG   LEU  20           HG       LEU  20   2.391   6.990  -6.377
  140   HD11  LEU  20          HD11      LEU  20   2.518   6.389  -3.575
  141   HD12  LEU  20          HD12      LEU  20   1.449   5.229  -4.362
  142   HD13  LEU  20          HD13      LEU  20   1.139   6.958  -4.515
  143   HD21  LEU  20          HD21      LEU  20   4.908   5.906  -5.740
  144   HD22  LEU  20          HD22      LEU  20   4.316   6.607  -4.233
  145   HD23  LEU  20          HD23      LEU  20   4.449   7.607  -5.681
  146    H    LEU  21           H        LEU  21   3.101   1.775  -6.916
  147    HA   LEU  21           HA       LEU  21   0.571   0.829  -5.947
  148    HB3  LEU  21           HB3      LEU  21   1.346  -1.336  -7.179
  149    HG   LEU  21           HG       LEU  21   0.695   1.357  -8.295
  150   HD11  LEU  21          HD11      LEU  21   2.113   0.720 -10.055
  151   HD12  LEU  21          HD12      LEU  21   0.548   0.096 -10.576
  152   HD13  LEU  21          HD13      LEU  21   1.739  -0.992  -9.863
  153   HD21  LEU  21          HD21      LEU  21  -0.981  -0.281  -7.323
  154   HD22  LEU  21          HD22      LEU  21  -0.606  -1.356  -8.669
  155   HD23  LEU  21          HD23      LEU  21  -1.323   0.224  -8.978
  156    H    LEU  22           H        LEU  22   3.933  -0.154  -5.463
  157    HA   LEU  22           HA       LEU  22   3.467  -2.282  -3.666
  158    HB3  LEU  22           HB3      LEU  22   5.912  -0.613  -3.330
  159    HG   LEU  22           HG       LEU  22   5.311  -2.980  -2.368
  160   HD11  LEU  22          HD11      LEU  22   6.612  -4.028  -4.827
  161   HD12  LEU  22          HD12      LEU  22   4.907  -3.600  -4.968
  162   HD13  LEU  22          HD13      LEU  22   5.421  -4.788  -3.772
  163   HD21  LEU  22          HD21      LEU  22   7.950  -2.449  -3.775
  164   HD22  LEU  22          HD22      LEU  22   7.700  -3.603  -2.465
  165   HD23  LEU  22          HD23      LEU  22   7.516  -1.875  -2.163
  166    H    LEU  23           H        LEU  23   3.579   1.162  -3.322
  167    HA   LEU  23           HA       LEU  23   3.798   1.203  -0.443
  168    HB3  LEU  23           HB3      LEU  23   2.508   3.538  -1.615
  169    HG   LEU  23           HG       LEU  23   3.765   3.348   0.571
  170   HD11  LEU  23          HD11      LEU  23   5.878   2.577   0.582
  171   HD12  LEU  23          HD12      LEU  23   6.372   3.841  -0.541
  172   HD13  LEU  23          HD13      LEU  23   5.764   2.305  -1.155
  173   HD21  LEU  23          HD21      LEU  23   3.320   5.540  -0.336
  174   HD22  LEU  23          HD22      LEU  23   4.628   5.379  -1.507
  175   HD23  LEU  23          HD23      LEU  23   4.996   5.532   0.211
  176    H    MET  24           H        MET  24   1.153   1.754  -2.730
  177    HA   MET  24           HA       MET  24  -0.914   2.334  -1.050
  178    HB3  MET  24           HB3      MET  24  -2.250   0.734  -2.776
  179    HG3  MET  24           HG3      MET  24  -2.202   2.757  -4.313
  180    HE1  MET  24           HE1      MET  24  -1.892   5.319  -1.839
  181    HE2  MET  24           HE2      MET  24  -3.623   5.639  -1.810
  182    HE3  MET  24           HE3      MET  24  -2.807   5.384  -3.352
  183    H    LEU  25           H        LEU  25  -0.087  -1.094  -1.958
  184    HA   LEU  25           HA       LEU  25  -1.972  -2.258  -0.249
  185    HB3  LEU  25           HB3      LEU  25   0.057  -4.095  -0.301
  186    HG   LEU  25           HG       LEU  25  -2.248  -4.427  -1.097
  187   HD11  LEU  25          HD11      LEU  25  -3.048  -2.799  -2.453
  188   HD12  LEU  25          HD12      LEU  25  -2.222  -3.649  -3.758
  189   HD13  LEU  25          HD13      LEU  25  -1.429  -2.301  -2.944
  190   HD21  LEU  25          HD21      LEU  25  -1.353  -6.235  -2.107
  191   HD22  LEU  25          HD22      LEU  25   0.144  -5.362  -2.435
  192   HD23  LEU  25          HD23      LEU  25  -1.196  -5.276  -3.578
  193    H    LEU  26           H        LEU  26   1.226  -1.059   0.284
  194    HA   LEU  26           HA       LEU  26   1.878  -2.189   2.739
  195    HB3  LEU  26           HB3      LEU  26   2.566   0.669   2.493
  196    HG   LEU  26           HG       LEU  26   4.195  -1.887   2.651
  197   HD11  LEU  26          HD11      LEU  26   5.584  -0.155   1.773
  198   HD12  LEU  26          HD12      LEU  26   5.941  -0.221   3.499
  199   HD13  LEU  26          HD13      LEU  26   4.896   1.048   2.861
  200   HD21  LEU  26          HD21      LEU  26   4.500  -0.736   5.055
  201   HD22  LEU  26          HD22      LEU  26   3.181  -1.860   4.726
  202   HD23  LEU  26          HD23      LEU  26   2.891  -0.120   4.676
  203    H    ILE  27           H        ILE  27  -0.087   0.742   2.130
  204    HA   ILE  27           HA       ILE  27  -0.564   1.143   4.965
  205    HB   ILE  27           HB       ILE  27  -1.820   2.386   2.507
  206   HG13  ILE  27          HG13      ILE  27   0.672   2.788   3.427
  207   HG21  ILE  27          HG21      ILE  27  -3.484   2.557   4.179
  208   HG22  ILE  27          HG22      ILE  27  -2.601   4.077   4.306
  209   HG23  ILE  27          HG23      ILE  27  -2.295   2.781   5.461
  210   HD11  ILE  27          HD11      ILE  27  -0.172   3.914   1.484
  211   HD12  ILE  27          HD12      ILE  27   0.415   5.168   2.578
  212   HD13  ILE  27          HD13      ILE  27  -1.314   4.850   2.448
  213    H    LEU  28           H        LEU  28  -2.563   0.291   2.191
  214    HA   LEU  28           HA       LEU  28  -4.954  -0.279   3.453
  215    HB3  LEU  28           HB3      LEU  28  -4.771  -2.355   1.594
  216    HG   LEU  28           HG       LEU  28  -6.608  -0.741   1.836
  217   HD11  LEU  28          HD11      LEU  28  -4.420   1.133   1.324
  218   HD12  LEU  28          HD12      LEU  28  -5.990   1.422   2.071
  219   HD13  LEU  28          HD13      LEU  28  -5.831   1.451   0.316
  220   HD21  LEU  28          HD21      LEU  28  -5.309  -0.752  -0.907
  221   HD22  LEU  28          HD22      LEU  28  -6.985  -0.301  -0.596
  222   HD23  LEU  28          HD23      LEU  28  -6.441  -1.950  -0.283
  223    H    ALA  29           H        ALA  29  -2.204  -2.515   2.998
  224    HA   ALA  29           HA       ALA  29  -3.283  -4.688   4.391
  225    HB1  ALA  29           HB1      ALA  29  -1.286  -4.879   2.988
  226    HB2  ALA  29           HB2      ALA  29  -0.945  -5.439   4.625
  227    HB3  ALA  29           HB3      ALA  29  -0.389  -3.849   4.104
  228    H    LEU  30           H        LEU  30  -1.690  -1.771   5.513
  229    HA   LEU  30           HA       LEU  30  -0.961  -2.477   8.086
  230    HB3  LEU  30           HB3      LEU  30  -2.362   0.128   7.551
  231    HG   LEU  30           HG       LEU  30  -1.214  -0.796   9.782
  232   HD11  LEU  30          HD11      LEU  30   0.943  -1.057   8.322
  233   HD12  LEU  30          HD12      LEU  30   1.083  -0.387   9.948
  234   HD13  LEU  30          HD13      LEU  30   1.092   0.685   8.548
  235   HD21  LEU  30          HD21      LEU  30  -1.125   1.970   8.572
  236   HD22  LEU  30          HD22      LEU  30  -0.568   1.668  10.218
  237   HD23  LEU  30          HD23      LEU  30  -2.244   1.338   9.781
  238    H    TRP  31           H        TRP  31  -4.157  -1.329   6.992
  239    HA   TRP  31           HA       TRP  31  -5.462  -1.396   9.434
  240    HB3  TRP  31           HB3      TRP  31  -7.517  -2.048   7.891
  241    HD1  TRP  31           HD1      TRP  31  -4.741   0.601   7.943
  242    HE1  TRP  31           HE1      TRP  31  -5.793   2.898   8.456
  243    HE3  TRP  31           HE3      TRP  31  -9.688  -0.669   7.927
  244    HZ2  TRP  31           HZ2      TRP  31  -8.388   4.045   8.814
  245    HZ3  TRP  31           HZ3      TRP  31 -11.427   1.044   8.356
  246    HH2  TRP  31           HH2      TRP  31 -10.784   3.397   8.800
  247    H    LYS  32           H        LYS  32  -4.645  -4.058   7.297
  248    HA   LYS  32           HA       LYS  32  -6.192  -6.019   8.754
  249    HB3  LYS  32           HB3      LYS  32  -3.859  -6.369   6.846
  250    HG3  LYS  32           HG3      LYS  32  -5.566  -8.288   8.378
  251    HD3  LYS  32           HD3      LYS  32  -6.092  -8.692   5.970
  252    HE3  LYS  32           HE3      LYS  32  -3.078  -8.838   5.826
  253    HZ1  LYS  32           HZ1      LYS  32  -3.673  -9.686   3.475
  254    HZ2  LYS  32           HZ2      LYS  32  -5.117 -10.208   4.201
  255    HZ3  LYS  32           HZ3      LYS  32  -3.622 -10.790   4.761
  256    H    ILE  33           H        ILE  33  -3.008  -4.689   8.821
  257    HA   ILE  33           HA       ILE  33  -2.113  -6.485  10.958
  258    HB   ILE  33           HB       ILE  33  -0.619  -4.210   9.627
  259   HG13  ILE  33          HG13      ILE  33  -1.389  -6.350   8.269
  260   HG21  ILE  33          HG21      ILE  33   0.755  -4.535  11.405
  261   HG22  ILE  33          HG22      ILE  33   1.211  -6.031  10.590
  262   HG23  ILE  33          HG23      ILE  33  -0.024  -6.055  11.846
  263   HD11  ILE  33          HD11      ILE  33   0.810  -6.277   7.060
  264   HD12  ILE  33          HD12      ILE  33   1.443  -5.281   8.370
  265   HD13  ILE  33          HD13      ILE  33   0.121  -4.683   7.367
  266    H    GLY  34           H        GLY  34  -4.077  -3.940  10.960
  267    HA2  GLY  34           HA3      GLY  34  -3.121  -3.009  13.594
  268    HA3  GLY  34           HA2      GLY  34  -3.592  -1.837  12.368
  269    H    PHE  35           H        PHE  35  -5.888  -2.708  11.317
  270    HA   PHE  35           HA       PHE  35  -7.838  -2.096  13.214
  271    HB3  PHE  35           HB3      PHE  35  -8.322  -3.835  10.787
  272    HD1  PHE  35           HD1      PHE  35  -9.623  -0.756  12.501
  273    HD2  PHE  35           HD2      PHE  35 -10.467  -4.699  11.017
  274    HE1  PHE  35           HE1      PHE  35 -12.003  -0.489  13.143
  275    HE2  PHE  35           HE2      PHE  35 -12.846  -4.431  11.659
  276    HZ   PHE  35           HZ       PHE  35 -13.614  -2.326  12.722
  277    H    PHE  36           H        PHE  36  -6.374  -5.154  12.375
  278    HA   PHE  36           HA       PHE  36  -8.269  -6.721  13.903
  279    HB3  PHE  36           HB3      PHE  36  -6.365  -8.491  13.509
  280    HD1  PHE  36           HD1      PHE  36  -8.134  -6.138  11.174
  281    HD2  PHE  36           HD2      PHE  36  -7.426 -10.215  12.325
  282    HE1  PHE  36           HE1      PHE  36  -9.810  -6.892   9.520
  283    HE2  PHE  36           HE2      PHE  36  -9.105 -10.970  10.665
  284    HZ   PHE  36           HZ       PHE  36 -10.297  -9.308   9.262
  285    H    LYS  37           H        LYS  37  -6.340  -4.499  14.852
  286    HA   LYS  37           HA       LYS  37  -4.641  -4.258  16.537
  287    HB3  LYS  37           HB3      LYS  37  -6.980  -5.090  18.216
  288    HG3  LYS  37           HG3      LYS  37  -5.395  -2.528  18.286
  289    HD3  LYS  37           HD3      LYS  37  -6.846  -4.174  20.380
  290    HE3  LYS  37           HE3      LYS  37  -4.983  -2.996  21.387
  291    HZ1  LYS  37           HZ1      LYS  37  -4.557  -1.440  19.622
  292    HZ2  LYS  37           HZ2      LYS  37  -4.788  -0.587  21.074
  293    HZ3  LYS  37           HZ3      LYS  37  -6.025  -0.641  19.909
  294    H    ARG  38           H        ARG  38  -4.007  -6.709  15.599
  295    HA   ARG  38           HA       ARG  38  -4.179  -9.060  16.800
  296    HB3  ARG  38           HB3      ARG  38  -1.624  -7.594  16.173
  297    HG3  ARG  38           HG3      ARG  38  -2.077 -10.252  17.416
  298    HD3  ARG  38           HD3      ARG  38  -0.213 -11.281  16.173
  299    HE   ARG  38           HE       ARG  38  -2.774 -10.993  15.162
  300   HH11  ARG  38          HH11      ARG  38   0.435 -11.409  13.938
  301   HH12  ARG  38          HH12      ARG  38  -0.068 -12.257  12.513
  302   HH21  ARG  38          HH21      ARG  38  -3.445 -12.096  13.291
  303   HH22  ARG  38          HH22      ARG  38  -2.265 -12.646  12.148
  304    HA   PRO  39           HA       PRO  39  -3.152  -7.791  21.075
  305    HB3  PRO  39           HB3      PRO  39  -5.415  -7.290  21.366
  306    HG3  PRO  39           HG3      PRO  39  -7.018  -8.436  20.239
  307    HD3  PRO  39           HD3      PRO  39  -5.872  -8.603  18.279
  308    H    LEU  40           H        LEU  40  -1.769  -9.876  19.952
  309    HA   LEU  40           HA       LEU  40  -1.541 -11.741  22.138
  310    HB3  LEU  40           HB3      LEU  40  -1.792 -13.246  19.630
  311    HG   LEU  40           HG       LEU  40  -3.054 -14.802  20.990
  312   HD11  LEU  40          HD11      LEU  40  -1.396 -15.471  22.486
  313   HD12  LEU  40          HD12      LEU  40  -0.929 -13.818  22.877
  314   HD13  LEU  40          HD13      LEU  40  -0.507 -14.511  21.308
  315   HD21  LEU  40          HD21      LEU  40  -2.912 -13.031  23.408
  316   HD22  LEU  40          HD22      LEU  40  -4.015 -14.353  23.046
  317   HD23  LEU  40          HD23      LEU  40  -4.216 -12.801  22.242
  318    H    LYS  41           H        LYS  41   0.403 -13.000  22.018
  319    HA   LYS  41           HA       LYS  41   2.514 -11.687  20.549
  320    HB3  LYS  41           HB3      LYS  41   3.199 -12.335  22.683
  321    HG3  LYS  41           HG3      LYS  41   1.702 -14.908  22.125
  322    HD3  LYS  41           HD3      LYS  41   4.039 -14.509  23.792
  323    HE3  LYS  41           HE3      LYS  41   3.067 -15.452  25.878
  324    HZ1  LYS  41           HZ1      LYS  41   2.717 -12.831  24.852
  325    HZ2  LYS  41           HZ2      LYS  41   3.117 -13.324  26.427
  326    HZ3  LYS  41           HZ3      LYS  41   1.487 -13.198  25.963
  327    H    LYS  42           H        LYS  42   2.270 -12.115  18.359
  328    HA   LYS  42           HA       LYS  42   1.629 -14.612  17.235
  329    HB3  LYS  42           HB3      LYS  42   3.463 -12.915  15.662
  330    HG3  LYS  42           HG3      LYS  42   1.577 -13.060  14.057
  331    HD3  LYS  42           HD3      LYS  42   2.394 -15.686  15.326
  332    HE3  LYS  42           HE3      LYS  42   0.388 -15.732  13.765
  333    HZ1  LYS  42           HZ1      LYS  42   1.683 -15.614  11.359
  334    HZ2  LYS  42           HZ2      LYS  42   2.260 -14.254  12.202
  335    HZ3  LYS  42           HZ3      LYS  42   0.590 -14.470  11.970
  336    H    LYS  43           H        LYS  43   4.870 -13.075  17.095
  337    HA   LYS  43           HA       LYS  43   6.063 -15.693  17.708
  338    HB3  LYS  43           HB3      LYS  43   6.188 -15.733  15.353
  339    HG3  LYS  43           HG3      LYS  43   6.587 -12.788  15.664
  340    HD3  LYS  43           HD3      LYS  43   7.835 -14.520  13.531
  341    HE3  LYS  43           HE3      LYS  43   8.102 -11.947  12.604
  342    HZ1  LYS  43           HZ1      LYS  43   6.814 -12.694  10.828
  343    HZ2  LYS  43           HZ2      LYS  43   5.853 -13.695  11.810
  344    HZ3  LYS  43           HZ3      LYS  43   7.468 -14.116  11.484
  345    H    MET  44           H        MET  44   6.078 -12.280  17.860
  346    HA   MET  44           HA       MET  44   7.252 -10.797  19.136
  347    HB3  MET  44           HB3      MET  44   8.428 -11.550  21.063
  348    HG3  MET  44           HG3      MET  44   6.835 -13.110  22.059
  349    HE1  MET  44           HE1      MET  44   5.295  -9.900  22.958
  350    HE2  MET  44           HE2      MET  44   6.978 -10.311  22.641
  351    HE3  MET  44           HE3      MET  44   5.928 -11.478  23.439
  352    H    GLU  45           H        GLU  45   9.751 -10.598  20.019
  353    HA   GLU  45           HA       GLU  45  11.277  -9.583  18.068
  354    HB3  GLU  45           HB3      GLU  45  12.621 -11.248  20.177
  355    HG3  GLU  45           HG3      GLU  45  13.861  -9.836  18.445
  356    H    LYS  46           H        LYS  46  10.749 -12.999  18.499
  357    HA   LYS  46           HA       LYS  46  13.005 -13.677  16.768
  358    HB3  LYS  46           HB3      LYS  46  12.482 -15.969  17.299
  359    HG3  LYS  46           HG3      LYS  46  13.138 -14.002  19.176
  360    HD3  LYS  46           HD3      LYS  46  11.304 -16.008  20.503
  361    HE3  LYS  46           HE3      LYS  46  12.137 -13.339  21.592
  362    HZ1  LYS  46           HZ1      LYS  46  11.058 -15.852  22.528
  363    HZ2  LYS  46           HZ2      LYS  46  10.869 -14.286  23.158
  364    HZ3  LYS  46           HZ3      LYS  46  12.259 -15.192  23.527
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1  31.349  -8.750 -26.700
    2    H2   MET   1           H2       MET   1  30.987  -7.203 -26.096
    3    H3   MET   1           H3       MET   1  29.756  -8.169 -26.757
    4    HA   MET   1           HA       MET   1  29.456  -9.330 -24.889
    5    HB3  MET   1           HB3      MET   1  31.249 -10.279 -23.615
    6    HG3  MET   1           HG3      MET   1  31.113 -10.527 -26.406
    7    HE1  MET   1           HE1      MET   1  32.479 -11.208 -28.236
    8    HE2  MET   1           HE2      MET   1  33.923 -10.299 -28.680
    9    HE3  MET   1           HE3      MET   1  32.418  -9.444 -28.353
   10    H    GLY   2           H        GLY   2  31.136  -6.358 -25.090
   11    HA2  GLY   2           HA3      GLY   2  31.333  -5.475 -22.473
   12    HA3  GLY   2           HA2      GLY   2  31.004  -4.427 -23.847
   13    H    LEU   3           H        LEU   3  29.982  -4.465 -21.034
   14    HA   LEU   3           HA       LEU   3  27.093  -4.736 -21.559
   15    HB3  LEU   3           HB3      LEU   3  28.146  -4.307 -18.806
   16    HG   LEU   3           HG       LEU   3  25.675  -4.675 -19.696
   17   HD11  LEU   3          HD11      LEU   3  26.166  -6.774 -20.881
   18   HD12  LEU   3          HD12      LEU   3  25.044  -7.072 -19.552
   19   HD13  LEU   3          HD13      LEU   3  26.746  -7.499 -19.380
   20   HD21  LEU   3          HD21      LEU   3  25.118  -5.685 -17.506
   21   HD22  LEU   3          HD22      LEU   3  26.330  -4.417 -17.330
   22   HD23  LEU   3          HD23      LEU   3  26.814  -6.111 -17.275
   23    HA   PRO   4           HA       PRO   4  27.430  -0.221 -21.394
   24    HB3  PRO   4           HB3      PRO   4  26.083  -0.112 -23.251
   25    HG3  PRO   4           HG3      PRO   4  24.529  -1.727 -23.678
   26    HD3  PRO   4           HD3      PRO   4  26.101  -3.276 -23.078
   27    H    GLY   5           H        GLY   5  24.106  -1.014 -20.390
   28    HA2  GLY   5           HA3      GLY   5  23.215  -0.965 -18.180
   29    HA3  GLY   5           HA2      GLY   5  24.721  -0.245 -17.619
   30    H    ARG   6           H        ARG   6  22.783   0.777 -20.366
   31    HA   ARG   6           HA       ARG   6  22.897   3.488 -20.061
   32    HB3  ARG   6           HB3      ARG   6  21.719   3.013 -21.971
   33    HG3  ARG   6           HG3      ARG   6  19.743   1.305 -21.849
   34    HD3  ARG   6           HD3      ARG   6  21.808  -0.536 -21.590
   35    HE   ARG   6           HE       ARG   6  21.820   0.532 -24.188
   36   HH11  ARG   6          HH11      ARG   6  19.600  -0.687 -21.830
   37   HH12  ARG   6          HH12      ARG   6  18.503  -1.338 -23.003
   38   HH21  ARG   6          HH21      ARG   6  20.400  -0.333 -25.726
   39   HH22  ARG   6          HH22      ARG   6  18.956  -1.137 -25.208
   40    H    VAL   7           H        VAL   7  21.272   5.045 -19.247
   41    HA   VAL   7           HA       VAL   7  19.861   4.072 -16.834
   42    HB   VAL   7           HB       VAL   7  20.551   6.662 -16.201
   43   HG11  VAL   7          HG11      VAL   7  20.584   4.823 -14.635
   44   HG12  VAL   7          HG12      VAL   7  22.201   5.527 -14.662
   45   HG13  VAL   7          HG13      VAL   7  21.879   4.022 -15.525
   46   HG21  VAL   7          HG21      VAL   7  22.934   6.878 -16.630
   47   HG22  VAL   7          HG22      VAL   7  22.114   6.638 -18.172
   48   HG23  VAL   7          HG23      VAL   7  22.976   5.299 -17.413
   49    HA   PRO   8           HA       PRO   8  17.002   6.497 -19.499
   50    HB3  PRO   8           HB3      PRO   8  15.641   4.879 -20.281
   51    HG3  PRO   8           HG3      PRO   8  16.753   2.981 -19.886
   52    HD3  PRO   8           HD3      PRO   8  18.519   3.122 -18.458
   53    H    LEU   9           H        LEU   9  16.059   8.308 -18.718
   54    HA   LEU   9           HA       LEU   9  15.634   8.702 -15.921
   55    HB3  LEU   9           HB3      LEU   9  14.172  10.674 -17.156
   56    HG   LEU   9           HG       LEU   9  15.958  11.005 -15.506
   57   HD11  LEU   9          HD11      LEU   9  18.324  11.121 -16.883
   58   HD12  LEU   9          HD12      LEU   9  17.544   9.736 -17.649
   59   HD13  LEU   9          HD13      LEU   9  17.811   9.746 -15.905
   60   HD21  LEU   9          HD21      LEU   9  15.282  12.913 -16.938
   61   HD22  LEU   9          HD22      LEU   9  16.519  12.461 -18.111
   62   HD23  LEU   9          HD23      LEU   9  16.988  13.009 -16.502
   63    H    TRP  10           H        TRP  10  13.655   7.898 -18.651
   64    HA   TRP  10           HA       TRP  10  11.087   8.197 -17.582
   65    HB3  TRP  10           HB3      TRP  10  10.508   6.255 -19.176
   66    HD1  TRP  10           HD1      TRP  10   9.532   9.064 -19.074
   67    HE1  TRP  10           HE1      TRP  10   9.635  10.685 -21.073
   68    HE3  TRP  10           HE3      TRP  10  13.220   6.843 -21.821
   69    HZ2  TRP  10           HZ2      TRP  10  11.089  10.999 -23.517
   70    HZ3  TRP  10           HZ3      TRP  10  13.942   7.823 -23.980
   71    HH2  TRP  10           HH2      TRP  10  12.883   9.897 -24.829
   72    H    VAL  11           H        VAL  11  13.392   5.541 -17.283
   73    HA   VAL  11           HA       VAL  11  11.777   3.599 -16.158
   74    HB   VAL  11           HB       VAL  11  14.379   3.670 -16.737
   75   HG11  VAL  11          HG11      VAL  11  14.421   3.649 -13.717
   76   HG12  VAL  11          HG12      VAL  11  14.753   5.107 -14.649
   77   HG13  VAL  11          HG13      VAL  11  15.786   3.696 -14.830
   78   HG21  VAL  11          HG21      VAL  11  13.140   1.625 -16.473
   79   HG22  VAL  11          HG22      VAL  11  12.965   1.891 -14.739
   80   HG23  VAL  11          HG23      VAL  11  14.549   1.518 -15.418
   81    H    ILE  12           H        ILE  12  13.155   6.453 -14.588
   82    HA   ILE  12           HA       ILE  12  12.794   5.753 -11.923
   83    HB   ILE  12           HB       ILE  12  12.737   8.362 -13.380
   84   HG13  ILE  12          HG13      ILE  12  14.244   7.305 -10.966
   85   HG21  ILE  12          HG21      ILE  12  12.356   9.459 -11.092
   86   HG22  ILE  12          HG22      ILE  12  11.666   7.917 -10.593
   87   HG23  ILE  12          HG23      ILE  12  10.930   8.828 -11.915
   88   HD11  ILE  12          HD11      ILE  12  16.116   7.722 -12.859
   89   HD12  ILE  12          HD12      ILE  12  14.752   7.312 -13.898
   90   HD13  ILE  12          HD13      ILE  12  15.292   6.175 -12.661
   91    H    LEU  13           H        LEU  13  10.394   6.918 -14.263
   92    HA   LEU  13           HA       LEU  13   8.265   7.243 -12.444
   93    HB3  LEU  13           HB3      LEU  13   6.856   6.631 -14.568
   94    HG   LEU  13           HG       LEU  13   8.589   8.980 -13.983
   95   HD11  LEU  13          HD11      LEU  13   8.868   8.834 -16.393
   96   HD12  LEU  13          HD12      LEU  13   7.722  10.127 -16.038
   97   HD13  LEU  13          HD13      LEU  13   7.138   8.565 -16.614
   98   HD21  LEU  13          HD21      LEU  13   5.635   8.710 -14.620
   99   HD22  LEU  13          HD22      LEU  13   6.433  10.094 -13.874
  100   HD23  LEU  13          HD23      LEU  13   6.308   8.570 -12.997
  101    H    LEU  14           H        LEU  14   9.021   4.423 -14.560
  102    HA   LEU  14           HA       LEU  14   7.113   2.699 -13.531
  103    HB3  LEU  14           HB3      LEU  14   9.190   1.005 -14.072
  104    HG   LEU  14           HG       LEU  14   8.321   1.030 -16.437
  105   HD11  LEU  14          HD11      LEU  14   5.768   1.123 -15.128
  106   HD12  LEU  14          HD12      LEU  14   6.943   0.416 -14.020
  107   HD13  LEU  14          HD13      LEU  14   6.699  -0.293 -15.616
  108   HD21  LEU  14          HD21      LEU  14   7.822   3.661 -15.992
  109   HD22  LEU  14          HD22      LEU  14   6.223   2.988 -15.679
  110   HD23  LEU  14          HD23      LEU  14   7.003   2.719 -17.238
  111    H    SER  15           H        SER  15  10.206   3.693 -12.349
  112    HA   SER  15           HA       SER  15  10.480   1.696 -10.300
  113    HB3  SER  15           HB3      SER  15  11.570   4.452  -9.879
  114    HG   SER  15           HG       SER  15  12.065   1.879  -9.168
  115    H    ALA  16           H        ALA  16   9.605   5.148 -10.061
  116    HA   ALA  16           HA       ALA  16   8.614   5.082  -7.476
  117    HB1  ALA  16           HB1      ALA  16   9.073   7.092  -9.041
  118    HB2  ALA  16           HB2      ALA  16   7.740   7.215  -7.894
  119    HB3  ALA  16           HB3      ALA  16   7.414   6.854  -9.588
  120    H    PHE  17           H        PHE  17   7.059   4.101 -10.493
  121    HA   PHE  17           HA       PHE  17   4.406   4.039  -9.379
  122    HB3  PHE  17           HB3      PHE  17   5.499   2.701 -11.858
  123    HD1  PHE  17           HD1      PHE  17   2.496   4.773 -11.069
  124    HD2  PHE  17           HD2      PHE  17   4.008   0.895 -12.132
  125    HE1  PHE  17           HE1      PHE  17   0.178   3.971 -11.444
  126    HE2  PHE  17           HE2      PHE  17   1.692   0.095 -12.507
  127    HZ   PHE  17           HZ       PHE  17  -0.224   1.632 -12.164
  128    H    ALA  18           H        ALA  18   6.901   1.624 -10.150
  129    HA   ALA  18           HA       ALA  18   5.392  -0.641  -9.340
  130    HB1  ALA  18           HB1      ALA  18   7.511  -1.837  -9.407
  131    HB2  ALA  18           HB2      ALA  18   8.401  -0.316  -9.405
  132    HB3  ALA  18           HB3      ALA  18   7.409  -0.753 -10.795
  133    H    GLY  19           H        GLY  19   7.423   1.642  -7.657
  134    HA2  GLY  19           HA3      GLY  19   7.625   0.113  -5.224
  135    HA3  GLY  19           HA2      GLY  19   8.066   1.806  -5.434
  136    H    LEU  20           H        LEU  20   5.525   2.621  -6.506
  137    HA   LEU  20           HA       LEU  20   4.150   3.214  -4.086
  138    HB3  LEU  20           HB3      LEU  20   3.091   3.487  -6.906
  139    HG   LEU  20           HG       LEU  20   1.821   3.948  -4.526
  140   HD11  LEU  20          HD11      LEU  20   1.870   6.347  -4.093
  141   HD12  LEU  20          HD12      LEU  20   3.035   6.585  -5.397
  142   HD13  LEU  20          HD13      LEU  20   3.502   5.694  -3.949
  143   HD21  LEU  20          HD21      LEU  20   1.611   5.349  -7.201
  144   HD22  LEU  20          HD22      LEU  20   0.435   5.599  -5.911
  145   HD23  LEU  20          HD23      LEU  20   0.649   3.994  -6.608
  146    H    LEU  21           H        LEU  21   3.549   0.926  -6.726
  147    HA   LEU  21           HA       LEU  21   0.993   0.084  -5.806
  148    HB3  LEU  21           HB3      LEU  21   2.055  -2.060  -7.211
  149    HG   LEU  21           HG       LEU  21  -0.129  -0.974  -7.571
  150   HD11  LEU  21          HD11      LEU  21   1.637   1.306  -8.209
  151   HD12  LEU  21          HD12      LEU  21  -0.017   1.300  -7.598
  152   HD13  LEU  21          HD13      LEU  21   0.287   1.087  -9.323
  153   HD21  LEU  21          HD21      LEU  21   0.928  -2.391  -9.356
  154   HD22  LEU  21          HD22      LEU  21   1.558  -0.916 -10.091
  155   HD23  LEU  21          HD23      LEU  21  -0.183  -1.177  -9.993
  156    H    LEU  22           H        LEU  22   4.260  -1.237  -5.462
  157    HA   LEU  22           HA       LEU  22   3.476  -3.451  -3.854
  158    HB3  LEU  22           HB3      LEU  22   6.093  -2.981  -3.168
  159    HG   LEU  22           HG       LEU  22   6.619  -4.534  -5.085
  160   HD11  LEU  22          HD11      LEU  22   4.302  -5.933  -4.159
  161   HD12  LEU  22          HD12      LEU  22   4.927  -4.966  -2.822
  162   HD13  LEU  22          HD13      LEU  22   5.975  -6.128  -3.635
  163   HD21  LEU  22          HD21      LEU  22   3.748  -4.843  -5.714
  164   HD22  LEU  22          HD22      LEU  22   5.148  -4.906  -6.783
  165   HD23  LEU  22          HD23      LEU  22   4.476  -3.348  -6.300
  166    H    LEU  23           H        LEU  23   4.450  -0.127  -3.207
  167    HA   LEU  23           HA       LEU  23   4.650  -0.512  -0.357
  168    HB3  LEU  23           HB3      LEU  23   4.353   2.020  -1.985
  169    HG   LEU  23           HG       LEU  23   4.351   1.479   0.898
  170   HD11  LEU  23          HD11      LEU  23   5.854   3.388   1.444
  171   HD12  LEU  23          HD12      LEU  23   6.323   3.477  -0.255
  172   HD13  LEU  23          HD13      LEU  23   6.722   2.047   0.696
  173   HD21  LEU  23          HD21      LEU  23   3.436   3.754   0.942
  174   HD22  LEU  23          HD22      LEU  23   2.665   2.830  -0.347
  175   HD23  LEU  23          HD23      LEU  23   3.923   4.003  -0.734
  176    H    MET  24           H        MET  24   2.261   1.093  -2.429
  177    HA   MET  24           HA       MET  24   0.441   1.932  -0.591
  178    HB3  MET  24           HB3      MET  24  -0.434   0.462  -3.091
  179    HG3  MET  24           HG3      MET  24  -1.834   2.903  -2.345
  180    HE1  MET  24           HE1      MET  24  -4.573   2.463  -2.107
  181    HE2  MET  24           HE2      MET  24  -5.085   1.875  -3.686
  182    HE3  MET  24           HE3      MET  24  -3.820   3.097  -3.578
  183    H    LEU  25           H        LEU  25   0.388  -1.423  -1.962
  184    HA   LEU  25           HA       LEU  25  -1.636  -2.423  -0.367
  185    HB3  LEU  25           HB3      LEU  25   0.325  -4.455  -0.511
  186    HG   LEU  25           HG       LEU  25  -1.112  -5.305  -2.347
  187   HD11  LEU  25          HD11      LEU  25  -2.519  -5.961  -0.721
  188   HD12  LEU  25          HD12      LEU  25  -3.277  -4.369  -0.702
  189   HD13  LEU  25          HD13      LEU  25  -1.873  -4.688   0.315
  190   HD21  LEU  25          HD21      LEU  25  -2.379  -3.931  -3.620
  191   HD22  LEU  25          HD22      LEU  25  -1.542  -2.587  -2.843
  192   HD23  LEU  25          HD23      LEU  25  -3.082  -3.157  -2.199
  193    H    LEU  26           H        LEU  26   1.722  -1.827   0.379
  194    HA   LEU  26           HA       LEU  26   1.941  -3.196   2.815
  195    HB3  LEU  26           HB3      LEU  26   3.287  -0.555   2.613
  196    HG   LEU  26           HG       LEU  26   4.256  -3.391   3.089
  197   HD11  LEU  26          HD11      LEU  26   5.555  -0.673   3.218
  198   HD12  LEU  26          HD12      LEU  26   6.130  -2.130   2.408
  199   HD13  LEU  26          HD13      LEU  26   6.174  -2.024   4.167
  200   HD21  LEU  26          HD21      LEU  26   2.895  -2.924   4.943
  201   HD22  LEU  26          HD22      LEU  26   3.258  -1.198   4.896
  202   HD23  LEU  26          HD23      LEU  26   4.468  -2.339   5.484
  203    H    ILE  27           H        ILE  27   0.909   0.155   2.180
  204    HA   ILE  27           HA       ILE  27   0.252   0.658   4.942
  205    HB   ILE  27           HB       ILE  27  -0.766   2.226   2.574
  206   HG13  ILE  27          HG13      ILE  27   1.356   3.595   2.898
  207   HG21  ILE  27          HG21      ILE  27   0.049   3.028   5.386
  208   HG22  ILE  27          HG22      ILE  27  -1.613   2.743   4.865
  209   HG23  ILE  27          HG23      ILE  27  -0.687   4.075   4.172
  210   HD11  ILE  27          HD11      ILE  27   2.435   1.082   4.177
  211   HD12  ILE  27          HD12      ILE  27   1.822   2.421   5.146
  212   HD13  ILE  27          HD13      ILE  27   3.198   2.668   4.072
  213    H    LEU  28           H        LEU  28  -1.528   0.233   1.972
  214    HA   LEU  28           HA       LEU  28  -4.145   0.274   2.835
  215    HB3  LEU  28           HB3      LEU  28  -3.821  -2.021   1.080
  216    HG   LEU  28           HG       LEU  28  -4.886   0.781   0.633
  217   HD11  LEU  28          HD11      LEU  28  -5.687  -1.737  -0.822
  218   HD12  LEU  28          HD12      LEU  28  -4.321  -0.766  -1.373
  219   HD13  LEU  28          HD13      LEU  28  -5.936  -0.059  -1.306
  220   HD21  LEU  28          HD21      LEU  28  -6.486   0.127   2.097
  221   HD22  LEU  28          HD22      LEU  28  -5.863  -1.522   2.143
  222   HD23  LEU  28          HD23      LEU  28  -6.991  -1.040   0.876
  223    H    ALA  29           H        ALA  29  -1.898  -2.502   2.971
  224    HA   ALA  29           HA       ALA  29  -3.679  -4.288   4.224
  225    HB1  ALA  29           HB1      ALA  29  -1.758  -5.237   3.236
  226    HB2  ALA  29           HB2      ALA  29  -1.493  -5.410   4.971
  227    HB3  ALA  29           HB3      ALA  29  -0.673  -4.129   4.076
  228    H    LEU  30           H        LEU  30  -1.506  -1.821   5.534
  229    HA   LEU  30           HA       LEU  30  -1.425  -2.574   8.213
  230    HB3  LEU  30           HB3      LEU  30  -1.887   0.289   7.945
  231    HG   LEU  30           HG       LEU  30  -0.608  -0.974   9.738
  232   HD11  LEU  30          HD11      LEU  30   1.898  -0.939   8.284
  233   HD12  LEU  30          HD12      LEU  30   0.739  -2.001   7.485
  234   HD13  LEU  30          HD13      LEU  30   1.154  -2.264   9.178
  235   HD21  LEU  30          HD21      LEU  30   0.095   1.486   8.337
  236   HD22  LEU  30          HD22      LEU  30   1.497   0.766   9.131
  237   HD23  LEU  30          HD23      LEU  30   0.057   1.162  10.071
  238    H    TRP  31           H        TRP  31  -3.906  -0.668   6.544
  239    HA   TRP  31           HA       TRP  31  -5.608  -0.063   8.627
  240    HB3  TRP  31           HB3      TRP  31  -7.445  -0.585   6.749
  241    HD1  TRP  31           HD1      TRP  31  -4.260   1.626   6.688
  242    HE1  TRP  31           HE1      TRP  31  -5.006   4.094   6.691
  243    HE3  TRP  31           HE3      TRP  31  -9.330   1.014   6.638
  244    HZ2  TRP  31           HZ2      TRP  31  -7.432   5.607   6.677
  245    HZ3  TRP  31           HZ3      TRP  31 -10.834   2.985   6.632
  246    HH2  TRP  31           HH2      TRP  31  -9.893   5.279   6.652
  247    H    LYS  32           H        LYS  32  -5.095  -3.118   7.065
  248    HA   LYS  32           HA       LYS  32  -7.351  -4.467   8.255
  249    HB3  LYS  32           HB3      LYS  32  -5.245  -6.279   7.509
  250    HG3  LYS  32           HG3      LYS  32  -7.888  -5.521   6.230
  251    HD3  LYS  32           HD3      LYS  32  -7.511  -8.088   5.537
  252    HE3  LYS  32           HE3      LYS  32  -6.486  -5.595   4.161
  253    HZ1  LYS  32           HZ1      LYS  32  -5.502  -7.848   3.451
  254    HZ2  LYS  32           HZ2      LYS  32  -6.121  -6.812   2.255
  255    HZ3  LYS  32           HZ3      LYS  32  -7.034  -8.142   2.788
  256    H    ILE  33           H        ILE  33  -3.875  -4.267   8.856
  257    HA   ILE  33           HA       ILE  33  -4.131  -5.821  11.323
  258    HB   ILE  33           HB       ILE  33  -1.703  -4.581  10.005
  259   HG13  ILE  33          HG13      ILE  33  -3.192  -6.731   9.159
  260   HG21  ILE  33          HG21      ILE  33  -2.156  -6.028  12.565
  261   HG22  ILE  33          HG22      ILE  33  -0.917  -4.845  12.144
  262   HG23  ILE  33          HG23      ILE  33  -0.749  -6.522  11.624
  263   HD11  ILE  33          HD11      ILE  33  -1.528  -5.781   7.762
  264   HD12  ILE  33          HD12      ILE  33  -0.973  -7.429   8.056
  265   HD13  ILE  33          HD13      ILE  33  -0.251  -6.086   8.940
  266    H    GLY  34           H        GLY  34  -4.854  -2.785  10.585
  267    HA2  GLY  34           HA3      GLY  34  -3.757  -1.639  13.089
  268    HA3  GLY  34           HA2      GLY  34  -4.144  -0.692  11.655
  269    H    PHE  35           H        PHE  35  -6.551  -1.234  10.889
  270    HA   PHE  35           HA       PHE  35  -8.281  -0.093  12.771
  271    HB3  PHE  35           HB3      PHE  35  -9.047  -1.900  10.463
  272    HD1  PHE  35           HD1      PHE  35 -10.034   1.405  11.929
  273    HD2  PHE  35           HD2      PHE  35 -11.237  -2.591  10.911
  274    HE1  PHE  35           HE1      PHE  35 -12.364   1.939  12.591
  275    HE2  PHE  35           HE2      PHE  35 -13.566  -2.059  11.574
  276    HZ   PHE  35           HZ       PHE  35 -14.130   0.207  12.414
  277    H    PHE  36           H        PHE  36  -7.178  -3.330  12.351
  278    HA   PHE  36           HA       PHE  36  -9.311  -4.466  14.009
  279    HB3  PHE  36           HB3      PHE  36  -6.927  -6.042  13.145
  280    HD1  PHE  36           HD1      PHE  36 -10.562  -6.099  12.303
  281    HD2  PHE  36           HD2      PHE  36  -7.384  -7.855  14.595
  282    HE1  PHE  36           HE1      PHE  36 -12.079  -7.934  13.000
  283    HE2  PHE  36           HE2      PHE  36  -8.901  -9.689  15.294
  284    HZ   PHE  36           HZ       PHE  36 -11.249  -9.728  14.495
  285    H    LYS  37           H        LYS  37  -6.708  -2.690  14.699
  286    HA   LYS  37           HA       LYS  37  -5.853  -4.319  17.012
  287    HB3  LYS  37           HB3      LYS  37  -4.491  -1.780  16.189
  288    HG3  LYS  37           HG3      LYS  37  -4.054  -3.463  18.239
  289    HD3  LYS  37           HD3      LYS  37  -2.097  -4.505  16.207
  290    HE3  LYS  37           HE3      LYS  37  -3.242  -5.872  18.640
  291    HZ1  LYS  37           HZ1      LYS  37  -0.544  -6.036  17.434
  292    HZ2  LYS  37           HZ2      LYS  37  -1.835  -7.004  16.903
  293    HZ3  LYS  37           HZ3      LYS  37  -1.281  -7.126  18.504
  294    H    ARG  38           H        ARG  38  -8.164  -2.164  16.390
  295    HA   ARG  38           HA       ARG  38  -9.186  -0.431  17.506
  296    HB3  ARG  38           HB3      ARG  38  -9.993  -1.153  19.563
  297    HG3  ARG  38           HG3      ARG  38  -8.980  -3.661  18.194
  298    HD3  ARG  38           HD3      ARG  38 -10.424  -3.267  20.632
  299    HE   ARG  38           HE       ARG  38 -12.581  -3.603  19.884
  300   HH11  ARG  38          HH11      ARG  38 -10.341  -5.305  17.870
  301   HH12  ARG  38          HH12      ARG  38 -11.568  -6.076  16.922
  302   HH21  ARG  38          HH21      ARG  38 -14.195  -4.618  18.653
  303   HH22  ARG  38          HH22      ARG  38 -13.751  -5.687  17.365
  304    HA   PRO  39           HA       PRO  39  -5.151   1.544  18.780
  305    HB3  PRO  39           HB3      PRO  39  -4.703   3.042  17.115
  306    HG3  PRO  39           HG3      PRO  39  -5.421   1.465  15.632
  307    HD3  PRO  39           HD3      PRO  39  -7.310   0.190  16.026
  308    H    LEU  40           H        LEU  40  -5.472   4.394  19.036
  309    HA   LEU  40           HA       LEU  40  -5.930   5.802  20.821
  310    HB3  LEU  40           HB3      LEU  40  -8.498   6.059  21.060
  311    HG   LEU  40           HG       LEU  40  -6.775   6.544  18.665
  312   HD11  LEU  40          HD11      LEU  40  -9.765   7.019  18.811
  313   HD12  LEU  40          HD12      LEU  40  -8.890   6.086  17.598
  314   HD13  LEU  40          HD13      LEU  40  -8.706   7.839  17.664
  315   HD21  LEU  40          HD21      LEU  40  -8.419   8.566  20.157
  316   HD22  LEU  40          HD22      LEU  40  -6.835   8.753  19.407
  317   HD23  LEU  40          HD23      LEU  40  -6.989   7.887  20.935
  318    H    LYS  41           H        LYS  41  -5.003   3.614  21.937
  319    HA   LYS  41           HA       LYS  41  -6.253   1.862  23.490
  320    HB3  LYS  41           HB3      LYS  41  -4.174   3.679  24.705
  321    HG3  LYS  41           HG3      LYS  41  -4.172   0.706  24.928
  322    HD3  LYS  41           HD3      LYS  41  -3.777   2.861  27.015
  323    HE3  LYS  41           HE3      LYS  41  -2.382   0.210  26.902
  324    HZ1  LYS  41           HZ1      LYS  41  -2.499   0.518  29.297
  325    HZ2  LYS  41           HZ2      LYS  41  -3.403   1.941  29.090
  326    HZ3  LYS  41           HZ3      LYS  41  -1.792   1.867  28.552
  327    H    LYS  42           H        LYS  42  -6.390   5.343  24.047
  328    HA   LYS  42           HA       LYS  42  -8.249   4.831  26.298
  329    HB3  LYS  42           HB3      LYS  42  -6.598   7.331  26.060
  330    HG3  LYS  42           HG3      LYS  42  -7.501   5.996  28.586
  331    HD3  LYS  42           HD3      LYS  42  -6.074   8.210  28.175
  332    HE3  LYS  42           HE3      LYS  42  -8.818   9.413  28.372
  333    HZ1  LYS  42           HZ1      LYS  42  -7.432  11.123  28.611
  334    HZ2  LYS  42           HZ2      LYS  42  -7.146  10.995  26.942
  335    HZ3  LYS  42           HZ3      LYS  42  -6.091  10.252  28.048
  336    H    LYS  43           H        LYS  43 -10.040   4.874  24.908
  337    HA   LYS  43           HA       LYS  43 -11.620   5.827  23.466
  338    HB3  LYS  43           HB3      LYS  43 -12.868   7.471  24.650
  339    HG3  LYS  43           HG3      LYS  43 -11.695   6.378  27.090
  340    HD3  LYS  43           HD3      LYS  43 -14.280   5.846  25.597
  341    HE3  LYS  43           HE3      LYS  43 -14.517   5.582  28.418
  342    HZ1  LYS  43           HZ1      LYS  43 -14.583   3.717  26.122
  343    HZ2  LYS  43           HZ2      LYS  43 -15.896   4.412  26.946
  344    HZ3  LYS  43           HZ3      LYS  43 -14.948   3.223  27.703
  345    H    MET  44           H        MET  44 -12.244   8.649  23.341
  346    HA   MET  44           HA       MET  44 -10.259   9.423  21.323
  347    HB3  MET  44           HB3      MET  44 -12.008  11.159  20.743
  348    HG3  MET  44           HG3      MET  44 -11.785   8.949  19.586
  349    HE1  MET  44           HE1      MET  44 -15.304   6.653  20.622
  350    HE2  MET  44           HE2      MET  44 -14.650   7.425  19.181
  351    HE3  MET  44           HE3      MET  44 -15.377   8.411  20.448
  352    H    GLU  45           H        GLU  45 -12.220  11.826  22.857
  353    HA   GLU  45           HA       GLU  45 -10.235  12.703  24.750
  354    HB3  GLU  45           HB3      GLU  45  -9.249  13.460  22.581
  355    HG3  GLU  45           HG3      GLU  45 -11.622  15.326  22.442
  356    H    LYS  46           H        LYS  46 -13.262  12.237  24.052
  357    HA   LYS  46           HA       LYS  46 -14.233  14.220  25.911
  358    HB3  LYS  46           HB3      LYS  46 -14.908  14.386  22.982
  359    HG3  LYS  46           HG3      LYS  46 -16.607  15.080  25.369
  360    HD3  LYS  46           HD3      LYS  46 -16.238  16.616  22.844
  361    HE3  LYS  46           HE3      LYS  46 -18.910  15.873  24.033
  362    HZ1  LYS  46           HZ1      LYS  46 -18.225  18.420  23.639
  363    HZ2  LYS  46           HZ2      LYS  46 -19.805  17.828  23.444
  364    HZ3  LYS  46           HZ3      LYS  46 -18.795  18.022  22.093
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1  30.647  -3.855 -22.679
    2    H2   MET   1           H2       MET   1  30.645  -4.016 -24.371
    3    H3   MET   1           H3       MET   1  31.490  -5.132 -23.409
    4    HA   MET   1           HA       MET   1  28.610  -4.897 -23.903
    5    HB3  MET   1           HB3      MET   1  28.820  -7.358 -23.983
    6    HG3  MET   1           HG3      MET   1  30.242  -5.475 -25.691
    7    HE1  MET   1           HE1      MET   1  30.601  -7.909 -28.031
    8    HE2  MET   1           HE2      MET   1  29.997  -9.009 -26.796
    9    HE3  MET   1           HE3      MET   1  31.605  -9.254 -27.474
   10    H    GLY   2           H        GLY   2  27.424  -4.429 -22.149
   11    HA2  GLY   2           HA3      GLY   2  26.822  -5.950 -20.056
   12    HA3  GLY   2           HA2      GLY   2  28.325  -5.232 -19.488
   13    H    LEU   3           H        LEU   3  27.788  -3.751 -18.022
   14    HA   LEU   3           HA       LEU   3  25.530  -1.939 -18.581
   15    HB3  LEU   3           HB3      LEU   3  26.387  -1.545 -15.940
   16    HG   LEU   3           HG       LEU   3  24.250  -2.677 -15.377
   17   HD11  LEU   3          HD11      LEU   3  23.424  -1.230 -17.803
   18   HD12  LEU   3          HD12      LEU   3  24.584  -0.349 -16.809
   19   HD13  LEU   3          HD13      LEU   3  23.059  -0.892 -16.111
   20   HD21  LEU   3          HD21      LEU   3  23.493  -3.159 -18.170
   21   HD22  LEU   3          HD22      LEU   3  23.260  -4.180 -16.751
   22   HD23  LEU   3          HD23      LEU   3  24.798  -4.209 -17.616
   23    HA   PRO   4           HA       PRO   4  28.938   1.065 -18.947
   24    HB3  PRO   4           HB3      PRO   4  28.037   1.578 -21.033
   25    HG3  PRO   4           HG3      PRO   4  25.777   1.525 -21.404
   26    HD3  PRO   4           HD3      PRO   4  25.764  -0.513 -20.373
   27    H    GLY   5           H        GLY   5  25.993   1.276 -17.274
   28    HA2  GLY   5           HA3      GLY   5  25.663   2.253 -15.146
   29    HA3  GLY   5           HA2      GLY   5  27.067   3.282 -15.429
   30    H    ARG   6           H        ARG   6  24.593   2.832 -17.823
   31    HA   ARG   6           HA       ARG   6  24.138   5.587 -18.220
   32    HB3  ARG   6           HB3      ARG   6  21.847   4.312 -19.148
   33    HG3  ARG   6           HG3      ARG   6  23.097   4.301 -21.341
   34    HD3  ARG   6           HD3      ARG   6  23.904   6.904 -20.602
   35    HE   ARG   6           HE       ARG   6  21.160   6.501 -21.467
   36   HH11  ARG   6          HH11      ARG   6  24.511   6.552 -22.330
   37   HH12  ARG   6          HH12      ARG   6  24.221   7.008 -23.975
   38   HH21  ARG   6          HH21      ARG   6  20.775   7.131 -23.614
   39   HH22  ARG   6          HH22      ARG   6  22.106   7.336 -24.702
   40    H    VAL   7           H        VAL   7  22.085   6.744 -17.870
   41    HA   VAL   7           HA       VAL   7  20.663   5.829 -15.432
   42    HB   VAL   7           HB       VAL   7  21.578   8.615 -16.158
   43   HG11  VAL   7          HG11      VAL   7  20.517   8.873 -13.697
   44   HG12  VAL   7          HG12      VAL   7  19.468   7.599 -14.319
   45   HG13  VAL   7          HG13      VAL   7  19.575   9.144 -15.164
   46   HG21  VAL   7          HG21      VAL   7  22.189   6.752 -13.841
   47   HG22  VAL   7          HG22      VAL   7  22.742   8.423 -13.959
   48   HG23  VAL   7          HG23      VAL   7  23.305   7.223 -15.123
   49    HA   PRO   8           HA       PRO   8  17.562   6.608 -18.771
   50    HB3  PRO   8           HB3      PRO   8  16.690   4.555 -19.167
   51    HG3  PRO   8           HG3      PRO   8  18.571   3.449 -18.571
   52    HD3  PRO   8           HD3      PRO   8  19.923   4.217 -16.871
   53    H    LEU   9           H        LEU   9  16.087   8.173 -18.478
   54    HA   LEU   9           HA       LEU   9  15.196   8.995 -15.889
   55    HB3  LEU   9           HB3      LEU   9  13.561  10.374 -17.406
   56    HG   LEU   9           HG       LEU   9  16.519  10.594 -17.036
   57   HD11  LEU   9          HD11      LEU   9  14.874  12.461 -18.773
   58   HD12  LEU   9          HD12      LEU   9  16.180  11.416 -19.333
   59   HD13  LEU   9          HD13      LEU   9  16.530  12.757 -18.242
   60   HD21  LEU   9          HD21      LEU   9  14.274  12.538 -16.435
   61   HD22  LEU   9          HD22      LEU   9  15.891  12.513 -15.734
   62   HD23  LEU   9          HD23      LEU   9  14.737  11.241 -15.333
   63    H    TRP  10           H        TRP  10  13.768   7.224 -18.560
   64    HA   TRP  10           HA       TRP  10  11.108   7.076 -17.725
   65    HB3  TRP  10           HB3      TRP  10  11.424   4.677 -18.915
   66    HD1  TRP  10           HD1      TRP  10   9.081   6.220 -19.231
   67    HE1  TRP  10           HE1      TRP  10   8.388   7.590 -21.303
   68    HE3  TRP  10           HE3      TRP  10  13.630   6.776 -21.484
   69    HZ2  TRP  10           HZ2      TRP  10   9.603   8.766 -23.610
   70    HZ3  TRP  10           HZ3      TRP  10  13.833   8.023 -23.616
   71    HH2  TRP  10           HH2      TRP  10  11.827   9.019 -24.682
   72    H    VAL  11           H        VAL  11  13.863   5.003 -16.920
   73    HA   VAL  11           HA       VAL  11  12.509   3.002 -15.519
   74    HB   VAL  11           HB       VAL  11  15.287   4.124 -15.332
   75   HG11  VAL  11          HG11      VAL  11  15.660   2.096 -13.746
   76   HG12  VAL  11          HG12      VAL  11  13.930   2.217 -13.430
   77   HG13  VAL  11          HG13      VAL  11  14.991   3.576 -13.060
   78   HG21  VAL  11          HG21      VAL  11  14.134   1.394 -15.996
   79   HG22  VAL  11          HG22      VAL  11  15.840   1.827 -16.069
   80   HG23  VAL  11          HG23      VAL  11  14.690   2.585 -17.171
   81    H    ILE  12           H        ILE  12  13.584   6.182 -14.461
   82    HA   ILE  12           HA       ILE  12  13.099   5.869 -11.707
   83    HB   ILE  12           HB       ILE  12  12.751   8.421 -13.289
   84   HG13  ILE  12          HG13      ILE  12  15.198   8.762 -12.789
   85   HG21  ILE  12          HG21      ILE  12  12.499   7.813 -10.552
   86   HG22  ILE  12          HG22      ILE  12  12.596   9.415 -11.280
   87   HG23  ILE  12          HG23      ILE  12  14.062   8.612 -10.716
   88   HD11  ILE  12          HD11      ILE  12  16.559   7.012 -12.007
   89   HD12  ILE  12          HD12      ILE  12  15.348   5.783 -12.371
   90   HD13  ILE  12          HD13      ILE  12  15.122   6.864 -10.997
   91    H    LEU  13           H        LEU  13  10.973   7.080 -14.291
   92    HA   LEU  13           HA       LEU  13   8.791   7.654 -12.576
   93    HB3  LEU  13           HB3      LEU  13   8.659   6.930 -15.512
   94    HG   LEU  13           HG       LEU  13   6.655   7.523 -13.620
   95   HD11  LEU  13          HD11      LEU  13   5.765   9.661 -14.361
   96   HD12  LEU  13          HD12      LEU  13   7.078   9.841 -15.527
   97   HD13  LEU  13          HD13      LEU  13   7.419   9.899 -13.797
   98   HD21  LEU  13          HD21      LEU  13   6.431   6.236 -15.732
   99   HD22  LEU  13          HD22      LEU  13   6.601   7.733 -16.648
  100   HD23  LEU  13          HD23      LEU  13   5.200   7.492 -15.605
  101    H    LEU  14           H        LEU  14   9.266   4.865 -14.827
  102    HA   LEU  14           HA       LEU  14   7.050   3.426 -13.997
  103    HB3  LEU  14           HB3      LEU  14   9.741   2.405 -14.943
  104    HG   LEU  14           HG       LEU  14   7.236   1.076 -14.180
  105   HD11  LEU  14          HD11      LEU  14   7.421  -0.548 -16.123
  106   HD12  LEU  14          HD12      LEU  14   8.457   0.638 -16.918
  107   HD13  LEU  14          HD13      LEU  14   6.782   1.040 -16.544
  108   HD21  LEU  14          HD21      LEU  14   9.537   0.546 -13.332
  109   HD22  LEU  14          HD22      LEU  14   9.972   0.011 -14.955
  110   HD23  LEU  14          HD23      LEU  14   8.730  -0.850 -14.045
  111    H    SER  15           H        SER  15  10.278   3.668 -12.686
  112    HA   SER  15           HA       SER  15  10.152   1.541 -10.838
  113    HB3  SER  15           HB3      SER  15  11.662   4.159 -10.783
  114    HG   SER  15           HG       SER  15  11.972   1.937  -9.041
  115    H    ALA  16           H        ALA  16   9.591   5.041 -10.266
  116    HA   ALA  16           HA       ALA  16   8.559   4.792  -7.707
  117    HB1  ALA  16           HB1      ALA  16   9.185   6.946  -8.617
  118    HB2  ALA  16           HB2      ALA  16   7.479   6.994  -8.171
  119    HB3  ALA  16           HB3      ALA  16   7.944   6.821  -9.864
  120    H    PHE  17           H        PHE  17   7.023   4.211 -10.843
  121    HA   PHE  17           HA       PHE  17   4.341   4.284  -9.847
  122    HB3  PHE  17           HB3      PHE  17   5.523   2.981 -12.306
  123    HD1  PHE  17           HD1      PHE  17   2.447   4.993 -11.692
  124    HD2  PHE  17           HD2      PHE  17   4.081   1.134 -12.636
  125    HE1  PHE  17           HE1      PHE  17   0.174   4.162 -12.229
  126    HE2  PHE  17           HE2      PHE  17   1.806   0.303 -13.173
  127    HZ   PHE  17           HZ       PHE  17  -0.146   1.818 -12.970
  128    H    ALA  18           H        ALA  18   6.693   1.695 -10.539
  129    HA   ALA  18           HA       ALA  18   4.941  -0.433  -9.787
  130    HB1  ALA  18           HB1      ALA  18   7.969  -0.387  -9.812
  131    HB2  ALA  18           HB2      ALA  18   6.956  -0.760 -11.205
  132    HB3  ALA  18           HB3      ALA  18   6.948  -1.823  -9.798
  133    H    GLY  19           H        GLY  19   7.137   1.664  -8.109
  134    HA2  GLY  19           HA3      GLY  19   7.244   0.206  -5.645
  135    HA3  GLY  19           HA2      GLY  19   7.698   1.895  -5.869
  136    H    LEU  20           H        LEU  20   5.336   2.958  -6.812
  137    HA   LEU  20           HA       LEU  20   3.911   3.597  -4.520
  138    HB3  LEU  20           HB3      LEU  20   2.137   3.735  -6.765
  139    HG   LEU  20           HG       LEU  20   2.497   6.151  -6.505
  140   HD11  LEU  20          HD11      LEU  20   1.285   6.143  -4.600
  141   HD12  LEU  20          HD12      LEU  20   2.622   5.466  -3.669
  142   HD13  LEU  20          HD13      LEU  20   1.543   4.399  -4.567
  143   HD21  LEU  20          HD21      LEU  20   4.439   7.010  -5.744
  144   HD22  LEU  20          HD22      LEU  20   5.086   5.369  -5.772
  145   HD23  LEU  20          HD23      LEU  20   4.379   6.013  -4.291
  146    H    LEU  21           H        LEU  21   3.451   0.964  -6.757
  147    HA   LEU  21           HA       LEU  21   0.884   0.152  -5.729
  148    HB3  LEU  21           HB3      LEU  21   1.921  -2.050  -7.031
  149    HG   LEU  21           HG       LEU  21   0.655  -1.154  -9.011
  150   HD11  LEU  21          HD11      LEU  21  -0.303  -1.753  -6.384
  151   HD12  LEU  21          HD12      LEU  21  -1.125  -1.992  -7.926
  152   HD13  LEU  21          HD13      LEU  21  -1.311  -0.471  -7.054
  153   HD21  LEU  21          HD21      LEU  21  -0.307   1.174  -7.473
  154   HD22  LEU  21          HD22      LEU  21   0.075   1.039  -9.190
  155   HD23  LEU  21          HD23      LEU  21   1.366   1.305  -8.017
  156    H    LEU  22           H        LEU  22   4.214  -0.989  -5.431
  157    HA   LEU  22           HA       LEU  22   3.626  -3.152  -3.687
  158    HB3  LEU  22           HB3      LEU  22   6.247  -2.521  -3.169
  159    HG   LEU  22           HG       LEU  22   6.747  -4.127  -5.045
  160   HD11  LEU  22          HD11      LEU  22   6.260  -5.694  -3.511
  161   HD12  LEU  22          HD12      LEU  22   4.551  -5.589  -3.932
  162   HD13  LEU  22          HD13      LEU  22   5.215  -4.545  -2.676
  163   HD21  LEU  22          HD21      LEU  22   5.213  -4.640  -6.648
  164   HD22  LEU  22          HD22      LEU  22   4.481  -3.104  -6.188
  165   HD23  LEU  22          HD23      LEU  22   3.868  -4.611  -5.506
  166    H    LEU  23           H        LEU  23   4.413   0.233  -3.186
  167    HA   LEU  23           HA       LEU  23   4.837  -0.045  -0.336
  168    HB3  LEU  23           HB3      LEU  23   4.050   2.608  -0.849
  169    HG   LEU  23           HG       LEU  23   5.903   1.829   0.595
  170   HD11  LEU  23          HD11      LEU  23   6.709   0.544  -1.850
  171   HD12  LEU  23          HD12      LEU  23   7.386   0.354  -0.233
  172   HD13  LEU  23          HD13      LEU  23   8.000   1.613  -1.306
  173   HD21  LEU  23          HD21      LEU  23   6.854   3.660  -1.630
  174   HD22  LEU  23          HD22      LEU  23   7.488   3.598   0.015
  175   HD23  LEU  23          HD23      LEU  23   5.846   4.172  -0.277
  176    H    MET  24           H        MET  24   2.219   1.421  -2.219
  177    HA   MET  24           HA       MET  24   0.441   2.067  -0.308
  178    HB3  MET  24           HB3      MET  24  -0.531   0.533  -2.718
  179    HG3  MET  24           HG3      MET  24  -1.933   1.656  -0.702
  180    HE1  MET  24           HE1      MET  24  -2.641   5.014  -3.619
  181    HE2  MET  24           HE2      MET  24  -3.707   3.702  -3.123
  182    HE3  MET  24           HE3      MET  24  -2.259   3.344  -4.058
  183    H    LEU  25           H        LEU  25   0.739  -1.286  -1.590
  184    HA   LEU  25           HA       LEU  25  -1.247  -2.492  -0.105
  185    HB3  LEU  25           HB3      LEU  25   1.035  -4.199   0.009
  186    HG   LEU  25           HG       LEU  25  -1.289  -3.988  -1.929
  187   HD11  LEU  25          HD11      LEU  25  -0.819  -6.348  -2.427
  188   HD12  LEU  25          HD12      LEU  25   0.567  -6.314  -1.338
  189   HD13  LEU  25          HD13      LEU  25   0.583  -5.350  -2.815
  190   HD21  LEU  25          HD21      LEU  25  -2.487  -4.639  -0.127
  191   HD22  LEU  25          HD22      LEU  25  -1.032  -4.857   0.841
  192   HD23  LEU  25          HD23      LEU  25  -1.608  -6.165  -0.192
  193    H    LEU  26           H        LEU  26   1.910  -1.402   0.915
  194    HA   LEU  26           HA       LEU  26   2.051  -2.619   3.456
  195    HB3  LEU  26           HB3      LEU  26   3.115   0.145   2.888
  196    HG   LEU  26           HG       LEU  26   3.261  -1.331   5.127
  197   HD11  LEU  26          HD11      LEU  26   5.740  -2.138   3.587
  198   HD12  LEU  26          HD12      LEU  26   4.344  -3.198   3.787
  199   HD13  LEU  26          HD13      LEU  26   5.258  -2.667   5.199
  200   HD21  LEU  26          HD21      LEU  26   4.184   0.909   4.901
  201   HD22  LEU  26          HD22      LEU  26   5.485   0.309   3.873
  202   HD23  LEU  26          HD23      LEU  26   5.430  -0.142   5.576
  203    H    ILE  27           H        ILE  27   0.746   0.531   2.492
  204    HA   ILE  27           HA       ILE  27  -0.210   1.207   5.129
  205    HB   ILE  27           HB       ILE  27  -0.665   2.432   2.400
  206   HG13  ILE  27          HG13      ILE  27   1.553   2.507   3.969
  207   HG21  ILE  27          HG21      ILE  27  -2.621   3.014   3.594
  208   HG22  ILE  27          HG22      ILE  27  -1.536   4.376   3.879
  209   HG23  ILE  27          HG23      ILE  27  -1.753   3.144   5.123
  210   HD11  ILE  27          HD11      ILE  27   1.662   3.455   1.821
  211   HD12  ILE  27          HD12      ILE  27   1.889   4.850   2.876
  212   HD13  ILE  27          HD13      ILE  27   0.316   4.550   2.134
  213    H    LEU  28           H        LEU  28  -1.460  -0.145   2.231
  214    HA   LEU  28           HA       LEU  28  -4.250  -0.054   2.925
  215    HB3  LEU  28           HB3      LEU  28  -3.682  -2.311   1.205
  216    HG   LEU  28           HG       LEU  28  -5.025  -1.027  -0.381
  217   HD11  LEU  28          HD11      LEU  28  -5.836  -1.882   2.120
  218   HD12  LEU  28          HD12      LEU  28  -6.913  -1.408   0.807
  219   HD13  LEU  28          HD13      LEU  28  -6.466  -0.236   2.047
  220   HD21  LEU  28          HD21      LEU  28  -5.058   1.231  -0.405
  221   HD22  LEU  28          HD22      LEU  28  -3.822   1.189   0.851
  222   HD23  LEU  28          HD23      LEU  28  -5.526   1.298   1.294
  223    H    ALA  29           H        ALA  29  -1.768  -2.570   3.134
  224    HA   ALA  29           HA       ALA  29  -3.344  -4.549   4.341
  225    HB1  ALA  29           HB1      ALA  29  -1.187  -5.081   3.362
  226    HB2  ALA  29           HB2      ALA  29  -1.179  -5.530   5.066
  227    HB3  ALA  29           HB3      ALA  29  -0.367  -4.056   4.539
  228    H    LEU  30           H        LEU  30  -1.395  -1.933   5.775
  229    HA   LEU  30           HA       LEU  30  -1.437  -2.680   8.434
  230    HB3  LEU  30           HB3      LEU  30  -1.957   0.177   7.692
  231    HG   LEU  30           HG       LEU  30  -1.417  -0.922  10.051
  232   HD11  LEU  30          HD11      LEU  30   0.732  -1.890   8.854
  233   HD12  LEU  30          HD12      LEU  30   0.829  -1.304  10.515
  234   HD13  LEU  30          HD13      LEU  30   1.384  -0.287   9.187
  235   HD21  LEU  30          HD21      LEU  30  -1.670   1.398  10.036
  236   HD22  LEU  30          HD22      LEU  30  -0.427   1.627   8.805
  237   HD23  LEU  30          HD23      LEU  30   0.034   1.244  10.465
  238    H    TRP  31           H        TRP  31  -3.943  -0.868   6.673
  239    HA   TRP  31           HA       TRP  31  -5.681  -0.336   8.755
  240    HB3  TRP  31           HB3      TRP  31  -6.920  -1.216   6.205
  241    HD1  TRP  31           HD1      TRP  31  -9.285  -0.703   7.037
  242    HE1  TRP  31           HE1      TRP  31 -10.440   1.331   8.122
  243    HE3  TRP  31           HE3      TRP  31  -5.231   2.306   7.815
  244    HZ2  TRP  31           HZ2      TRP  31  -9.739   3.894   9.179
  245    HZ3  TRP  31           HZ3      TRP  31  -5.502   4.535   8.862
  246    HH2  TRP  31           HH2      TRP  31  -7.748   5.333   9.545
  247    H    LYS  32           H        LYS  32  -5.148  -3.346   7.080
  248    HA   LYS  32           HA       LYS  32  -7.455  -4.686   8.177
  249    HB3  LYS  32           HB3      LYS  32  -6.555  -6.676   7.168
  250    HG3  LYS  32           HG3      LYS  32  -5.544  -4.839   5.112
  251    HD3  LYS  32           HD3      LYS  32  -8.084  -6.480   5.213
  252    HE3  LYS  32           HE3      LYS  32  -6.285  -5.508   2.974
  253    HZ1  LYS  32           HZ1      LYS  32  -8.800  -6.750   2.332
  254    HZ2  LYS  32           HZ2      LYS  32  -7.680  -7.817   3.034
  255    HZ3  LYS  32           HZ3      LYS  32  -7.273  -6.961   1.623
  256    H    ILE  33           H        ILE  33  -3.987  -4.595   8.867
  257    HA   ILE  33           HA       ILE  33  -4.345  -6.259  11.247
  258    HB   ILE  33           HB       ILE  33  -1.856  -5.065  10.007
  259   HG13  ILE  33          HG13      ILE  33  -3.394  -7.099   9.039
  260   HG21  ILE  33          HG21      ILE  33  -1.127  -5.415  12.162
  261   HG22  ILE  33          HG22      ILE  33  -0.965  -7.067  11.567
  262   HG23  ILE  33          HG23      ILE  33  -2.383  -6.603  12.508
  263   HD11  ILE  33          HD11      ILE  33  -1.514  -6.158   7.850
  264   HD12  ILE  33          HD12      ILE  33  -1.262  -7.900   7.953
  265   HD13  ILE  33          HD13      ILE  33  -0.378  -6.815   9.026
  266    H    GLY  34           H        GLY  34  -4.961  -3.166  10.679
  267    HA2  GLY  34           HA3      GLY  34  -3.945  -2.259  13.313
  268    HA3  GLY  34           HA2      GLY  34  -4.073  -1.191  11.920
  269    H    PHE  35           H        PHE  35  -6.324  -1.061  10.950
  270    HA   PHE  35           HA       PHE  35  -8.144   0.092  12.617
  271    HB3  PHE  35           HB3      PHE  35  -9.112  -1.670  10.385
  272    HD1  PHE  35           HD1      PHE  35  -8.949   1.943  11.407
  273    HD2  PHE  35           HD2      PHE  35 -11.426  -1.445  10.490
  274    HE1  PHE  35           HE1      PHE  35 -10.973   3.348  11.686
  275    HE2  PHE  35           HE2      PHE  35 -13.450  -0.039  10.768
  276    HZ   PHE  35           HZ       PHE  35 -13.224   2.357  11.368
  277    H    PHE  36           H        PHE  36  -7.589  -3.312  12.111
  278    HA   PHE  36           HA       PHE  36  -9.933  -4.143  13.619
  279    HB3  PHE  36           HB3      PHE  36  -7.590  -5.717  12.517
  280    HD1  PHE  36           HD1      PHE  36 -11.272  -6.266  12.863
  281    HD2  PHE  36           HD2      PHE  36  -7.324  -7.497  14.021
  282    HE1  PHE  36           HE1      PHE  36 -12.228  -8.250  14.002
  283    HE2  PHE  36           HE2      PHE  36  -8.279  -9.485  15.161
  284    HZ   PHE  36           HZ       PHE  36 -10.731  -9.861  15.151
  285    H    LYS  37           H        LYS  37  -6.473  -3.795  14.003
  286    HA   LYS  37           HA       LYS  37  -6.306  -5.090  16.556
  287    HB3  LYS  37           HB3      LYS  37  -4.327  -3.045  15.599
  288    HG3  LYS  37           HG3      LYS  37  -4.082  -5.727  16.992
  289    HD3  LYS  37           HD3      LYS  37  -1.803  -4.085  17.349
  290    HE3  LYS  37           HE3      LYS  37  -2.250  -6.520  15.599
  291    HZ1  LYS  37           HZ1      LYS  37  -0.029  -6.659  15.393
  292    HZ2  LYS  37           HZ2      LYS  37   0.276  -6.028  16.941
  293    HZ3  LYS  37           HZ3      LYS  37  -0.078  -4.983  15.649
  294    H    ARG  38           H        ARG  38  -8.420  -3.294  16.622
  295    HA   ARG  38           HA       ARG  38  -9.138  -1.222  17.526
  296    HB3  ARG  38           HB3      ARG  38  -7.975  -2.686  19.895
  297    HG3  ARG  38           HG3      ARG  38  -9.656  -0.397  19.616
  298    HD3  ARG  38           HD3      ARG  38 -11.557  -1.868  19.292
  299    HE   ARG  38           HE       ARG  38 -10.234  -3.733  20.820
  300   HH11  ARG  38          HH11      ARG  38 -13.336  -2.200  20.865
  301   HH12  ARG  38          HH12      ARG  38 -14.150  -3.558  21.565
  302   HH21  ARG  38          HH21      ARG  38 -11.294  -5.518  21.736
  303   HH22  ARG  38          HH22      ARG  38 -12.995  -5.438  22.059
  304    HA   PRO  39           HA       PRO  39  -5.061   1.012  17.800
  305    HB3  PRO  39           HB3      PRO  39  -5.210   2.631  16.183
  306    HG3  PRO  39           HG3      PRO  39  -6.132   0.956  14.918
  307    HD3  PRO  39           HD3      PRO  39  -7.819  -0.420  15.722
  308    H    LEU  40           H        LEU  40  -6.028   0.565  20.147
  309    HA   LEU  40           HA       LEU  40  -6.712   1.385  22.217
  310    HB3  LEU  40           HB3      LEU  40  -5.401   3.308  22.932
  311    HG   LEU  40           HG       LEU  40  -3.877   1.582  20.957
  312   HD11  LEU  40          HD11      LEU  40  -2.768   3.717  21.864
  313   HD12  LEU  40          HD12      LEU  40  -1.902   2.203  22.129
  314   HD13  LEU  40          HD13      LEU  40  -2.820   2.935  23.445
  315   HD21  LEU  40          HD21      LEU  40  -3.321   0.468  23.298
  316   HD22  LEU  40          HD22      LEU  40  -4.797   0.035  22.434
  317   HD23  LEU  40          HD23      LEU  40  -4.861   1.190  23.765
  318    H    LYS  41           H        LYS  41  -6.484   4.651  21.882
  319    HA   LYS  41           HA       LYS  41  -9.381   4.951  21.346
  320    HB3  LYS  41           HB3      LYS  41  -7.644   6.605  23.192
  321    HG3  LYS  41           HG3      LYS  41 -10.529   6.746  22.325
  322    HD3  LYS  41           HD3      LYS  41 -10.511   6.607  24.789
  323    HE3  LYS  41           HE3      LYS  41  -9.350   8.773  25.826
  324    HZ1  LYS  41           HZ1      LYS  41  -8.708   6.066  25.557
  325    HZ2  LYS  41           HZ2      LYS  41  -8.255   7.134  26.798
  326    HZ3  LYS  41           HZ3      LYS  41  -7.265   6.947  25.430
  327    H    LYS  42           H        LYS  42  -9.496   5.664  19.330
  328    HA   LYS  42           HA       LYS  42  -8.860   6.773  17.353
  329    HB3  LYS  42           HB3      LYS  42  -9.005   9.279  18.960
  330    HG3  LYS  42           HG3      LYS  42 -10.799   8.489  16.692
  331    HD3  LYS  42           HD3      LYS  42  -9.320  11.078  17.124
  332    HE3  LYS  42           HE3      LYS  42 -12.046  10.436  15.964
  333    HZ1  LYS  42           HZ1      LYS  42 -10.571  12.846  16.545
  334    HZ2  LYS  42           HZ2      LYS  42 -12.236  12.624  16.283
  335    HZ3  LYS  42           HZ3      LYS  42 -11.178  12.777  14.962
  336    H    LYS  43           H        LYS  43  -7.714   9.485  17.365
  337    HA   LYS  43           HA       LYS  43  -5.156   9.537  18.545
  338    HB3  LYS  43           HB3      LYS  43  -4.391   9.184  15.822
  339    HG3  LYS  43           HG3      LYS  43  -3.909   7.498  18.297
  340    HD3  LYS  43           HD3      LYS  43  -2.744   7.554  15.547
  341    HE3  LYS  43           HE3      LYS  43  -1.171   7.161  18.103
  342    HZ1  LYS  43           HZ1      LYS  43   0.555   6.646  16.175
  343    HZ2  LYS  43           HZ2      LYS  43  -0.848   6.030  15.439
  344    HZ3  LYS  43           HZ3      LYS  43  -0.340   5.430  16.946
  345    H    MET  44           H        MET  44  -3.777  11.260  17.651
  346    HA   MET  44           HA       MET  44  -5.027  13.665  17.317
  347    HB3  MET  44           HB3      MET  44  -2.872  14.322  16.021
  348    HG3  MET  44           HG3      MET  44  -3.101  13.271  18.823
  349    HE1  MET  44           HE1      MET  44  -0.590  15.138  16.364
  350    HE2  MET  44           HE2      MET  44   0.708  15.436  17.516
  351    HE3  MET  44           HE3      MET  44  -0.896  16.103  17.815
  352    H    GLU  45           H        GLU  45  -3.152  12.902  14.496
  353    HA   GLU  45           HA       GLU  45  -3.620  13.102  12.253
  354    HB3  GLU  45           HB3      GLU  45  -5.664  11.961  11.475
  355    HG3  GLU  45           HG3      GLU  45  -5.194   9.853  13.157
  356    H    LYS  46           H        LYS  46  -6.902  13.332  12.081
  357    HA   LYS  46           HA       LYS  46  -6.898  16.018  11.203
  358    HB3  LYS  46           HB3      LYS  46  -9.496  15.651  11.631
  359    HG3  LYS  46           HG3      LYS  46  -9.360  14.106   9.491
  360    HD3  LYS  46           HD3      LYS  46  -8.390  16.275   8.283
  361    HE3  LYS  46           HE3      LYS  46 -10.968  16.156   9.873
  362    HZ1  LYS  46           HZ1      LYS  46 -11.711  17.759   8.158
  363    HZ2  LYS  46           HZ2      LYS  46 -10.098  17.913   7.646
  364    HZ3  LYS  46           HZ3      LYS  46 -10.543  18.390   9.214
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1  21.142 -12.390  -9.744
    2    H2   MET   1           H2       MET   1  22.692 -12.682  -9.110
    3    H3   MET   1           H3       MET   1  22.389 -12.915 -10.766
    4    HA   MET   1           HA       MET   1  21.773 -10.261  -9.814
    5    HB3  MET   1           HB3      MET   1  24.164  -9.586  -9.741
    6    HG3  MET   1           HG3      MET   1  24.271 -11.645  -7.684
    7    HE1  MET   1           HE1      MET   1  26.558  -9.312  -6.148
    8    HE2  MET   1           HE2      MET   1  26.349 -10.689  -7.227
    9    HE3  MET   1           HE3      MET   1  25.593 -10.703  -5.635
   10    H    GLY   2           H        GLY   2  22.724  -8.714 -11.468
   11    HA2  GLY   2           HA3      GLY   2  23.906  -9.218 -13.833
   12    HA3  GLY   2           HA2      GLY   2  22.280  -9.829 -14.114
   13    H    LEU   3           H        LEU   3  23.863  -6.925 -12.735
   14    HA   LEU   3           HA       LEU   3  21.644  -5.247 -13.446
   15    HB3  LEU   3           HB3      LEU   3  23.260  -3.383 -12.806
   16    HG   LEU   3           HG       LEU   3  23.273  -3.983 -10.392
   17   HD11  LEU   3          HD11      LEU   3  21.120  -3.435 -11.906
   18   HD12  LEU   3          HD12      LEU   3  21.001  -3.752 -10.177
   19   HD13  LEU   3          HD13      LEU   3  20.651  -5.035 -11.333
   20   HD21  LEU   3          HD21      LEU   3  22.041  -6.631 -11.134
   21   HD22  LEU   3          HD22      LEU   3  22.770  -6.135  -9.607
   22   HD23  LEU   3          HD23      LEU   3  23.794  -6.470 -11.001
   23    HA   PRO   4           HA       PRO   4  22.985  -4.414 -17.608
   24    HB3  PRO   4           HB3      PRO   4  20.868  -3.548 -17.959
   25    HG3  PRO   4           HG3      PRO   4  19.792  -2.315 -16.340
   26    HD3  PRO   4           HD3      PRO   4  20.399  -4.097 -15.008
   27    H    GLY   5           H        GLY   5  23.887  -2.501 -14.968
   28    HA2  GLY   5           HA3      GLY   5  25.870  -1.341 -14.606
   29    HA3  GLY   5           HA2      GLY   5  26.257  -1.520 -16.315
   30    H    ARG   6           H        ARG   6  23.351  -0.474 -16.737
   31    HA   ARG   6           HA       ARG   6  23.858   2.382 -16.202
   32    HB3  ARG   6           HB3      ARG   6  22.552   2.242 -18.692
   33    HG3  ARG   6           HG3      ARG   6  24.825   3.108 -19.496
   34    HD3  ARG   6           HD3      ARG   6  24.590   5.038 -17.592
   35    HE   ARG   6           HE       ARG   6  23.582   4.667 -20.173
   36   HH11  ARG   6          HH11      ARG   6  22.783   6.350 -17.257
   37   HH12  ARG   6          HH12      ARG   6  21.964   7.644 -18.067
   38   HH21  ARG   6          HH21      ARG   6  22.515   6.358 -21.241
   39   HH22  ARG   6          HH22      ARG   6  21.811   7.648 -20.323
   40    H    VAL   7           H        VAL   7  22.129   3.444 -15.456
   41    HA   VAL   7           HA       VAL   7  19.564   2.011 -15.386
   42    HB   VAL   7           HB       VAL   7  19.165   4.004 -13.660
   43   HG11  VAL   7          HG11      VAL   7  20.740   1.453 -13.218
   44   HG12  VAL   7          HG12      VAL   7  19.001   1.679 -13.038
   45   HG13  VAL   7          HG13      VAL   7  20.111   2.443 -11.901
   46   HG21  VAL   7          HG21      VAL   7  21.462   4.929 -14.267
   47   HG22  VAL   7          HG22      VAL   7  22.149   3.513 -13.470
   48   HG23  VAL   7          HG23      VAL   7  21.185   4.665 -12.544
   49    HA   PRO   8           HA       PRO   8  18.587   5.327 -18.389
   50    HB3  PRO   8           HB3      PRO   8  17.809   3.888 -19.969
   51    HG3  PRO   8           HG3      PRO   8  17.395   1.754 -19.383
   52    HD3  PRO   8           HD3      PRO   8  18.988   1.702 -17.753
   53    H    LEU   9           H        LEU   9  17.410   7.148 -18.091
   54    HA   LEU   9           HA       LEU   9  16.163   7.794 -15.739
   55    HB3  LEU   9           HB3      LEU   9  14.787   9.385 -17.431
   56    HG   LEU   9           HG       LEU   9  17.638   9.462 -16.458
   57   HD11  LEU   9          HD11      LEU   9  17.888  10.784 -18.383
   58   HD12  LEU   9          HD12      LEU   9  17.444  11.969 -17.154
   59   HD13  LEU   9          HD13      LEU   9  16.233  11.389 -18.297
   60   HD21  LEU   9          HD21      LEU   9  16.767  10.695 -14.735
   61   HD22  LEU   9          HD22      LEU   9  15.269   9.889 -15.194
   62   HD23  LEU   9          HD23      LEU   9  15.607  11.518 -15.775
   63    H    TRP  10           H        TRP  10  14.767   6.208 -18.541
   64    HA   TRP  10           HA       TRP  10  12.044   6.457 -17.957
   65    HB3  TRP  10           HB3      TRP  10  11.994   4.068 -19.050
   66    HD1  TRP  10           HD1      TRP  10  14.266   6.564 -20.882
   67    HE1  TRP  10           HE1      TRP  10  12.892   7.704 -22.742
   68    HE3  TRP  10           HE3      TRP  10   9.641   4.661 -19.852
   69    HZ2  TRP  10           HZ2      TRP  10  10.188   7.797 -23.669
   70    HZ3  TRP  10           HZ3      TRP  10   7.685   5.292 -21.238
   71    HH2  TRP  10           HH2      TRP  10   7.952   6.856 -23.143
   72    H    VAL  11           H        VAL  11  14.443   4.134 -16.827
   73    HA   VAL  11           HA       VAL  11  12.811   2.361 -15.459
   74    HB   VAL  11           HB       VAL  11  15.439   2.455 -15.850
   75   HG11  VAL  11          HG11      VAL  11  15.247   3.152 -12.911
   76   HG12  VAL  11          HG12      VAL  11  15.625   4.354 -14.145
   77   HG13  VAL  11          HG13      VAL  11  16.697   2.980 -13.897
   78   HG21  VAL  11          HG21      VAL  11  13.889   1.080 -13.654
   79   HG22  VAL  11          HG22      VAL  11  15.588   0.718 -13.958
   80   HG23  VAL  11          HG23      VAL  11  14.385   0.428 -15.215
   81    H    ILE  12           H        ILE  12  14.008   5.507 -14.405
   82    HA   ILE  12           HA       ILE  12  13.267   5.314 -11.696
   83    HB   ILE  12           HB       ILE  12  13.541   7.690 -13.536
   84   HG13  ILE  12          HG13      ILE  12  15.694   7.874 -12.697
   85   HG21  ILE  12          HG21      ILE  12  12.789   7.545 -10.621
   86   HG22  ILE  12          HG22      ILE  12  12.034   8.485 -11.907
   87   HG23  ILE  12          HG23      ILE  12  13.615   8.957 -11.285
   88   HD11  ILE  12          HD11      ILE  12  15.320   8.136 -10.377
   89   HD12  ILE  12          HD12      ILE  12  16.322   6.689 -10.482
   90   HD13  ILE  12          HD13      ILE  12  14.585   6.539 -10.226
   91    H    LEU  13           H        LEU  13  11.434   6.367 -14.532
   92    HA   LEU  13           HA       LEU  13   9.175   7.327 -13.150
   93    HB3  LEU  13           HB3      LEU  13   8.478   6.090 -15.682
   94    HG   LEU  13           HG       LEU  13   7.381   8.044 -14.529
   95   HD11  LEU  13          HD11      LEU  13   9.152  10.052 -15.614
   96   HD12  LEU  13          HD12      LEU  13  10.040   9.009 -14.506
   97   HD13  LEU  13          HD13      LEU  13   8.593   9.852 -13.954
   98   HD21  LEU  13          HD21      LEU  13   7.324   9.456 -16.702
   99   HD22  LEU  13          HD22      LEU  13   6.807   7.774 -16.811
  100   HD23  LEU  13          HD23      LEU  13   8.418   8.239 -17.359
  101    H    LEU  14           H        LEU  14   9.669   4.122 -14.727
  102    HA   LEU  14           HA       LEU  14   7.283   3.007 -13.823
  103    HB3  LEU  14           HB3      LEU  14   8.363   0.839 -14.267
  104    HG   LEU  14           HG       LEU  14   8.248   3.095 -16.097
  105   HD11  LEU  14          HD11      LEU  14  10.628   2.573 -16.451
  106   HD12  LEU  14          HD12      LEU  14   9.677   2.096 -17.856
  107   HD13  LEU  14          HD13      LEU  14  10.226   0.876 -16.709
  108   HD21  LEU  14          HD21      LEU  14   7.896   0.112 -16.539
  109   HD22  LEU  14          HD22      LEU  14   7.247   1.408 -17.544
  110   HD23  LEU  14          HD23      LEU  14   6.641   1.175 -15.904
  111    H    SER  15           H        SER  15  10.423   3.338 -12.362
  112    HA   SER  15           HA       SER  15  10.124   1.559 -10.205
  113    HB3  SER  15           HB3      SER  15  11.645   4.181 -10.251
  114    HG   SER  15           HG       SER  15  12.815   3.138  -8.569
  115    H    ALA  16           H        ALA  16   9.588   5.118 -10.223
  116    HA   ALA  16           HA       ALA  16   8.457   5.273  -7.695
  117    HB1  ALA  16           HB1      ALA  16   7.972   6.944 -10.170
  118    HB2  ALA  16           HB2      ALA  16   9.113   7.272  -8.864
  119    HB3  ALA  16           HB3      ALA  16   7.377   7.368  -8.565
  120    H    PHE  17           H        PHE  17   7.052   4.229 -10.748
  121    HA   PHE  17           HA       PHE  17   4.329   4.444  -9.844
  122    HB3  PHE  17           HB3      PHE  17   4.107   2.650 -11.813
  123    HD1  PHE  17           HD1      PHE  17   5.507   6.081 -11.328
  124    HD2  PHE  17           HD2      PHE  17   2.644   3.630 -13.390
  125    HE1  PHE  17           HE1      PHE  17   4.464   8.112 -12.295
  126    HE2  PHE  17           HE2      PHE  17   1.602   5.661 -14.356
  127    HZ   PHE  17           HZ       PHE  17   2.512   7.902 -13.809
  128    H    ALA  18           H        ALA  18   6.691   1.792 -10.065
  129    HA   ALA  18           HA       ALA  18   4.960  -0.227  -9.067
  130    HB1  ALA  18           HB1      ALA  18   7.264  -0.519 -10.174
  131    HB2  ALA  18           HB2      ALA  18   6.908  -1.554  -8.791
  132    HB3  ALA  18           HB3      ALA  18   7.941  -0.139  -8.590
  133    H    GLY  19           H        GLY  19   6.725   2.352  -7.661
  134    HA2  GLY  19           HA3      GLY  19   6.672   1.420  -4.932
  135    HA3  GLY  19           HA2      GLY  19   7.087   3.045  -5.470
  136    H    LEU  20           H        LEU  20   4.629   3.401  -6.991
  137    HA   LEU  20           HA       LEU  20   2.993   4.506  -4.944
  138    HB3  LEU  20           HB3      LEU  20   2.206   3.954  -7.811
  139    HG   LEU  20           HG       LEU  20   0.815   5.051  -5.629
  140   HD11  LEU  20          HD11      LEU  20   0.515   7.395  -6.260
  141   HD12  LEU  20          HD12      LEU  20   1.669   7.207  -7.582
  142   HD13  LEU  20          HD13      LEU  20   2.216   7.086  -5.908
  143   HD21  LEU  20          HD21      LEU  20  -0.250   4.026  -7.552
  144   HD22  LEU  20          HD22      LEU  20   0.409   5.258  -8.628
  145   HD23  LEU  20          HD23      LEU  20  -0.821   5.691  -7.439
  146    H    LEU  21           H        LEU  21   2.831   1.539  -6.835
  147    HA   LEU  21           HA       LEU  21   0.221   0.790  -5.867
  148    HB3  LEU  21           HB3      LEU  21   1.381  -1.541  -6.770
  149    HG   LEU  21           HG       LEU  21   0.261  -0.957  -8.950
  150   HD11  LEU  21          HD11      LEU  21  -1.854  -0.058  -7.245
  151   HD12  LEU  21          HD12      LEU  21  -0.883  -1.223  -6.345
  152   HD13  LEU  21          HD13      LEU  21  -1.589  -1.675  -7.895
  153   HD21  LEU  21          HD21      LEU  21  -0.849   1.535  -7.821
  154   HD22  LEU  21          HD22      LEU  21  -0.337   1.176  -9.471
  155   HD23  LEU  21          HD23      LEU  21   0.858   1.632  -8.256
  156    H    LEU  22           H        LEU  22   3.558  -0.186  -5.202
  157    HA   LEU  22           HA       LEU  22   2.965  -2.097  -3.207
  158    HB3  LEU  22           HB3      LEU  22   5.472  -0.583  -2.870
  159    HG   LEU  22           HG       LEU  22   4.791  -2.878  -1.930
  160   HD11  LEU  22          HD11      LEU  22   4.437  -4.619  -3.331
  161   HD12  LEU  22          HD12      LEU  22   5.838  -4.209  -4.319
  162   HD13  LEU  22          HD13      LEU  22   4.290  -3.415  -4.609
  163   HD21  LEU  22          HD21      LEU  22   7.103  -2.009  -1.886
  164   HD22  LEU  22          HD22      LEU  22   7.364  -2.623  -3.519
  165   HD23  LEU  22          HD23      LEU  22   7.089  -3.747  -2.187
  166    H    LEU  23           H        LEU  23   3.333   1.366  -3.190
  167    HA   LEU  23           HA       LEU  23   3.517   1.679  -0.347
  168    HB3  LEU  23           HB3      LEU  23   2.451   4.026  -1.020
  169    HG   LEU  23           HG       LEU  23   5.206   2.934  -1.586
  170   HD11  LEU  23          HD11      LEU  23   4.037   5.523  -2.417
  171   HD12  LEU  23          HD12      LEU  23   5.455   4.676  -3.036
  172   HD13  LEU  23          HD13      LEU  23   5.574   5.636  -1.561
  173   HD21  LEU  23          HD21      LEU  23   4.811   5.151   0.308
  174   HD22  LEU  23          HD22      LEU  23   5.669   3.627   0.526
  175   HD23  LEU  23          HD23      LEU  23   3.922   3.692   0.745
  176    H    MET  24           H        MET  24   0.800   2.203  -2.566
  177    HA   MET  24           HA       MET  24  -1.217   2.676  -0.789
  178    HB3  MET  24           HB3      MET  24  -2.224   0.822  -2.764
  179    HG3  MET  24           HG3      MET  24  -3.375   2.800  -1.687
  180    HE1  MET  24           HE1      MET  24  -4.267   5.215  -3.227
  181    HE2  MET  24           HE2      MET  24  -3.358   4.832  -4.686
  182    HE3  MET  24           HE3      MET  24  -3.062   6.352  -3.844
  183    H    LEU  25           H        LEU  25  -0.323  -0.653  -1.891
  184    HA   LEU  25           HA       LEU  25  -2.102  -1.980  -0.174
  185    HB3  LEU  25           HB3      LEU  25   0.166  -3.624  -0.442
  186    HG   LEU  25           HG       LEU  25  -2.375  -3.321  -2.067
  187   HD11  LEU  25          HD11      LEU  25  -0.029  -5.036  -2.449
  188   HD12  LEU  25          HD12      LEU  25  -1.378  -4.722  -3.539
  189   HD13  LEU  25          HD13      LEU  25  -1.527  -5.949  -2.281
  190   HD21  LEU  25          HD21      LEU  25  -1.887  -4.204   0.555
  191   HD22  LEU  25          HD22      LEU  25  -2.067  -5.681  -0.393
  192   HD23  LEU  25          HD23      LEU  25  -3.354  -4.474  -0.388
  193    H    LEU  26           H        LEU  26   1.154  -0.787   0.319
  194    HA   LEU  26           HA       LEU  26   1.794  -2.047   2.726
  195    HB3  LEU  26           HB3      LEU  26   2.722   0.663   2.833
  196    HG   LEU  26           HG       LEU  26   4.010  -1.954   1.995
  197   HD11  LEU  26          HD11      LEU  26   5.342  -0.091   1.195
  198   HD12  LEU  26          HD12      LEU  26   6.132  -0.772   2.617
  199   HD13  LEU  26          HD13      LEU  26   5.209   0.725   2.752
  200   HD21  LEU  26          HD21      LEU  26   4.900  -1.084   4.526
  201   HD22  LEU  26          HD22      LEU  26   3.833  -2.445   4.190
  202   HD23  LEU  26          HD23      LEU  26   3.152  -0.859   4.541
  203    H    ILE  27           H        ILE  27  -0.158   0.845   2.150
  204    HA   ILE  27           HA       ILE  27  -0.582   1.304   4.998
  205    HB   ILE  27           HB       ILE  27  -2.006   2.494   2.599
  206   HG13  ILE  27          HG13      ILE  27   0.637   2.843   3.404
  207   HG21  ILE  27          HG21      ILE  27  -3.371   2.720   4.573
  208   HG22  ILE  27          HG22      ILE  27  -2.582   4.275   4.307
  209   HG23  ILE  27          HG23      ILE  27  -1.977   3.180   5.550
  210   HD11  ILE  27          HD11      ILE  27  -1.288   4.613   1.884
  211   HD12  ILE  27          HD12      ILE  27  -0.117   3.473   1.225
  212   HD13  ILE  27          HD13      ILE  27   0.437   4.961   1.990
  213    H    LEU  28           H        LEU  28  -2.626   0.487   2.262
  214    HA   LEU  28           HA       LEU  28  -4.968  -0.185   3.534
  215    HB3  LEU  28           HB3      LEU  28  -4.112  -2.003   1.310
  216    HG   LEU  28           HG       LEU  28  -6.465  -1.688   2.487
  217   HD11  LEU  28          HD11      LEU  28  -6.771   0.323   0.273
  218   HD12  LEU  28          HD12      LEU  28  -6.227   0.860   1.862
  219   HD13  LEU  28          HD13      LEU  28  -7.791   0.064   1.690
  220   HD21  LEU  28          HD21      LEU  28  -5.930  -1.887  -0.490
  221   HD22  LEU  28          HD22      LEU  28  -7.523  -2.162   0.215
  222   HD23  LEU  28          HD23      LEU  28  -6.171  -3.211   0.652
  223    H    ALA  29           H        ALA  29  -2.174  -2.365   3.029
  224    HA   ALA  29           HA       ALA  29  -3.337  -4.595   4.337
  225    HB1  ALA  29           HB1      ALA  29  -1.091  -5.518   4.360
  226    HB2  ALA  29           HB2      ALA  29  -0.395  -3.925   4.061
  227    HB3  ALA  29           HB3      ALA  29  -1.360  -4.714   2.813
  228    H    LEU  30           H        LEU  30  -1.454  -1.849   5.431
  229    HA   LEU  30           HA       LEU  30  -0.706  -2.645   7.976
  230    HB3  LEU  30           HB3      LEU  30  -1.813   0.106   7.687
  231    HG   LEU  30           HG       LEU  30  -0.438  -0.814   9.648
  232   HD11  LEU  30          HD11      LEU  30   1.615  -1.663   9.273
  233   HD12  LEU  30          HD12      LEU  30   2.094  -0.224   8.376
  234   HD13  LEU  30          HD13      LEU  30   1.296  -1.555   7.543
  235   HD21  LEU  30          HD21      LEU  30  -0.780   1.601   9.201
  236   HD22  LEU  30          HD22      LEU  30   0.625   1.592   8.136
  237   HD23  LEU  30          HD23      LEU  30   0.824   1.286   9.861
  238    H    TRP  31           H        TRP  31  -3.847  -1.402   6.895
  239    HA   TRP  31           HA       TRP  31  -5.038  -1.298   9.445
  240    HB3  TRP  31           HB3      TRP  31  -7.222  -1.583   8.042
  241    HD1  TRP  31           HD1      TRP  31  -6.047   0.920   5.802
  242    HE1  TRP  31           HE1      TRP  31  -6.103   3.283   6.830
  243    HE3  TRP  31           HE3      TRP  31  -6.558  -0.276  10.744
  244    HZ2  TRP  31           HZ2      TRP  31  -6.330   4.503   9.407
  245    HZ3  TRP  31           HZ3      TRP  31  -6.684   1.501  12.459
  246    HH2  TRP  31           HH2      TRP  31  -6.576   3.889  11.799
  247    H    LYS  32           H        LYS  32  -4.562  -3.868   7.190
  248    HA   LYS  32           HA       LYS  32  -6.361  -5.732   8.490
  249    HB3  LYS  32           HB3      LYS  32  -5.269  -7.437   7.082
  250    HG3  LYS  32           HG3      LYS  32  -5.441  -5.396   5.024
  251    HD3  LYS  32           HD3      LYS  32  -6.094  -7.887   4.979
  252    HE3  LYS  32           HE3      LYS  32  -7.597  -7.337   7.126
  253    HZ1  LYS  32           HZ1      LYS  32  -9.142  -5.884   6.307
  254    HZ2  LYS  32           HZ2      LYS  32  -9.961  -7.358   6.094
  255    HZ3  LYS  32           HZ3      LYS  32  -9.195  -6.610   4.774
  256    H    ILE  33           H        ILE  33  -2.872  -5.255   8.309
  257    HA   ILE  33           HA       ILE  33  -2.353  -7.113  10.472
  258    HB   ILE  33           HB       ILE  33  -0.507  -5.201   9.021
  259   HG13  ILE  33          HG13      ILE  33  -1.739  -7.269   7.870
  260   HG21  ILE  33          HG21      ILE  33   1.074  -7.170   9.996
  261   HG22  ILE  33          HG22      ILE  33  -0.148  -7.114  11.265
  262   HG23  ILE  33          HG23      ILE  33   0.772  -5.664  10.862
  263   HD11  ILE  33          HD11      ILE  33   1.228  -6.679   7.653
  264   HD12  ILE  33          HD12      ILE  33  -0.067  -5.868   6.771
  265   HD13  ILE  33          HD13      ILE  33   0.287  -7.566   6.454
  266    H    GLY  34           H        GLY  34  -3.736  -4.237  10.512
  267    HA2  GLY  34           HA3      GLY  34  -2.328  -3.285  12.936
  268    HA3  GLY  34           HA2      GLY  34  -3.196  -2.235  11.821
  269    H    PHE  35           H        PHE  35  -5.551  -2.549  11.645
  270    HA   PHE  35           HA       PHE  35  -6.919  -2.328  13.992
  271    HB3  PHE  35           HB3      PHE  35  -8.398  -3.839  11.937
  272    HD1  PHE  35           HD1      PHE  35 -10.040  -3.809  13.775
  273    HD2  PHE  35           HD2      PHE  35  -8.360  -0.191  12.197
  274    HE1  PHE  35           HE1      PHE  35 -11.825  -2.492  14.897
  275    HE2  PHE  35           HE2      PHE  35 -10.139   1.129  13.315
  276    HZ   PHE  35           HZ       PHE  35 -11.871  -0.023  14.666
  277    H    PHE  36           H        PHE  36  -5.691  -5.147  12.550
  278    HA   PHE  36           HA       PHE  36  -7.201  -6.974  14.271
  279    HB3  PHE  36           HB3      PHE  36  -4.839  -7.769  12.589
  280    HD1  PHE  36           HD1      PHE  36  -8.443  -8.694  12.523
  281    HD2  PHE  36           HD2      PHE  36  -4.484  -9.823  13.748
  282    HE1  PHE  36           HE1      PHE  36  -9.265 -10.966  13.087
  283    HE2  PHE  36           HE2      PHE  36  -5.305 -12.094  14.312
  284    HZ   PHE  36           HZ       PHE  36  -7.696 -12.666  13.981
  285    H    LYS  37           H        LYS  37  -3.900  -5.901  13.684
  286    HA   LYS  37           HA       LYS  37  -2.847  -7.179  16.059
  287    HB3  LYS  37           HB3      LYS  37  -1.481  -5.031  14.440
  288    HG3  LYS  37           HG3      LYS  37  -0.720  -6.505  16.691
  289    HD3  LYS  37           HD3      LYS  37  -0.502  -8.451  15.042
  290    HE3  LYS  37           HE3      LYS  37   2.107  -7.470  14.141
  291    HZ1  LYS  37           HZ1      LYS  37   1.166  -9.462  13.301
  292    HZ2  LYS  37           HZ2      LYS  37   1.154  -8.333  12.031
  293    HZ3  LYS  37           HZ3      LYS  37  -0.280  -8.686  12.872
  294    H    ARG  38           H        ARG  38  -5.012  -5.068  16.134
  295    HA   ARG  38           HA       ARG  38  -3.696  -3.170  17.989
  296    HB3  ARG  38           HB3      ARG  38  -6.241  -2.792  16.401
  297    HG3  ARG  38           HG3      ARG  38  -4.665  -1.039  18.299
  298    HD3  ARG  38           HD3      ARG  38  -6.065   0.825  17.573
  299    HE   ARG  38           HE       ARG  38  -5.085   0.130  14.979
  300   HH11  ARG  38          HH11      ARG  38  -4.167   0.744  18.257
  301   HH12  ARG  38          HH12      ARG  38  -2.574   1.292  17.854
  302   HH21  ARG  38          HH21      ARG  38  -2.999   0.848  14.441
  303   HH22  ARG  38          HH22      ARG  38  -1.913   1.352  15.693
  304    HA   PRO  39           HA       PRO  39  -6.350  -5.912  20.663
  305    HB3  PRO  39           HB3      PRO  39  -5.013  -6.337  22.492
  306    HG3  PRO  39           HG3      PRO  39  -3.451  -6.729  20.859
  307    HD3  PRO  39           HD3      PRO  39  -3.108  -5.261  19.111
  308    H    LEU  40           H        LEU  40  -6.224  -4.425  23.383
  309    HA   LEU  40           HA       LEU  40  -7.786  -2.033  22.735
  310    HB3  LEU  40           HB3      LEU  40  -9.495  -3.732  22.903
  311    HG   LEU  40           HG       LEU  40  -7.693  -4.856  24.809
  312   HD11  LEU  40          HD11      LEU  40 -10.495  -4.462  25.901
  313   HD12  LEU  40          HD12      LEU  40  -9.077  -3.585  26.477
  314   HD13  LEU  40          HD13      LEU  40  -9.173  -5.333  26.675
  315   HD21  LEU  40          HD21      LEU  40  -9.220  -6.792  24.585
  316   HD22  LEU  40          HD22      LEU  40  -8.886  -6.062  23.015
  317   HD23  LEU  40          HD23      LEU  40 -10.423  -5.751  23.824
  318    H    LYS  41           H        LYS  41  -7.447  -0.405  24.123
  319    HA   LYS  41           HA       LYS  41  -5.331  -0.287  25.864
  320    HB3  LYS  41           HB3      LYS  41  -6.362   1.703  26.824
  321    HG3  LYS  41           HG3      LYS  41  -5.837   1.276  24.137
  322    HD3  LYS  41           HD3      LYS  41  -8.412   2.851  24.315
  323    HE3  LYS  41           HE3      LYS  41  -8.137   3.216  22.086
  324    HZ1  LYS  41           HZ1      LYS  41  -5.834   3.311  21.434
  325    HZ2  LYS  41           HZ2      LYS  41  -5.390   2.258  22.690
  326    HZ3  LYS  41           HZ3      LYS  41  -5.982   3.810  23.049
  327    H    LYS  42           H        LYS  42  -5.653   0.268  28.350
  328    HA   LYS  42           HA       LYS  42  -6.563  -2.181  29.567
  329    HB3  LYS  42           HB3      LYS  42  -5.579  -1.371  31.556
  330    HG3  LYS  42           HG3      LYS  42  -3.385  -0.524  30.835
  331    HD3  LYS  42           HD3      LYS  42  -4.192  -2.310  28.579
  332    HE3  LYS  42           HE3      LYS  42  -2.144  -3.412  29.126
  333    HZ1  LYS  42           HZ1      LYS  42  -2.252  -0.736  28.591
  334    HZ2  LYS  42           HZ2      LYS  42  -0.893  -1.740  28.415
  335    HZ3  LYS  42           HZ3      LYS  42  -1.115  -0.850  29.845
  336    H    LYS  43           H        LYS  43  -8.351  -2.529  30.771
  337    HA   LYS  43           HA       LYS  43 -10.753  -1.433  30.384
  338    HB3  LYS  43           HB3      LYS  43  -9.820  -2.192  33.158
  339    HG3  LYS  43           HG3      LYS  43 -12.514  -2.399  31.780
  340    HD3  LYS  43           HD3      LYS  43 -12.717  -2.663  34.580
  341    HE3  LYS  43           HE3      LYS  43 -13.445  -4.972  33.969
  342    HZ1  LYS  43           HZ1      LYS  43 -14.379  -2.521  32.828
  343    HZ2  LYS  43           HZ2      LYS  43 -15.258  -3.791  33.538
  344    HZ3  LYS  43           HZ3      LYS  43 -14.823  -3.869  31.898
  345    H    MET  44           H        MET  44 -11.079   0.715  30.122
  346    HA   MET  44           HA       MET  44 -10.193   2.564  32.231
  347    HB3  MET  44           HB3      MET  44 -10.774   4.340  30.612
  348    HG3  MET  44           HG3      MET  44  -9.196   2.417  28.967
  349    HE1  MET  44           HE1      MET  44  -6.945   4.542  30.880
  350    HE2  MET  44           HE2      MET  44  -6.332   5.455  29.503
  351    HE3  MET  44           HE3      MET  44  -6.440   3.698  29.409
  352    H    GLU  45           H        GLU  45 -12.777   3.700  30.377
  353    HA   GLU  45           HA       GLU  45 -14.899   2.751  32.106
  354    HB3  GLU  45           HB3      GLU  45 -14.705   5.709  32.092
  355    HG3  GLU  45           HG3      GLU  45 -15.255   3.852  34.402
  356    H    LYS  46           H        LYS  46 -16.888   2.958  31.165
  357    HA   LYS  46           HA       LYS  46 -16.910   4.094  28.448
  358    HB3  LYS  46           HB3      LYS  46 -17.554   1.779  28.497
  359    HG3  LYS  46           HG3      LYS  46 -19.471   2.641  30.679
  360    HD3  LYS  46           HD3      LYS  46 -19.705  -0.063  30.521
  361    HE3  LYS  46           HE3      LYS  46 -21.864   0.376  29.387
  362    HZ1  LYS  46           HZ1      LYS  46 -22.440   1.085  31.386
  363    HZ2  LYS  46           HZ2      LYS  46 -22.014   2.667  30.943
  364    HZ3  LYS  46           HZ3      LYS  46 -20.874   1.657  31.694
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1  23.589  -5.385  -7.602
    2    H2   MET   1           H2       MET   1  22.554  -4.862  -8.843
    3    H3   MET   1           H3       MET   1  23.600  -3.759  -8.082
    4    HA   MET   1           HA       MET   1  25.055  -4.132  -9.691
    5    HB3  MET   1           HB3      MET   1  25.946  -6.662  -9.599
    6    HG3  MET   1           HG3      MET   1  26.301  -4.532  -7.472
    7    HE1  MET   1           HE1      MET   1  28.701  -6.621  -9.505
    8    HE2  MET   1           HE2      MET   1  29.824  -7.208  -8.281
    9    HE3  MET   1           HE3      MET   1  29.630  -5.475  -8.529
   10    H    GLY   2           H        GLY   2  25.694  -5.905 -11.509
   11    HA2  GLY   2           HA3      GLY   2  25.063  -6.912 -13.480
   12    HA3  GLY   2           HA2      GLY   2  23.642  -7.499 -12.620
   13    H    LEU   3           H        LEU   3  24.868  -4.322 -13.716
   14    HA   LEU   3           HA       LEU   3  22.159  -3.706 -14.697
   15    HB3  LEU   3           HB3      LEU   3  23.106  -1.307 -14.680
   16    HG   LEU   3           HG       LEU   3  22.299  -3.032 -12.398
   17   HD11  LEU   3          HD11      LEU   3  24.077  -1.755 -11.336
   18   HD12  LEU   3          HD12      LEU   3  22.525  -1.088 -10.828
   19   HD13  LEU   3          HD13      LEU   3  23.481  -0.260 -12.055
   20   HD21  LEU   3          HD21      LEU   3  21.356  -0.331 -13.416
   21   HD22  LEU   3          HD22      LEU   3  20.515  -1.357 -12.254
   22   HD23  LEU   3          HD23      LEU   3  20.697  -1.885 -13.927
   23    HA   PRO   4           HA       PRO   4  23.820  -3.794 -18.812
   24    HB3  PRO   4           HB3      PRO   4  21.659  -3.681 -19.600
   25    HG3  PRO   4           HG3      PRO   4  20.061  -2.456 -18.505
   26    HD3  PRO   4           HD3      PRO   4  20.905  -3.485 -16.628
   27    H    GLY   5           H        GLY   5  23.737  -0.877 -16.990
   28    HA2  GLY   5           HA3      GLY   5  25.455   0.747 -16.942
   29    HA3  GLY   5           HA2      GLY   5  25.995   0.189 -18.524
   30    H    ARG   6           H        ARG   6  22.692   0.922 -17.699
   31    HA   ARG   6           HA       ARG   6  22.795   3.510 -19.041
   32    HB3  ARG   6           HB3      ARG   6  20.621   2.707 -20.326
   33    HG3  ARG   6           HG3      ARG   6  23.463   2.063 -21.139
   34    HD3  ARG   6           HD3      ARG   6  22.049   2.859 -23.395
   35    HE   ARG   6           HE       ARG   6  22.130   0.055 -23.312
   36   HH11  ARG   6          HH11      ARG   6  24.202   2.787 -22.855
   37   HH12  ARG   6          HH12      ARG   6  25.642   1.943 -23.319
   38   HH21  ARG   6          HH21      ARG   6  24.010  -1.059 -23.909
   39   HH22  ARG   6          HH22      ARG   6  25.533  -0.233 -23.916
   40    H    VAL   7           H        VAL   7  21.167   4.921 -18.420
   41    HA   VAL   7           HA       VAL   7  19.296   3.893 -16.371
   42    HB   VAL   7           HB       VAL   7  19.640   6.406 -15.528
   43   HG11  VAL   7          HG11      VAL   7  19.905   4.473 -14.103
   44   HG12  VAL   7          HG12      VAL   7  21.363   5.454 -13.947
   45   HG13  VAL   7          HG13      VAL   7  21.382   3.996 -14.940
   46   HG21  VAL   7          HG21      VAL   7  21.362   6.669 -17.441
   47   HG22  VAL   7          HG22      VAL   7  22.413   5.647 -16.461
   48   HG23  VAL   7          HG23      VAL   7  21.855   7.198 -15.833
   49    HA   PRO   8           HA       PRO   8  16.874   6.150 -19.573
   50    HB3  PRO   8           HB3      PRO   8  15.911   4.292 -20.461
   51    HG3  PRO   8           HG3      PRO   8  16.180   2.338 -19.385
   52    HD3  PRO   8           HD3      PRO   8  18.148   2.843 -18.365
   53    H    LEU   9           H        LEU   9  15.546   7.872 -19.179
   54    HA   LEU   9           HA       LEU   9  15.010   8.813 -16.642
   55    HB3  LEU   9           HB3      LEU   9  12.877   9.779 -18.139
   56    HG   LEU   9           HG       LEU   9  14.406  11.717 -18.575
   57   HD11  LEU   9          HD11      LEU   9  15.211  11.294 -15.857
   58   HD12  LEU   9          HD12      LEU   9  13.603  10.603 -16.075
   59   HD13  LEU   9          HD13      LEU   9  13.893  12.298 -16.465
   60   HD21  LEU   9          HD21      LEU   9  16.598  10.506 -17.015
   61   HD22  LEU   9          HD22      LEU   9  16.671  11.544 -18.437
   62   HD23  LEU   9          HD23      LEU   9  16.386   9.813 -18.623
   63    H    TRP  10           H        TRP  10  13.119   6.631 -18.639
   64    HA   TRP  10           HA       TRP  10  10.713   6.571 -17.227
   65    HB3  TRP  10           HB3      TRP  10  10.751   4.079 -18.023
   66    HD1  TRP  10           HD1      TRP  10   8.447   5.009 -18.854
   67    HE1  TRP  10           HE1      TRP  10   7.727   6.269 -20.985
   68    HE3  TRP  10           HE3      TRP  10  13.024   6.376 -20.662
   69    HZ2  TRP  10           HZ2      TRP  10   8.933   7.671 -23.167
   70    HZ3  TRP  10           HZ3      TRP  10  13.208   7.671 -22.766
   71    HH2  TRP  10           HH2      TRP  10  11.171   8.320 -24.020
   72    H    VAL  11           H        VAL  11  13.816   5.141 -16.495
   73    HA   VAL  11           HA       VAL  11  13.135   3.159 -14.689
   74    HB   VAL  11           HB       VAL  11  15.468   3.925 -15.525
   75   HG11  VAL  11          HG11      VAL  11  15.453   5.418 -12.899
   76   HG12  VAL  11          HG12      VAL  11  15.103   6.233 -14.423
   77   HG13  VAL  11          HG13      VAL  11  16.668   5.460 -14.176
   78   HG21  VAL  11          HG21      VAL  11  16.362   3.176 -13.101
   79   HG22  VAL  11          HG22      VAL  11  15.608   2.037 -14.218
   80   HG23  VAL  11          HG23      VAL  11  14.662   2.747 -12.909
   81    H    ILE  12           H        ILE  12  13.252   6.642 -14.213
   82    HA   ILE  12           HA       ILE  12  12.894   6.591 -11.386
   83    HB   ILE  12           HB       ILE  12  12.620   8.655 -13.538
   84   HG13  ILE  12          HG13      ILE  12  14.499   9.581 -12.535
   85   HG21  ILE  12          HG21      ILE  12  10.743   9.293 -12.259
   86   HG22  ILE  12          HG22      ILE  12  12.054  10.260 -11.584
   87   HG23  ILE  12          HG23      ILE  12  11.501   8.813 -10.740
   88   HD11  ILE  12          HD11      ILE  12  15.081   8.952 -10.088
   89   HD12  ILE  12          HD12      ILE  12  13.417   8.384  -9.985
   90   HD13  ILE  12          HD13      ILE  12  13.750  10.076 -10.353
   91    H    LEU  13           H        LEU  13  10.665   6.949 -14.100
   92    HA   LEU  13           HA       LEU  13   8.321   7.115 -12.409
   93    HB3  LEU  13           HB3      LEU  13   7.083   6.751 -14.582
   94    HG   LEU  13           HG       LEU  13   8.878   8.939 -13.839
   95   HD11  LEU  13          HD11      LEU  13   8.124   8.527 -16.743
   96   HD12  LEU  13          HD12      LEU  13   9.741   8.755 -16.078
   97   HD13  LEU  13          HD13      LEU  13   8.590  10.092 -16.076
   98   HD21  LEU  13          HD21      LEU  13   6.880  10.253 -14.283
   99   HD22  LEU  13          HD22      LEU  13   6.401   8.782 -13.437
  100   HD23  LEU  13          HD23      LEU  13   6.155   8.919 -15.178
  101    H    LEU  14           H        LEU  14   9.513   4.662 -14.682
  102    HA   LEU  14           HA       LEU  14   7.801   2.606 -14.138
  103    HB3  LEU  14           HB3      LEU  14  10.758   2.155 -14.535
  104    HG   LEU  14           HG       LEU  14   8.619   0.418 -14.334
  105   HD11  LEU  14          HD11      LEU  14   9.280   0.658 -17.278
  106   HD12  LEU  14          HD12      LEU  14   7.859   1.425 -16.566
  107   HD13  LEU  14          HD13      LEU  14   8.029  -0.331 -16.524
  108   HD21  LEU  14          HD21      LEU  14  10.190  -1.229 -15.327
  109   HD22  LEU  14          HD22      LEU  14  11.008  -0.162 -14.185
  110   HD23  LEU  14          HD23      LEU  14  11.190   0.098 -15.920
  111    H    SER  15           H        SER  15  10.490   3.748 -12.221
  112    HA   SER  15           HA       SER  15  10.400   1.457 -10.420
  113    HB3  SER  15           HB3      SER  15  12.531   2.603 -10.675
  114    HG   SER  15           HG       SER  15  11.177   4.702 -10.928
  115    H    ALA  16           H        ALA  16   9.808   4.939 -10.053
  116    HA   ALA  16           HA       ALA  16   8.562   4.961  -7.633
  117    HB1  ALA  16           HB1      ALA  16   7.664   6.582 -10.029
  118    HB2  ALA  16           HB2      ALA  16   9.032   6.988  -8.991
  119    HB3  ALA  16           HB3      ALA  16   7.396   6.985  -8.334
  120    H    PHE  17           H        PHE  17   6.922   4.457 -10.787
  121    HA   PHE  17           HA       PHE  17   4.349   4.071  -9.781
  122    HB3  PHE  17           HB3      PHE  17   5.657   2.823 -12.208
  123    HD1  PHE  17           HD1      PHE  17   2.394   4.502 -11.504
  124    HD2  PHE  17           HD2      PHE  17   4.403   0.858 -12.568
  125    HE1  PHE  17           HE1      PHE  17   0.206   3.429 -11.964
  126    HE2  PHE  17           HE2      PHE  17   2.215  -0.215 -13.028
  127    HZ   PHE  17           HZ       PHE  17   0.116   1.070 -12.726
  128    H    ALA  18           H        ALA  18   6.953   1.725 -10.370
  129    HA   ALA  18           HA       ALA  18   5.506  -0.598  -9.714
  130    HB1  ALA  18           HB1      ALA  18   7.717  -1.636  -9.364
  131    HB2  ALA  18           HB2      ALA  18   8.465  -0.039  -9.390
  132    HB3  ALA  18           HB3      ALA  18   7.686  -0.669 -10.840
  133    H    GLY  19           H        GLY  19   7.524   1.538  -7.707
  134    HA2  GLY  19           HA3      GLY  19   7.148   0.051  -5.301
  135    HA3  GLY  19           HA2      GLY  19   7.775   1.693  -5.423
  136    H    LEU  20           H        LEU  20   5.416   2.707  -6.843
  137    HA   LEU  20           HA       LEU  20   3.904   3.633  -4.688
  138    HB3  LEU  20           HB3      LEU  20   2.291   3.499  -7.085
  139    HG   LEU  20           HG       LEU  20   2.469   5.934  -6.954
  140   HD11  LEU  20          HD11      LEU  20   2.433   5.433  -4.069
  141   HD12  LEU  20          HD12      LEU  20   1.456   4.279  -4.978
  142   HD13  LEU  20          HD13      LEU  20   1.142   6.009  -5.126
  143   HD21  LEU  20          HD21      LEU  20   4.136   6.198  -4.627
  144   HD22  LEU  20          HD22      LEU  20   4.356   6.921  -6.221
  145   HD23  LEU  20          HD23      LEU  20   5.031   5.329  -5.873
  146    H    LEU  21           H        LEU  21   3.135   1.028  -6.973
  147    HA   LEU  21           HA       LEU  21   0.648   0.297  -6.010
  148    HB3  LEU  21           HB3      LEU  21   1.649  -2.117  -6.727
  149    HG   LEU  21           HG       LEU  21  -0.228  -0.973  -7.793
  150   HD11  LEU  21          HD11      LEU  21   0.669   0.663  -9.736
  151   HD12  LEU  21          HD12      LEU  21   1.939   0.927  -8.541
  152   HD13  LEU  21          HD13      LEU  21   0.255   1.248  -8.124
  153   HD21  LEU  21          HD21      LEU  21   1.859  -1.509  -9.921
  154   HD22  LEU  21          HD22      LEU  21   0.115  -1.752 -10.032
  155   HD23  LEU  21          HD23      LEU  21   1.088  -2.802  -9.002
  156    H    LEU  22           H        LEU  22   3.859  -0.826  -4.999
  157    HA   LEU  22           HA       LEU  22   2.901  -2.562  -2.960
  158    HB3  LEU  22           HB3      LEU  22   5.361  -1.914  -2.067
  159    HG   LEU  22           HG       LEU  22   4.704  -4.143  -2.780
  160   HD11  LEU  22          HD11      LEU  22   5.016  -4.459  -5.419
  161   HD12  LEU  22          HD12      LEU  22   4.498  -2.773  -5.425
  162   HD13  LEU  22          HD13      LEU  22   3.461  -4.012  -4.719
  163   HD21  LEU  22          HD21      LEU  22   6.902  -3.958  -4.668
  164   HD22  LEU  22          HD22      LEU  22   6.870  -4.703  -3.070
  165   HD23  LEU  22          HD23      LEU  22   7.225  -2.984  -3.233
  166    H    LEU  23           H        LEU  23   4.011   0.791  -3.065
  167    HA   LEU  23           HA       LEU  23   3.937   1.451  -0.380
  168    HB3  LEU  23           HB3      LEU  23   2.935   3.317  -2.527
  169    HG   LEU  23           HG       LEU  23   3.382   3.629   0.210
  170   HD11  LEU  23          HD11      LEU  23   5.815   3.497  -0.198
  171   HD12  LEU  23          HD12      LEU  23   5.348   5.115   0.325
  172   HD13  LEU  23          HD13      LEU  23   5.688   4.802  -1.376
  173   HD21  LEU  23          HD21      LEU  23   3.082   6.020  -0.284
  174   HD22  LEU  23          HD22      LEU  23   1.995   5.051  -1.279
  175   HD23  LEU  23          HD23      LEU  23   3.465   5.728  -1.981
  176    H    MET  24           H        MET  24   1.267   1.054  -2.586
  177    HA   MET  24           HA       MET  24  -0.706   2.139  -0.727
  178    HB3  MET  24           HB3      MET  24  -1.085   0.485  -3.240
  179    HG3  MET  24           HG3      MET  24  -2.919   1.500  -1.174
  180    HE1  MET  24           HE1      MET  24  -2.695   1.109  -4.923
  181    HE2  MET  24           HE2      MET  24  -3.967   2.125  -5.594
  182    HE3  MET  24           HE3      MET  24  -4.391   0.654  -4.722
  183    H    LEU  25           H        LEU  25  -0.002  -1.030  -2.083
  184    HA   LEU  25           HA       LEU  25  -1.667  -2.596  -0.577
  185    HB3  LEU  25           HB3      LEU  25   0.525  -4.237  -0.844
  186    HG   LEU  25           HG       LEU  25  -0.538  -4.861  -3.037
  187   HD11  LEU  25          HD11      LEU  25  -1.952  -6.047  -1.754
  188   HD12  LEU  25          HD12      LEU  25  -2.975  -4.627  -1.542
  189   HD13  LEU  25          HD13      LEU  25  -1.655  -4.938  -0.415
  190   HD21  LEU  25          HD21      LEU  25  -2.777  -2.990  -2.612
  191   HD22  LEU  25          HD22      LEU  25  -1.994  -3.487  -4.112
  192   HD23  LEU  25          HD23      LEU  25  -1.277  -2.215  -3.121
  193    H    LEU  26           H        LEU  26   1.712  -1.761   0.329
  194    HA   LEU  26           HA       LEU  26   1.626  -3.264   2.736
  195    HB3  LEU  26           HB3      LEU  26   3.592  -1.748   3.369
  196    HG   LEU  26           HG       LEU  26   3.367  -3.583   1.026
  197   HD11  LEU  26          HD11      LEU  26   4.938  -1.850   0.236
  198   HD12  LEU  26          HD12      LEU  26   5.786  -3.358   0.575
  199   HD13  LEU  26          HD13      LEU  26   5.873  -2.019   1.721
  200   HD21  LEU  26          HD21      LEU  26   3.624  -4.201   3.523
  201   HD22  LEU  26          HD22      LEU  26   5.287  -3.641   3.359
  202   HD23  LEU  26          HD23      LEU  26   4.712  -4.993   2.383
  203    H    ILE  27           H        ILE  27   1.323   0.257   2.205
  204    HA   ILE  27           HA       ILE  27   0.753   0.838   4.913
  205    HB   ILE  27           HB       ILE  27   1.500   2.477   3.069
  206   HG13  ILE  27          HG13      ILE  27  -0.740   3.139   5.007
  207   HG21  ILE  27          HG21      ILE  27  -1.487   2.739   2.666
  208   HG22  ILE  27          HG22      ILE  27  -0.443   1.839   1.573
  209   HG23  ILE  27          HG23      ILE  27  -0.198   3.566   1.793
  210   HD11  ILE  27          HD11      ILE  27   0.967   2.604   6.437
  211   HD12  ILE  27          HD12      ILE  27   1.513   4.233   6.043
  212   HD13  ILE  27          HD13      ILE  27   2.214   2.845   5.215
  213    H    LEU  28           H        LEU  28  -1.269   0.020   2.179
  214    HA   LEU  28           HA       LEU  28  -3.745   0.530   3.572
  215    HB3  LEU  28           HB3      LEU  28  -3.257  -1.185   1.110
  216    HG   LEU  28           HG       LEU  28  -5.563  -0.765   2.797
  217   HD11  LEU  28          HD11      LEU  28  -5.773   0.211  -0.066
  218   HD12  LEU  28          HD12      LEU  28  -6.003   1.185   1.387
  219   HD13  LEU  28          HD13      LEU  28  -7.146  -0.102   0.997
  220   HD21  LEU  28          HD21      LEU  28  -5.117  -2.253   0.187
  221   HD22  LEU  28          HD22      LEU  28  -6.529  -2.444   1.225
  222   HD23  LEU  28          HD23      LEU  28  -4.934  -2.916   1.811
  223    H    ALA  29           H        ALA  29  -1.759  -2.318   2.852
  224    HA   ALA  29           HA       ALA  29  -3.346  -4.285   4.014
  225    HB1  ALA  29           HB1      ALA  29  -0.346  -4.061   3.757
  226    HB2  ALA  29           HB2      ALA  29  -1.460  -4.997   2.758
  227    HB3  ALA  29           HB3      ALA  29  -1.138  -5.490   4.420
  228    H    LEU  30           H        LEU  30  -0.748  -2.337   5.578
  229    HA   LEU  30           HA       LEU  30  -0.869  -3.486   8.100
  230    HB3  LEU  30           HB3      LEU  30  -0.550  -0.777   8.626
  231    HG   LEU  30           HG       LEU  30   0.905  -2.626   9.364
  232   HD11  LEU  30          HD11      LEU  30   1.293  -2.864   6.434
  233   HD12  LEU  30          HD12      LEU  30   1.342  -4.111   7.679
  234   HD13  LEU  30          HD13      LEU  30   2.742  -3.075   7.415
  235   HD21  LEU  30          HD21      LEU  30   2.960  -1.427   9.301
  236   HD22  LEU  30          HD22      LEU  30   1.705  -0.192   9.195
  237   HD23  LEU  30          HD23      LEU  30   2.572  -0.694   7.744
  238    H    TRP  31           H        TRP  31  -2.759  -0.759   6.881
  239    HA   TRP  31           HA       TRP  31  -4.260  -0.111   9.066
  240    HB3  TRP  31           HB3      TRP  31  -6.127  -0.142   6.950
  241    HD1  TRP  31           HD1      TRP  31  -3.066   2.099   7.768
  242    HE1  TRP  31           HE1      TRP  31  -3.949   4.380   8.580
  243    HE3  TRP  31           HE3      TRP  31  -8.093   1.231   7.542
  244    HZ2  TRP  31           HZ2      TRP  31  -6.457   5.668   9.070
  245    HZ3  TRP  31           HZ3      TRP  31  -9.704   2.998   8.188
  246    HH2  TRP  31           HH2      TRP  31  -8.894   5.215   8.949
  247    H    LYS  32           H        LYS  32  -4.805  -2.841   6.896
  248    HA   LYS  32           HA       LYS  32  -7.229  -3.736   8.066
  249    HB3  LYS  32           HB3      LYS  32  -6.824  -5.810   6.849
  250    HG3  LYS  32           HG3      LYS  32  -5.719  -3.721   5.012
  251    HD3  LYS  32           HD3      LYS  32  -8.118  -5.553   4.784
  252    HE3  LYS  32           HE3      LYS  32  -7.253  -3.412   3.233
  253    HZ1  LYS  32           HZ1      LYS  32  -6.145  -4.209   1.424
  254    HZ2  LYS  32           HZ2      LYS  32  -6.715  -5.798   1.620
  255    HZ3  LYS  32           HZ3      LYS  32  -5.474  -5.209   2.619
  256    H    ILE  33           H        ILE  33  -3.820  -4.606   8.539
  257    HA   ILE  33           HA       ILE  33  -4.318  -6.594  10.523
  258    HB   ILE  33           HB       ILE  33  -1.809  -4.912  10.303
  259   HG13  ILE  33          HG13      ILE  33  -1.029  -6.789   8.761
  260   HG21  ILE  33          HG21      ILE  33  -1.470  -7.743  10.792
  261   HG22  ILE  33          HG22      ILE  33  -2.577  -7.051  11.978
  262   HG23  ILE  33          HG23      ILE  33  -0.960  -6.377  11.783
  263   HD11  ILE  33          HD11      ILE  33  -3.058  -8.235   9.424
  264   HD12  ILE  33          HD12      ILE  33  -2.619  -8.196   7.716
  265   HD13  ILE  33          HD13      ILE  33  -3.978  -7.234   8.299
  266    H    GLY  34           H        GLY  34  -4.762  -3.322  10.458
  267    HA2  GLY  34           HA3      GLY  34  -4.344  -2.944  13.344
  268    HA3  GLY  34           HA2      GLY  34  -4.622  -1.662  12.164
  269    H    PHE  35           H        PHE  35  -6.476  -4.565  12.001
  270    HA   PHE  35           HA       PHE  35  -8.675  -5.075  12.333
  271    HB3  PHE  35           HB3      PHE  35  -8.412  -2.966  14.477
  272    HD1  PHE  35           HD1      PHE  35 -10.238  -6.188  14.288
  273    HD2  PHE  35           HD2      PHE  35 -10.546  -1.912  14.479
  274    HE1  PHE  35           HE1      PHE  35 -12.673  -6.385  14.725
  275    HE2  PHE  35           HE2      PHE  35 -12.981  -2.105  14.914
  276    HZ   PHE  35           HZ       PHE  35 -14.044  -4.342  15.037
  277    H    PHE  36           H        PHE  36  -7.860  -1.747  11.769
  278    HA   PHE  36           HA       PHE  36 -10.209  -0.469  11.438
  279    HB3  PHE  36           HB3      PHE  36  -9.225   0.781   9.534
  280    HD1  PHE  36           HD1      PHE  36  -9.743   1.646  12.090
  281    HD2  PHE  36           HD2      PHE  36  -5.956   0.287  10.586
  282    HE1  PHE  36           HE1      PHE  36  -8.585   2.896  13.880
  283    HE2  PHE  36           HE2      PHE  36  -4.794   1.548  12.375
  284    HZ   PHE  36           HZ       PHE  36  -6.109   2.853  14.024
  285    H    LYS  37           H        LYS  37  -9.041  -3.082   9.415
  286    HA   LYS  37           HA       LYS  37 -10.550  -2.966   7.164
  287    HB3  LYS  37           HB3      LYS  37  -9.155  -4.828   7.320
  288    HG3  LYS  37           HG3      LYS  37 -10.494  -5.354   9.988
  289    HD3  LYS  37           HD3      LYS  37  -8.169  -6.982   9.489
  290    HE3  LYS  37           HE3      LYS  37 -11.078  -7.756   9.846
  291    HZ1  LYS  37           HZ1      LYS  37  -8.512  -9.117  10.471
  292    HZ2  LYS  37           HZ2      LYS  37  -9.635  -9.574   9.283
  293    HZ3  LYS  37           HZ3      LYS  37 -10.044  -9.687  10.928
  294    H    ARG  38           H        ARG  38 -11.907  -2.811  10.231
  295    HA   ARG  38           HA       ARG  38 -14.017  -3.249  11.091
  296    HB3  ARG  38           HB3      ARG  38 -14.733  -2.214   8.342
  297    HG3  ARG  38           HG3      ARG  38 -16.222  -2.551  10.926
  298    HD3  ARG  38           HD3      ARG  38 -17.837  -0.785   9.938
  299    HE   ARG  38           HE       ARG  38 -15.385   0.445  10.999
  300   HH11  ARG  38          HH11      ARG  38 -18.504  -0.962  11.529
  301   HH12  ARG  38          HH12      ARG  38 -18.665  -0.319  13.127
  302   HH21  ARG  38          HH21      ARG  38 -15.597   1.292  13.085
  303   HH22  ARG  38          HH22      ARG  38 -17.022   0.953  14.010
  304    HA   PRO  39           HA       PRO  39 -14.763  -7.236   8.913
  305    HB3  PRO  39           HB3      PRO  39 -13.606  -8.460  10.457
  306    HG3  PRO  39           HG3      PRO  39 -13.100  -7.543  12.453
  307    HD3  PRO  39           HD3      PRO  39 -12.904  -5.424  11.644
  308    H    LEU  40           H        LEU  40 -16.621  -5.318  11.047
  309    HA   LEU  40           HA       LEU  40 -19.093  -6.561  10.035
  310    HB3  LEU  40           HB3      LEU  40 -20.071  -6.065  12.371
  311    HG   LEU  40           HG       LEU  40 -18.406  -8.310  11.434
  312   HD11  LEU  40          HD11      LEU  40 -18.625  -9.437  13.710
  313   HD12  LEU  40          HD12      LEU  40 -18.920  -7.830  14.375
  314   HD13  LEU  40          HD13      LEU  40 -17.382  -8.192  13.591
  315   HD21  LEU  40          HD21      LEU  40 -21.015  -8.260  12.969
  316   HD22  LEU  40          HD22      LEU  40 -20.401  -9.555  11.942
  317   HD23  LEU  40          HD23      LEU  40 -20.918  -8.030  11.222
  318    H    LYS  41           H        LYS  41 -19.755  -4.919   8.716
  319    HA   LYS  41           HA       LYS  41 -19.741  -2.171   9.789
  320    HB3  LYS  41           HB3      LYS  41 -18.614  -2.434   7.642
  321    HG3  LYS  41           HG3      LYS  41 -20.801  -3.039   5.916
  322    HD3  LYS  41           HD3      LYS  41 -18.359  -4.648   6.724
  323    HE3  LYS  41           HE3      LYS  41 -20.419  -5.598   5.278
  324    HZ1  LYS  41           HZ1      LYS  41 -20.005  -5.267   2.963
  325    HZ2  LYS  41           HZ2      LYS  41 -18.635  -4.313   3.284
  326    HZ3  LYS  41           HZ3      LYS  41 -20.184  -3.744   3.688
  327    H    LYS  42           H        LYS  42 -21.729  -1.185   8.006
  328    HA   LYS  42           HA       LYS  42 -24.036  -1.289   9.455
  329    HB3  LYS  42           HB3      LYS  42 -24.164  -1.241   6.449
  330    HG3  LYS  42           HG3      LYS  42 -26.063  -0.864   8.366
  331    HD3  LYS  42           HD3      LYS  42 -25.084   1.907   7.637
  332    HE3  LYS  42           HE3      LYS  42 -27.568   1.387   8.127
  333    HZ1  LYS  42           HZ1      LYS  42 -27.717   0.079   9.931
  334    HZ2  LYS  42           HZ2      LYS  42 -27.641   1.549  10.777
  335    HZ3  LYS  42           HZ3      LYS  42 -26.243   0.604  10.587
  336    H    LYS  43           H        LYS  43 -25.646  -2.703   9.813
  337    HA   LYS  43           HA       LYS  43 -26.903  -4.623   9.736
  338    HB3  LYS  43           HB3      LYS  43 -25.940  -5.064   6.918
  339    HG3  LYS  43           HG3      LYS  43 -28.750  -5.373   7.899
  340    HD3  LYS  43           HD3      LYS  43 -27.664  -5.788   5.503
  341    HE3  LYS  43           HE3      LYS  43 -27.299  -8.467   6.871
  342    HZ1  LYS  43           HZ1      LYS  43 -27.592  -9.011   4.720
  343    HZ2  LYS  43           HZ2      LYS  43 -25.964  -8.543   4.584
  344    HZ3  LYS  43           HZ3      LYS  43 -27.202  -7.463   4.146
  345    H    MET  44           H        MET  44 -25.833  -5.896  11.173
  346    HA   MET  44           HA       MET  44 -23.377  -7.038  11.117
  347    HB3  MET  44           HB3      MET  44 -24.265  -8.850  12.494
  348    HG3  MET  44           HG3      MET  44 -25.957  -6.461  13.169
  349    HE1  MET  44           HE1      MET  44 -24.914  -5.476  15.343
  350    HE2  MET  44           HE2      MET  44 -23.544  -6.326  16.052
  351    HE3  MET  44           HE3      MET  44 -25.125  -6.416  16.827
  352    H    GLU  45           H        GLU  45 -22.308  -8.204   9.676
  353    HA   GLU  45           HA       GLU  45 -23.528  -9.426   7.421
  354    HB3  GLU  45           HB3      GLU  45 -20.784 -10.093   8.486
  355    HG3  GLU  45           HG3      GLU  45 -21.968 -11.200   6.426
  356    H    LYS  46           H        LYS  46 -21.941 -10.831  10.297
  357    HA   LYS  46           HA       LYS  46 -23.275 -13.393   9.710
  358    HB3  LYS  46           HB3      LYS  46 -21.146 -13.047  11.797
  359    HG3  LYS  46           HG3      LYS  46 -20.616 -15.362  11.081
  360    HD3  LYS  46           HD3      LYS  46 -23.590 -15.248  11.522
  361    HE3  LYS  46           HE3      LYS  46 -22.367 -17.421  11.451
  362    HZ1  LYS  46           HZ1      LYS  46 -20.504 -17.729  12.605
  363    HZ2  LYS  46           HZ2      LYS  46 -21.128 -16.998  14.006
  364    HZ3  LYS  46           HZ3      LYS  46 -20.449 -16.043  12.775