*HEADER    RECEPTOR                                26-FEB-10   2RQZ              
*TITLE     STRUCTURE OF SUGAR MODIFIED EPIDERMAL GROWTH FACTOR-LIKE REPEAT 12 OF 
*TITLE    2 MOUSE NOTCH-1 RECEPTOR                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEUROGENIC LOCUS NOTCH HOMOLOG PROTEIN 1;                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: EXTRACELLULAR DOMAIN EGF-LIKE REPEAT 12;                   
*COMPND   5 SYNONYM: NOTCH 1, MOTCH A, MT14, P300;                               
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   4 ORGANISM_COMMON: MOUSE;                                              
*SOURCE   5 ORGANISM_TAXID: 10090;                                               
*SOURCE   6 OTHER_DETAILS: SYNTHETIC PEPTIDE                                     
*KEYWDS    NOTCH, GLYCOPEPTIDE, O-LINKED FUCOSE, ACTIVATOR, FRINGE, ANK REPEAT,  
*KEYWDS   2 DEVELOPMENTAL PROTEIN, DIFFERENTIATION, EGF-LIKE DOMAIN,             
*KEYWDS   3 GLYCOPROTEIN, METAL-BINDING, NOTCH SIGNALING PATHWAY, NUCLEUS,       
*KEYWDS   4 PHOSPHORYLATION, RECEPTOR, TRANSCRIPTION, TRANSCRIPTION REGULATION,  
*KEYWDS   5 TRANSMEMBRANE, CELL MEMBRANE, DISULFIDE BOND, PHOSPHOPROTEIN         
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    K.SHIMIZU, N.FUJITANI, K.HOSOGUCHI, S.NISHIMURA                       
*REVDAT   1   13-OCT-10 2RQZ    0                                                

assign (segid A and resid 1 and name HA)(segid A and resid 2 and name HN) 4.0 2.4 1.0
assign (segid A and resid 1 and name HA)(segid A and resid 1 and name HB1) 4.0 2.4 2.0
assign (segid A and resid 1 and name HA)(segid A and resid 1 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 1 and name HB2)(segid A and resid 1 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 2 and name HA)(segid A and resid 2 and name HN) 4.0 2.4 1.0
assign (segid A and resid 2 and name HA)(segid A and resid 2 and name HB) 3.0 1.4 0.5
assign (segid A and resid 2 and name HA)(segid A and resid 2 and name HG#) 4.0 2.4 1.0
assign (segid A and resid 2 and name HB)(segid A and resid 2 and name HN) 4.0 2.4 2.0
assign (segid A and resid 2 and name HG#)(segid A and resid 2 and name HN) 4.0 2.4 2.0
assign (segid A and resid 3 and name HA)(segid A and resid 3 and name HN) 4.0 2.4 2.0
assign (segid A and resid 3 and name HA)(segid A and resid 3 and name HB#) 4.0 2.4 1.0
assign (segid A and resid 3 and name HB#)(segid A and resid 3 and name HD22) 3.0 1.4 0.5
assign (segid A and resid 3 and name HD22)(segid A and resid 3 and name HD21) 2.4 0.8 0.2
assign (segid A and resid 3 and name HB#)(segid A and resid 3 and name HN) 4.0 2.4 1.0
assign (segid A and resid 3 and name HD21)(segid A and resid 3 and name HB#) 4.0 2.4 2.0
assign (segid A and resid 3 and name HN)(segid A and resid 2 and name HA) 2.4 0.8 0.2
assign (segid A and resid 3 and name HA)(segid A and resid 4 and name HN) 4.0 2.4 2.0
assign (segid A and resid 4 and name HA)(segid A and resid 4 and name HN) 4.0 2.4 2.0
assign (segid A and resid 4 and name HA)(segid A and resid 4 and name HG2) 4.0 2.4 2.0
assign (segid A and resid 4 and name HA)(segid A and resid 4 and name HG1) 4.0 2.4 2.0
assign (segid A and resid 4 and name HA)(segid A and resid 4 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 4 and name HA)(segid A and resid 4 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 4 and name HB1)(segid A and resid 4 and name HN) 4.0 2.4 2.0
assign (segid A and resid 4 and name HB1)(segid A and resid 4 and name HG2) 3.0 1.4 0.5
assign (segid A and resid 4 and name HN)(segid A and resid 4 and name HB2) 4.0 2.4 2.0
assign (segid A and resid 4 and name HB2)(segid A and resid 23 and name HD#) 4.0 2.4 2.0
assign (segid A and resid 4 and name HB1)(segid A and resid 23 and name HD#) 4.0 2.4 2.0
assign (segid A and resid 4 and name HA)(segid A and resid 5 and name HN) 3.0 1.4 0.5   ! overlapped C5HA-HN
assign (segid A and resid 5 and name HA)(segid A and resid 5 and name HN) 4.0 2.4 1.0
assign (segid A and resid 5 and name HA)(segid A and resid 5 and name HB1) 2.4 0.8 0.5
assign (segid A and resid 5 and name HA)(segid A and resid 5 and name HB2) 2.4 0.8 0.5
assign (segid A and resid 5 and name HB2)(segid A and resid 5 and name HN) 3.0 1.4 0.5
assign (segid A and resid 5 and name HB1)(segid A and resid 5 and name HN) 4.0 2.4 1.0    ! overlapped Q24H-F23HB3
assign (segid A and resid 5 and name HA)(segid A and resid 6 and name HN) 3.0 1.4 0.5
assign (segid A and resid 5 and name HA)(segid A and resid 9 and name HD2) 4.0 2.4 1.0
assign (segid A and resid 5 and name HA)(segid A and resid 9 and name HD1) 4.0 2.4 1.0
assign (segid A and resid 5 and name HB2)(segid A and resid 16 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 5 and name HB2)(segid A and resid 6 and name HN) 4.0 2.4 2.0
assign (segid A and resid 5 and name HB1)(segid A and resid 6 and name HN) 4.0 2.4 2.0
assign (segid A and resid 5 and name HN)(segid A and resid 6 and name HN) 4.0 2.4 1.0
assign (segid A and resid 5 and name HN)(segid A and resid 4 and name HG2) 4.0 2.4 2.0
assign (segid A and resid 6 and name HA)(segid A and resid 6 and name HB) 2.4 0.8 0.5 
assign (segid A and resid 6 and name HA)(segid A and resid 6 and name HD1#) 3.0 1.4 0.5
assign (segid A and resid 6 and name HA)(segid A and resid 6 and name HG12) 4.0 2.4 1.0
assign (segid A and resid 6 and name HA)(segid A and resid 6 and name HG11) 4.0 2.4 1.0
assign (segid A and resid 6 and name HA)(segid A and resid 6 and name HG2#) 3.0 1.4 0.5
assign (segid A and resid 6 and name HB)(segid A and resid 6 and name HN) 2.4 0.8 0.5
assign (segid A and resid 6 and name HB)(segid A and resid 6 and name HG12) 3.0 1.4 0.5
assign (segid A and resid 6 and name HB)(segid A and resid 6 and name HG2#) 2.4 0.8 0.5
assign (segid A and resid 6 and name HG11)(segid A and resid 6 and name HN) 4.0 2.4 1.0
assign (segid A and resid 6 and name HG11)(segid A and resid 6 and name HB) 4.0 2.4 1.0
assign (segid A and resid 6 and name HG11)(segid A and resid 6 and name HG12) 2.4 0.8 0.2
assign (segid A and resid 6 and name HG12)(segid A and resid 6 and name HN) 4.0 2.4 1.0
assign (segid A and resid 6 and name HN)(segid A and resid 6 and name HA) 3.0 1.4 0.5
assign (segid A and resid 6 and name HN)(segid A and resid 6 and name HG2#) 4.0 2.4 1.0
assign (segid A and resid 6 and name HG12)(segid A and resid 7 and name HN) 4.0 2.4 2.0
assign (segid A and resid 6 and name HG2#)(segid A and resid 7 and name HN) 4.0 2.4 1.0
assign (segid A and resid 7 and name HA)(segid A and resid 7 and name HN) 2.4 0.8 0.5
assign (segid A and resid 7 and name HA)(segid A and resid 7 and name HB#) 2.4 0.8 0.5
assign (segid A and resid 7 and name HB#)(segid A and resid 7 and name HN) 2.4 0.8 0.2
assign (segid A and resid 7 and name HA)(segid A and resid 8 and name HN) 2.4 0.8 0.2
assign (segid A and resid 7 and name HA)(segid A and resid 8 and name HB2) 4.0 2.4 2.0
assign (segid A and resid 7 and name HB#)(segid A and resid 6 and name HG2#) 4.0 2.4 1.0
assign (segid A and resid 7 and name HN)(segid A and resid 6 and name HN) 3.0 1.4 0.5
assign (segid A and resid 7 and name HN)(segid A and resid 6 and name HA) 3.0 1.4 0.5
assign (segid A and resid 7 and name HN)(segid A and resid 8 and name HN) 3.0 1.4 0.5
assign (segid A and resid 8 and name HA)(segid A and resid 8 and name HN) 2.4 0.8 0.5
assign (segid A and resid 8 and name HA)(segid A and resid 8 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 8 and name HA)(segid A and resid 8 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 8 and name HB2)(segid A and resid 8 and name HN) 3.0 1.4 0.5
assign (segid A and resid 8 and name HB2)(segid A and resid 8 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 8 and name HB2)(segid A and resid 8 and name HD21) 3.0 1.4 0.5
assign (segid A and resid 8 and name HB2)(segid A and resid 8 and name HD22) 3.0 1.4 0.5
assign (segid A and resid 8 and name HB1)(segid A and resid 8 and name HD21) 3.0 1.4 0.5
assign (segid A and resid 8 and name HB1)(segid A and resid 8 and name HD22) 3.0 1.4 0.5
assign (segid A and resid 8 and name HN)(segid A and resid 8 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 8 and name HA)(segid A and resid 9 and name HD2) 2.4 0.8 0.5
assign (segid A and resid 8 and name HA)(segid A and resid 9 and name HD1) 2.4 0.8 0.5
assign (segid A and resid 8 and name HD22)(segid A and resid 8 and name HD21) 2.4 0.8 0.2
assign (segid A and resid 8 and name HN)(segid A and resid 9 and name HD2) 4.0 2.4 1.0   ! overlapped N8H-S7HB#
assign (segid A and resid 8 and name HN)(segid A and resid 7 and name HB#) 4.0 2.4 1.0   ! overlapped N8H-P9HD2
assign (segid A and resid 9 and name HA)(segid A and resid 10 and name HN) 4.0 2.4 1.0
assign (segid A and resid 9 and name HA)(segid A and resid 9 and name HG2) 4.0 2.4 2.0
assign (segid A and resid 9 and name HA)(segid A and resid 9 and name HB1) 2.4 0.8 0.5
assign (segid A and resid 9 and name HG2)(segid A and resid 23 and name HD#) 4.0 2.4 2.0
assign (segid A and resid 9 and name HG2)(segid A and resid 9 and name HG1) 2.4 0.8 0.2
assign (segid A and resid 9 and name HG2)(segid A and resid 9 and name HD2) 3.0 1.4 0.5
assign (segid A and resid 9 and name HG2)(segid A and resid 9 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 9 and name HG2)(segid A and resid 9 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 9 and name HD2)(segid A and resid 9 and name HG1) 3.0 1.4 0.5
assign (segid A and resid 9 and name HD2)(segid A and resid 9 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 9 and name HD2)(segid A and resid 9 and name HD1) 2.4 0.8 0.2
assign (segid A and resid 9 and name HD2)(segid A and resid 9 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 9 and name HD1)(segid A and resid 10 and name HN) 4.0 2.4 1.0
assign (segid A and resid 9 and name HD1)(segid A and resid 9 and name HG2) 3.0 1.4 0.5
assign (segid A and resid 9 and name HD1)(segid A and resid 9 and name HG1) 3.0 1.4 0.5
assign (segid A and resid 9 and name HD1)(segid A and resid 9 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 9 and name HD1)(segid A and resid 8 and name HN) 4.0 2.4 1.0
assign (segid A and resid 9 and name HB2)(segid A and resid 9 and name HA) 2.4 0.8 0.5
assign (segid A and resid 9 and name HB2)(segid A and resid 9 and name HG1) 2.4 0.8 0.5
assign (segid A and resid 9 and name HB2)(segid A and resid 9 and name HD1) 4.0 2.4 1.0
assign (segid A and resid 9 and name HB2)(segid A and resid 9 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 9 and name HB1)(segid A and resid 9 and name HG1) 3.0 1.4 0.5
assign (segid A and resid 9 and name HB1)(segid A and resid 35 and name HE#) 4.0 2.4 1.0
assign (segid A and resid 10 and name HA)(segid A and resid 14 and name HB#) 4.0 2.4 2.0
assign (segid A and resid 10 and name HA)(segid A and resid 10 and name HN) 3.0 1.4 0.5
assign (segid A and resid 10 and name HA)(segid A and resid 10 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 10 and name HA)(segid A and resid 10 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 10 and name HA)(segid A and resid 11 and name HN) 3.0 1.4 0.5
assign (segid A and resid 10 and name HA)(segid A and resid 11 and name HG#) 4.0 2.4 2.0
assign (segid A and resid 10 and name HA)(segid A and resid 35 and name HD#) 4.0 2.4 1.0
assign (segid A and resid 10 and name HB2)(segid A and resid 14 and name HB#) 3.0 1.4 0.5
assign (segid A and resid 10 and name HB2)(segid A and resid 10 and name HN) 3.0 1.4 0.5
assign (segid A and resid 10 and name HB2)(segid A and resid 10 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 10 and name HB1)(segid A and resid 10 and name HN) 4.0 2.4 1.0
assign (segid A and resid 10 and name HN)(segid A and resid 9 and name HG2) 4.0 2.4 2.0
assign (segid A and resid 10 and name HN)(segid A and resid 9 and name HD2) 3.0 1.4 0.5
assign (segid A and resid 11 and name HA)(segid A and resid 11 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 11 and name HA)(segid A and resid 11 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 11 and name HA)(segid A and resid 11 and name HG#) 3.0 1.4 0.5
assign (segid A and resid 11 and name HA)(segid A and resid 12 and name HN) 3.0 1.4 0.5
assign (segid A and resid 11 and name HB2)(segid A and resid 11 and name HN) 4.0 2.4 1.0
assign (segid A and resid 11 and name HB2)(segid A and resid 11 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 11 and name HB2)(segid A and resid 11 and name HG#) 3.0 1.4 0.5
assign (segid A and resid 11 and name HB1)(segid A and resid 12 and name HN) 4.0 2.4 1.0
assign (segid A and resid 11 and name HB1)(segid A and resid 11 and name HN) 3.0 1.4 0.5
assign (segid A and resid 11 and name HB1)(segid A and resid 11 and name HG#) 3.0 1.4 0.5
assign (segid A and resid 11 and name HB1)(segid A and resid 12 and name HD22) 4.0 2.4 2.0
assign (segid A and resid 11 and name HN)(segid A and resid 10 and name HB2) 4.0 2.4 2.0
assign (segid A and resid 11 and name HN)(segid A and resid 10 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 11 and name HN)(segid A and resid 36 and name HB2) 4.0 2.4 2.0
assign (segid A and resid 11 and name HE21)(segid A and resid 11 and name HE22) 2.4 0.8 0.2
assign (segid A and resid 11 and name HE21)(segid A and resid 11 and name HG#) 4.0 2.4 2.0
assign (segid A and resid 11 and name HG#)(segid A and resid 11 and name HN) 4.0 2.4 1.0
assign (segid A and resid 11 and name HG#)(segid A and resid 11 and name HE22) 4.0 2.4 1.0
assign (segid A and resid 11 and name HG#)(segid A and resid 12 and name HN) 4.0 2.4 2.0
assign (segid A and resid 11 and name HN)(segid A and resid 35 and name HD#) 4.0 2.4 2.0
assign (segid A and resid 12 and name HA)(segid A and resid 13 and name HN) 3.0 1.4 0.5
assign (segid A and resid 12 and name HA)(segid A and resid 12 and name HN) 2.4 0.8 0.5
assign (segid A and resid 12 and name HA)(segid A and resid 12 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 12 and name HB2)(segid A and resid 12 and name HN) 3.0 1.4 0.5 ! overlapped N12H-Q11HB2
assign (segid A and resid 12 and name HB2)(segid A and resid 12 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 12 and name HB2)(segid A and resid 12 and name HD22) 3.0 1.4 0.5  ! overlapped Q11HB2-N12HD22  
assign (segid A and resid 12 and name HB1)(segid A and resid 12 and name HN) 4.0 2.4 2.0
assign (segid A and resid 12 and name HB1)(segid A and resid 12 and name HA) 3.0 1.4 0.5
assign (segid A and resid 12 and name HB1)(segid A and resid 12 and name HD21) 4.0 2.4 1.0
assign (segid A and resid 12 and name HB1)(segid A and resid 12 and name HD22) 3.0 1.4 0.5
assign (segid A and resid 12 and name HD21)(segid A and resid 12 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 12 and name HD21)(segid A and resid 12 and name HD22) 2.4 0.8 0.2
assign (segid A and resid 12 and name HD21)(segid A and resid 11 and name HB1) 4.0 2.4 2.0
assign (segid A and resid 12 and name HD21)(segid A and resid 31 and name HD#) 4.0 2.4 2.0
assign (segid A and resid 12 and name HD21)(segid A and resid 31 and name HE#) 4.0 2.4 2.0 
assign (segid A and resid 12 and name HD22)(segid A and resid 31 and name HD#) 4.0 2.4 1.0
assign (segid A and resid 12 and name HD22)(segid A and resid 31 and name HE#) 4.0 2.4 2.0
assign (segid A and resid 13 and name HA)(segid A and resid 14 and name HN) 2.4 0.8 0.5
assign (segid A and resid 13 and name HA)(segid A and resid 13 and name HN) 2.4 0.8 0.2
assign (segid A and resid 13 and name HA)(segid A and resid 13 and name HB2) 2.4 0.8 0.5
assign (segid A and resid 13 and name HB2)(segid A and resid 14 and name HN) 4.0 2.4 2.0
assign (segid A and resid 13 and name HB2)(segid A and resid 13 and name HN) 4.0 2.4 2.0
assign (segid A and resid 13 and name HB1)(segid A and resid 14 and name HN) 4.0 2.4 2.0
assign (segid A and resid 13 and name HB1)(segid A and resid 13 and name HN) 4.0 2.4 2.0
assign (segid A and resid 13 and name HB1)(segid A and resid 13 and name HA) 3.0 1.4 0.5
assign (segid A and resid 13 and name HB1)(segid A and resid 13 and name HB2) 2.4 0.8 0.2
assign (segid A and resid 13 and name HN)(segid A and resid 12 and name HN) 4.0 2.4 2.0
assign (segid A and resid 14 and name HA)(segid A and resid 14 and name HN) 2.4 0.8 0.5
assign (segid A and resid 14 and name HA)(segid A and resid 15 and name HB) 4.0 2.4 1.0
assign (segid A and resid 14 and name HB#)(segid A and resid 10 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 14 and name HB#)(segid A and resid 25 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 14 and name HB#)(segid A and resid 13 and name HN) 4.0 2.4 1.0
assign (segid A and resid 14 and name HB#)(segid A and resid 14 and name HA) 2.4 0.8 0.5
assign (segid A and resid 14 and name HB#)(segid A and resid 15 and name HN) 3.0 1.4 0.5
assign (segid A and resid 14 and name HN)(segid A and resid 10 and name HB1) 4.0 2.4 2.0
assign (segid A and resid 14 and name HN)(segid A and resid 13 and name HN) 2.4 0.8 0.5
assign (segid A and resid 14 and name HN)(segid A and resid 14 and name HB#) 2.4 0.8 0.5
assign (segid A and resid 15 and name HN)(segid A and resid 14 and name HN) 4.0 2.4 1.0
assign (segid A and resid 15 and name HN)(segid A and resid 14 and name HA) 2.4 0.8 0.5
assign (segid A and resid 15 and name HA)(segid A and resid 16 and name HN) 3.0 1.4 0.5
assign (segid A and resid 15 and name HA)(segid A and resid 16 and name HB2) 4.0 2.4 2.0
assign (segid A and resid 15 and name HA)(segid A and resid 16 and name HB1) 4.0 2.4 2.0
assign (segid A and resid 15 and name HA)(segid A and resid 15 and name HN) 4.0 2.4 1.0
assign (segid A and resid 15 and name HA)(segid A and resid 15 and name HB) 4.0 2.4 1.0
assign (segid A and resid 15 and name HA)(segid A and resid 15 and name HG2#) 4.0 2.4 1.0
assign (segid A and resid 15 and name HB)(segid A and resid 26 and name HB) 2.4 0.8 0.5
assign (segid A and resid 15 and name HG2#)(segid A and resid 15 and name HB) 2.4 0.8 0.5
assign (segid A and resid 15 and name HG2#)(segid A and resid 26 and name HB) 4.0 2.4 1.0
assign (segid A and resid 15 and name HG2#)(segid A and resid 17 and name HB#) 4.0 2.4 2.0
assign (segid A and resid 15 and name HN)(segid A and resid 15 and name HB) 2.4 0.8 0.5
assign (segid A and resid 15 and name HN)(segid A and resid 15 and name HG2#) 4.0 2.4 1.0
assign (segid A and resid 15 and name HN)(segid A and resid 26 and name HG2#) 4.0 2.4 2.0  !overlapped I20
assign (segid A and resid 16 and name HA)(segid A and resid 25 and name HA) 4.0 2.4 1.0
assign (segid A and resid 16 and name HA)(segid A and resid 16 and name HN) 4.0 2.4 1.0
assign (segid A and resid 16 and name HA)(segid A and resid 16 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 16 and name HA)(segid A and resid 16 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 16 and name HA)(segid A and resid 17 and name HB#) 4.0 2.4 2.0
assign (segid A and resid 16 and name HB2)(segid A and resid 16 and name HN) 3.0 1.4 0.5
assign (segid A and resid 16 and name HN)(segid A and resid 16 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 16 and name HN)(segid A and resid 15 and name HG2#) 3.0 1.4 0.5  
assign (segid A and resid 17 and name HA)(segid A and resid 17 and name HB#) 4.0 2.4 1.0
assign (segid A and resid 17 and name HA)(segid A and resid 18 and name HN) 3.0 1.4 0.5
assign (segid A and resid 17 and name HB#)(segid A and resid 18 and name HN) 4.0 2.4 1.0
assign (segid A and resid 17 and name HB#)(segid A and resid 17 and name HD1#) 3.0 1.4 0.5
assign (segid A and resid 17 and name HB#)(segid A and resid 17 and name HD2#) 4.0 2.4 2.0
assign (segid A and resid 17 and name HB#)(segid A and resid 17 and name HG) 2.4 0.8 0.5
assign (segid A and resid 17 and name HB#)(segid A and resid 26 and name HD1#) 4.0 2.4 2.0
assign (segid A and resid 17 and name HB#)(segid A and resid 19 and name HG2) 4.0 2.4 2.0
assign (segid A and resid 17 and name HB#)(segid A and resid 24 and name HB1) 4.0 2.4 2.0
assign (segid A and resid 17 and name HN)(segid A and resid 16 and name HA) 2.4 0.8 0.5
assign (segid A and resid 17 and name HN)(segid A and resid 16 and name HB2) 4.0 2.4 2.0  
assign (segid A and resid 17 and name HN)(segid A and resid 16 and name HB1) 4.0 2.4 2.0  
assign (segid A and resid 17 and name HN)(segid A and resid 25 and name HA) 4.0 2.4 2.0
assign (segid A and resid 17 and name HN)(segid A and resid 17 and name HB#) 2.4 0.8 0.5
assign (segid A and resid 17 and name HN)(segid A and resid 17 and name HG) 4.0 2.4 2.0
assign (segid A and resid 17 and name HN)(segid A and resid 24 and name HN) 4.0 2.4 2.0
assign (segid A and resid 18 and name HA)(segid A and resid 23 and name HA) 4.0 2.4 1.0  
assign (segid A and resid 18 and name HA)(segid A and resid 18 and name HN) 4.0 2.4 1.0
assign (segid A and resid 18 and name HA)(segid A and resid 18 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 18 and name HA)(segid A and resid 18 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 18 and name HA)(segid A and resid 19 and name HN) 2.4 0.8 0.2
assign (segid A and resid 18 and name HB2)(segid A and resid 18 and name HN) 3.0 1.4 0.5
assign (segid A and resid 18 and name HB2)(segid A and resid 18 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 18 and name HB1)(segid A and resid 18 and name HN) 3.0 1.4 0.5
assign (segid A and resid 19 and name HA)(segid A and resid 19 and name HN) 4.0 2.4 1.0
assign (segid A and resid 19 and name HA)(segid A and resid 19 and name HB#) 4.0 2.4 1.0
assign (segid A and resid 19 and name HA)(segid A and resid 19 and name HG2) 3.0 1.4 0.5
assign (segid A and resid 19 and name HA)(segid A and resid 19 and name HG1) 3.0 1.4 0.5
assign (segid A and resid 19 and name HA)(segid A and resid 20 and name HN) 3.0 1.4 0.5
assign (segid A and resid 19 and name HB#)(segid A and resid 19 and name HN) 4.0 2.4 1.0
assign (segid A and resid 19 and name HB#)(segid A and resid 20 and name HN) 4.0 2.4 2.0
assign (segid A and resid 19 and name HN)(segid A and resid 18 and name HN) 4.0 2.4 2.0  
assign (segid A and resid 19 and name HE22)(segid A and resid 19 and name HE21) 2.4 0.8 0.2
assign (segid A and resid 19 and name HG2)(segid A and resid 19 and name HN) 4.0 2.4 1.0
assign (segid A and resid 19 and name HG2)(segid A and resid 19 and name HE22) 4.0 2.4 1.0
assign (segid A and resid 19 and name HG2)(segid A and resid 19 and name HG1) 2.4 0.8 0.2
assign (segid A and resid 19 and name HN)(segid A and resid 20 and name HN) 4.0 2.4 2.0
assign (segid A and resid 20 and name HA)(segid A and resid 21 and name HN) 3.0 1.4 0.5
assign (segid A and resid 20 and name HA)(segid A and resid 20 and name HN) 2.4 0.8 0.5
assign (segid A and resid 20 and name HA)(segid A and resid 20 and name HB) 3.0 1.4 0.5
assign (segid A and resid 20 and name HA)(segid A and resid 20 and name HG2#) 3.0 1.4 0.5
assign (segid A and resid 20 and name HG12)(segid A and resid 20 and name HN) 4.0 2.4 1.0
assign (segid A and resid 20 and name HG12)(segid A and resid 20 and name HB) 4.0 2.4 1.0
assign (segid A and resid 20 and name HG12)(segid A and resid 20 and name HG11) 2.4 0.8 0.5
assign (segid A and resid 20 and name HG11)(segid A and resid 20 and name HD1#) 3.0 1.4 0.5
assign (segid A and resid 20 and name HG2#)(segid A and resid 20 and name HN) 4.0 2.4 1.0
assign (segid A and resid 20 and name HN)(segid A and resid 20 and name HB) 3.0 1.4 0.5
assign (segid A and resid 21 and name HA2)(segid A and resid 22 and name HN) 4.0 2.4 1.0 
assign (segid A and resid 21 and name HA2)(segid A and resid 21 and name HN) 4.0 2.4 1.0 
assign (segid A and resid 21 and name HA2)(segid A and resid 21 and name HA1) 2.4 0.8 0.2
assign (segid A and resid 21 and name HA1)(segid A and resid 21 and name HN) 3.0 1.4 0.5
assign (segid A and resid 22 and name HA)(segid A and resid 23 and name HN) 2.4 0.8 0.2
assign (segid A and resid 22 and name HA)(segid A and resid 23 and name HD#) 4.0 2.4 2.0 
assign (segid A and resid 22 and name HA)(segid A and resid 22 and name HN) 3.0 1.4 0.5 
assign (segid A and resid 22 and name HA)(segid A and resid 22 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 22 and name HA)(segid A and resid 22 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 22 and name HA)(segid A and resid 22 and name HG#) 4.0 2.4 1.0
assign (segid A and resid 22 and name HB2)(segid A and resid 22 and name HN) 4.0 2.4 2.0 
assign (segid A and resid 22 and name HN)(segid A and resid 21 and name HN) 3.0 1.4 0.5
assign (segid A and resid 22 and name HG#)(segid A and resid 23 and name HN) 4.0 2.4 1.0 
assign (segid A and resid 22 and name HG#)(segid A and resid 21 and name HN) 4.0 2.4 2.0   
assign (segid A and resid 22 and name HG#)(segid A and resid 22 and name HN) 3.0 1.4 0.5
assign (segid A and resid 22 and name HB1)(segid A and resid 23 and name HN) 3.0 1.4 0.5 
assign (segid A and resid 22 and name HB1)(segid A and resid 22 and name HN) 4.0 2.4 2.0 
assign (segid A and resid 23 and name HA)(segid A and resid 23 and name HN) 2.4 0.8 0.5
assign (segid A and resid 23 and name HA)(segid A and resid 23 and name HB2) 2.4 0.8 0.5
assign (segid A and resid 23 and name HA)(segid A and resid 23 and name HD#) 3.0 1.4 0.5
assign (segid A and resid 23 and name HA)(segid A and resid 19 and name HN) 4.0 2.4 2.0 
assign (segid A and resid 23 and name HA)(segid A and resid 24 and name HN) 2.4 0.8 0.5
assign (segid A and resid 23 and name HB2)(segid A and resid 5 and name HN) 4.0 2.4 1.0  ! C5-NH = Q24-NH attention
assign (segid A and resid 23 and name HB1)(segid A and resid 5 and name HN) 4.0 2.4 1.0
assign (segid A and resid 23 and name HB2)(segid A and resid 23 and name HN) 4.0 2.4 1.0 
assign (segid A and resid 23 and name HB1)(segid A and resid 23 and name HN) 3.0 1.4 0.5
assign (segid A and resid 23 and name HB1)(segid A and resid 23 and name HA) 2.4 0.8 0.5
assign (segid A and resid 23 and name HE#)(segid A and resid 9 and name HG1) 4.0 2.4 2.0 
assign (segid A and resid 23 and name HN)(segid A and resid 22 and name HB2) 4.0 2.4 2.0 
assign (segid A and resid 23 and name HD#)(segid A and resid 23 and name HN) 3.0 1.4 0.5
assign (segid A and resid 23 and name HD#)(segid A and resid 23 and name HE#) 2.4 0.8 0.2
assign (segid A and resid 23 and name HD#)(segid A and resid 23 and name HZ) 4.0 2.4 1.0
assign (segid A and resid 23 and name HD#)(segid A and resid 24 and name HA) 4.0 2.4 1.0
assign (segid A and resid 23 and name HD#)(segid A and resid 24 and name HN) 4.0 2.4 1.0
assign (segid A and resid 24 and name HA)(segid A and resid 25 and name HN) 3.0 1.4 0.5 
assign (segid A and resid 24 and name HA)(segid A and resid 24 and name HN) 4.0 2.4 1.0 
assign (segid A and resid 24 and name HA)(segid A and resid 24 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 24 and name HA)(segid A and resid 24 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 24 and name HA)(segid A and resid 24 and name HG#) 4.0 2.4 2.0 
assign (segid A and resid 24 and name HB2)(segid A and resid 17 and name HB#) 4.0 2.4 2.0 
assign (segid A and resid 24 and name HB2)(segid A and resid 24 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 24 and name HE22)(segid A and resid 24 and name HE21) 2.4 0.8 0.2
assign (segid A and resid 24 and name HE22)(segid A and resid 24 and name HG#) 4.0 2.4 2.0
assign (segid A and resid 24 and name HN)(segid A and resid 23 and name HN) 4.0 2.4 2.0
assign (segid A and resid 24 and name HN)(segid A and resid 24 and name HB2) 4.0 2.4 2.0
assign (segid A and resid 24 and name HN)(segid A and resid 24 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 24 and name HN)(segid A and resid 17 and name HB#) 4.0 2.4 2.0
assign (segid A and resid 25 and name HA)(segid A and resid 14 and name HB#) 4.0 2.4 2.0
assign (segid A and resid 25 and name HA)(segid A and resid 25 and name HN) 4.0 2.4 1.0
assign (segid A and resid 25 and name HA)(segid A and resid 26 and name HN) 2.4 0.8 0.5
assign (segid A and resid 25 and name HB2)(segid A and resid 14 and name HB#) 4.0 2.4 2.0
assign (segid A and resid 25 and name HB2)(segid A and resid 25 and name HN) 3.0 1.4 0.5
assign (segid A and resid 25 and name HB2)(segid A and resid 25 and name HA) 4.0 2.4 1.0
assign (segid A and resid 25 and name HB1)(segid A and resid 25 and name HN) 4.0 2.4 1.0
assign (segid A and resid 25 and name HB1)(segid A and resid 25 and name HA) 3.0 1.4 0.5
assign (segid A and resid 25 and name HB1)(segid A and resid 25 and name HB2) 2.4 0.8 0.5
assign (segid A and resid 26 and name HN)(segid A and resid 14 and name HB#) 4.0 2.4 2.0
assign (segid A and resid 26 and name HA)(segid A and resid 27 and name HB1) 4.0 2.4 2.0
assign (segid A and resid 26 and name HA)(segid A and resid 26 and name HB) 4.0 2.4 1.0
assign (segid A and resid 26 and name HA)(segid A and resid 26 and name HD1#) 4.0 2.4 2.0
assign (segid A and resid 26 and name HA)(segid A and resid 26 and name HG12) 4.0 2.4 1.0
assign (segid A and resid 26 and name HA)(segid A and resid 26 and name HG11) 4.0 2.4 1.0
assign (segid A and resid 26 and name HA)(segid A and resid 26 and name HG2#) 3.0 1.4 0.5
assign (segid A and resid 26 and name HB)(segid A and resid 26 and name HD1#) 3.0 1.4 0.5
assign (segid A and resid 26 and name HB)(segid A and resid 26 and name HG12) 3.0 1.4 0.5
assign (segid A and resid 26 and name HB)(segid A and resid 26 and name HG2#) 3.0 1.4 0.5
assign (segid A and resid 26 and name HB)(segid A and resid 15 and name HN) 4.0 2.4 1.0
assign (segid A and resid 26 and name HN)(segid A and resid 25 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 26 and name HD1#)(segid A and resid 26 and name HG12) 3.0 1.4 0.5
assign (segid A and resid 26 and name HD1#)(segid A and resid 26 and name HG11) 3.0 1.4 0.5
assign (segid A and resid 26 and name HD1#)(segid A and resid 26 and name HG2#) 3.0 1.4 0.5
assign (segid A and resid 26 and name HD1#)(segid A and resid 17 and name HG) 4.0 2.4 2.0   
assign (segid A and resid 26 and name HD1#)(segid A and resid 15 and name HG2#) 4.0 1.4 2.0
assign (segid A and resid 26 and name HG11)(segid A and resid 26 and name HB) 3.0 1.4 0.5
assign (segid A and resid 26 and name HG11)(segid A and resid 26 and name HG12) 2.4 0.8 0.2
assign (segid A and resid 26 and name HG2#)(segid A and resid 26 and name HG12) 3.0 1.4 0.5
assign (segid A and resid 26 and name HN)(segid A and resid 26 and name HB) 3.0 1.4 0.5
assign (segid A and resid 26 and name HN)(segid A and resid 26 and name HD1#) 4.0 2.4 2.0   
assign (segid A and resid 26 and name HN)(segid A and resid 26 and name HG12) 4.0 2.4 1.0
assign (segid A and resid 26 and name HN)(segid A and resid 26 and name HG11) 4.0 2.4 2.0
assign (segid A and resid 26 and name HN)(segid A and resid 26 and name HG2#) 4.0 2.4 2.0
assign (segid A and resid 26 and name HN)(segid A and resid 15 and name HN) 4.0 2.4 2.0
assign (segid A and resid 26 and name HN)(segid A and resid 15 and name HB) 4.0 2.4 2.0
assign (segid A and resid 27 and name HA)(segid A and resid 14 and name HB#) 4.0 2.4 1.0
assign (segid A and resid 27 and name HA)(segid A and resid 27 and name HN) 4.0 2.4 1.0
assign (segid A and resid 27 and name HA)(segid A and resid 27 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 27 and name HA)(segid A and resid 27 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 27 and name HA)(segid A and resid 28 and name HN) 3.0 1.4 0.5
assign (segid A and resid 27 and name HB2)(segid A and resid 36 and name HB1) 4.0 2.4 2.0
assign (segid A and resid 27 and name HB2)(segid A and resid 27 and name HN) 4.0 2.4 1.0
assign (segid A and resid 27 and name HB2)(segid A and resid 27 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 27 and name HB2)(segid A and resid 31 and name HB2) 4.0 2.4 1.0  
assign (segid A and resid 27 and name HB2)(segid A and resid 31 and name HB1) 4.0 2.4 1.0   
assign (segid A and resid 27 and name HB1)(segid A and resid 27 and name HN) 3.0 1.4 0.5
assign (segid A and resid 27 and name HB1)(segid A and resid 28 and name HN) 4.0 2.4 2.0
assign (segid A and resid 27 and name HB1)(segid A and resid 31 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 27 and name HB1)(segid A and resid 31 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 27 and name HN)(segid A and resid 26 and name HA) 2.4 0.8 0.2
assign (segid A and resid 27 and name HN)(segid A and resid 26 and name HG2#) 4.0 2.4 1.0
assign (segid A and resid 28 and name HA)(segid A and resid 28 and name HN) 4.0 2.4 2.0
assign (segid A and resid 28 and name HA)(segid A and resid 28 and name HG1) 4.0 2.4 2.0
assign (segid A and resid 28 and name HA)(segid A and resid 28 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 28 and name HA)(segid A and resid 29 and name HB1) 4.0 2.4 2.0
assign (segid A and resid 28 and name HA(segid A and resid 29 and name HD2) 2.4 0.8 0.5
assign (segid A and resid 28 and name HA(segid A and resid 29 and name HD1) 3.0 1.4 0.5
assign (segid A and resid 28 and name HA)(segid A and resid 28 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 28 and name HG1)(segid A and resid 28 and name HN) 4.0 2.4 1.0
assign (segid A and resid 28 and name HG1)(segid A and resid 28 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 28 and name HG1)(segid A and resid 28 and name HG2) 2.4 0.8 0.2
assign (segid A and resid 28 and name HG1)(segid A and resid 28 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 28 and name HB1)(segid A and resid 28 and name HN) 4.0 2.4 1.0
assign (segid A and resid 28 and name HB1)(segid A and resid 28 and name HG2) 3.0 1.4 0.5
assign (segid A and resid 28 and name HB1)(segid A and resid 28 and name HB2) 2.4 0.8 0.2
assign (segid A and resid 28 and name HB1)(segid A and resid 31 and name HD#) 3.0 1.4 0.5  
assign (segid A and resid 28 and name HN)(segid A and resid 27 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 28 and name HG2)(segid A and resid 28 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 28 and name HN)(segid A and resid 28 and name HG2) 4.0 2.4 1.0
assign (segid A and resid 28 and name HN)(segid A and resid 28 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 28 and name HN)(segid A and resid 31 and name HB1) 4.0 2.4 2.0   
assign (segid A and resid 28 and name HN)(segid A and resid 31 and name HB2) 4.0 2.4 2.0   
assign (segid A and resid 28 and name HE#)(segid A and resid 28 and name HG2) 3.0 1.4 0.5
assign (segid A and resid 29 and name HA)(segid A and resid 30 and name HN) 2.4 0.8 0.5
assign (segid A and resid 29 and name HA)(segid A and resid 30 and name HA1) 4.0 2.4 1.0
assign (segid A and resid 29 and name HA)(segid A and resid 29 and name HB2) 2.4 0.8 0.2
assign (segid A and resid 29 and name HA)(segid A and resid 29 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 29 and name HA)(segid A and resid 29 and name HG2) 4.0 2.4 1.0
assign (segid A and resid 29 and name HA)(segid A and resid 29 and name HG1) 4.0 2.4 1.0
assign (segid A and resid 29 and name HA)(segid A and resid 31 and name HN) 4.0 2.4 1.0
assign (segid A and resid 29 and name HB2)(segid A and resid 30 and name HN) 4.0 2.4 1.0
assign (segid A and resid 29 and name HB2)(segid A and resid 29 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 29 and name HB2)(segid A and resid 29 and name HG2) 2.4 0.8 0.5
assign (segid A and resid 29 and name HD2)(segid A and resid 28 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 29 and name HD2)(segid A and resid 28 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 29 and name HD2)(segid A and resid 28 and name HE#) 4.0 2.4 1.0
assign (segid A and resid 29 and name HD1)(segid A and resid 28 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 29 and name HD1)(segid A and resid 28 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 29 and name HD1)(segid A and resid 28 and name HE#) 3.0 1.4 0.5
assign (segid A and resid 29 and name HG1)(segid A and resid 29 and name HG2) 2.4 0.8 0.2
assign (segid A and resid 30 and name HA2)(segid A and resid 30 and name HA1) 2.4 0.8 0.2
assign (segid A and resid 30 and name HA2)(segid A and resid 31 and name HN) 4.0 2.4 1.0
assign (segid A and resid 30 and name HA1)(segid A and resid 30 and name HN) 3.0 1.4 0.5
assign (segid A and resid 30 and name HN)(segid A and resid 30 and name HA2) 3.0 1.4 0.5
assign (segid A and resid 31 and name HA)(segid A and resid 32 and name HN) 3.0 1.4 0.5
assign (segid A and resid 31 and name HA)(segid A and resid 31 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 31 and name HA)(segid A and resid 31 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 31 and name HA)(segid A and resid 31 and name HD#) 3.0 1.4 0.5
assign (segid A and resid 31 and name HA)(segid A and resid 31 and name HE#) 4.0 2.4 2.0
assign (segid A and resid 31 and name HA)(segid A and resid 31 and name HN) 3.0 1.4 0.5
assign (segid A and resid 31 and name HD#)(segid A and resid 27 and name HB2) 4.0 2.4 2.0  
assign (segid A and resid 31 and name HD#)(segid A and resid 31 and name HN) 4.0 2.4 1.0
assign (segid A and resid 31 and name HD#)(segid A and resid 28 and name HN) 4.0 2.4 2.0
assign (segid A and resid 31 and name HD#)(segid A and resid 28 and name HB2) 4.0 2.4 1.0  
assign (segid A and resid 31 and name HE#)(segid A and resid 31 and name HD#) 2.4 0.8 0.2
assign (segid A and resid 31 and name HE#)(segid A and resid 28 and name HB1) 4.0 2.4 2.0
assign (segid A and resid 31 and name HN)(segid A and resid 30 and name HN) 3.0 1.4 0.5
assign (segid A and resid 31 and name HN)(segid A and resid 30 and name HA1) 4.0 2.4 1.0
assign (segid A and resid 31 and name HN)(segid A and resid 31 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 31 and name HN)(segid A and resid 31 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 32 and name HA)(segid A and resid 33 and name HN) 2.4 0.8 0.5
assign (segid A and resid 32 and name HA)(segid A and resid 32 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 32 and name HA)(segid A and resid 32 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 32 and name HA)(segid A and resid 32 and name HG#) 4.0 2.4 1.0
assign (segid A and resid 32 and name HB2)(segid A and resid 33 and name HN) 3.0 1.4 0.5
assign (segid A and resid 32 and name HG#)(segid A and resid 33 and name HN) 4.0 2.4 1.0
assign (segid A and resid 32 and name HN)(segid A and resid 32 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 32 and name HN)(segid A and resid 32 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 32 and name HN)(segid A and resid 38 and name HB) 4.0 2.4 1.0
assign (segid A and resid 32 and name HN)(segid A and resid 31 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 32 and name HN)(segid A and resid 31 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 32 and name HN)(segid A and resid 31 and name HD#) 4.0 2.4 1.0
assign (segid A and resid 33 and name HA2)(segid A and resid 36 and name HN) 4.0 2.4 1.0
assign (segid A and resid 33 and name HA2)(segid A and resid 33 and name HN) 4.0 2.4 1.0
assign (segid A and resid 33 and name HA2)(segid A and resid 33 and name HA1) 2.4 0.8 0.2
assign (segid A and resid 33 and name HA2)(segid A and resid 38 and name HD1#) 4.0 2.4 2.0
assign (segid A and resid 33 and name HA1)(segid A and resid 33 and name HN) 3.0 1.4 0.5
assign (segid A and resid 33 and name HA1)(segid A and resid 38 and name HD1#) 4.0 2.4 2.0
assign (segid A and resid 33 and name HN)(segid A and resid 32 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 34 and name HA)(segid A and resid 33 and name HA1) 4.0 2.4 2.0
assign (segid A and resid 34 and name HB)(segid A and resid 34 and name HA) 3.0 1.4 0.5
assign (segid A and resid 34 and name HB)(segid A and resid 35 and name HN) 4.0 2.4 1.0
assign (segid A and resid 34 and name HG1#)(segid A and resid 23 and name HE#) 4.0 2.4 2.0
assign (segid A and resid 34 and name HG1#)(segid A and resid 23 and name HZ) 4.0 2.4 2.0
assign (segid A and resid 34 and name HG1#)(segid A and resid 35 and name HD#) 4.0 2.4 2.0
assign (segid A and resid 34 and name HG1#)(segid A and resid 35 and name HE#) 4.0 2.4 2.0
assign (segid A and resid 34 and name HG2#)(segid A and resid 34 and name HA) 4.0 2.4 1.0
assign (segid A and resid 34 and name HG2#)(segid A and resid 34 and name HN) 3.0 1.4 0.5
assign (segid A and resid 34 and name HN)(segid A and resid 33 and name HN) 4.0 2.4 2.0
assign (segid A and resid 34 and name HN)(segid A and resid 33 and name HA1) 2.4 0.8 0.5
assign (segid A and resid 34 and name HN)(segid A and resid 34 and name HA) 2.4 0.8 0.5
assign (segid A and resid 34 and name HN)(segid A and resid 34 and name HB) 2.4 0.8 0.5
assign (segid A and resid 34 and name HN)(segid A and resid 35 and name HN) 3.0 1.4 0.5
assign (segid A and resid 35 and name HA)(segid A and resid 35 and name HN) 4.0 2.4 1.0
assign (segid A and resid 35 and name HA)(segid A and resid 35 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 35 and name HA)(segid A and resid 35 and name HD#) 3.0 1.4 0.5
assign (segid A and resid 35 and name HB2)(segid A and resid 37 and name HB1) 4.0 2.4 2.0
assign (segid A and resid 35 and name HB2)(segid A and resid 35 and name HN) 4.0 2.4 1.0
assign (segid A and resid 35 and name HB2)(segid A and resid 35 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 35 and name HB2)(segid A and resid 11 and name HN) 4.0 2.4 2.0   
assign (segid A and resid 35 and name HB2)(segid A and resid 11 and name HG#) 4.0 2.4 1.0
assign (segid A and resid 35 and name HB1)(segid A and resid 37 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 35 and name HB1)(segid A and resid 35 and name HA) 3.0 1.4 0.5
assign (segid A and resid 35 and name HB1)(segid A and resid 35 and name HD#) 3.0 1.4 0.5
assign (segid A and resid 35 and name HB1)(segid A and resid 11 and name HG#) 4.0 2.4 2.0
assign (segid A and resid 35 and name HD#)(segid A and resid 23 and name HE#) 4.0 2.4 2.0
assign (segid A and resid 35 and name HD#)(segid A and resid 35 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 35 and name HD#)(segid A and resid 9 and name HB2) 4.0 2.4 2.0
assign (segid A and resid 35 and name HD#)(segid A and resid 9 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 35 and name HD#)(segid A and resid 34 and name HB) 4.0 2.4 2.0
assign (segid A and resid 35 and name HE#)(segid A and resid 23 and name HD#) 4.0 2.4 1.0
assign (segid A and resid 35 and name HE#)(segid A and resid 23 and name HZ) 3.0 1.4 0.5
assign (segid A and resid 35 and name HE#)(segid A and resid 35 and name HD#) 2.4 0.8 0.2
assign (segid A and resid 35 and name HE#)(segid A and resid 9 and name HG2) 4.0 2.4 2.0
assign (segid A and resid 35 and name HE#)(segid A and resid 9 and name HB2) 4.0 2.4 2.0
assign (segid A and resid 35 and name HE#)(segid A and resid 34 and name HB) 4.0 2.4 2.0
assign (segid A and resid 35 and name HN)(segid A and resid 35 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 35 and name HN)(segid A and resid 34 and name HA) 4.0 2.4 2.0
assign (segid A and resid 36 and name HA)(segid A and resid 36 and name HN) 2.4 0.8 0.2
assign (segid A and resid 36 and name HA)(segid A and resid 36 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 36 and name HA)(segid A and resid 36 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 36 and name HA)(segid A and resid 31 and name HD#) 4.0 2.4 2.0   
assign (segid A and resid 36 and name HA)(segid A and resid 35 and name HN) 4.0 2.4 2.0
assign (segid A and resid 36 and name HB2)(segid A and resid 14 and name HB#) 4.0 2.4 1.0
assign (segid A and resid 36 and name HB2)(segid A and resid 36 and name HN) 4.0 2.4 2.0
assign (segid A and resid 36 and name HB2)(segid A and resid 36 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 36 and name HB1)(segid A and resid 14 and name HB#) 4.0 2.4 1.0
assign (segid A and resid 36 and name HB1)(segid A and resid 36 and name HN) 4.0 2.4 1.0
assign (segid A and resid 36 and name HN)(segid A and resid 35 and name HN) 2.4 0.8 0.5
assign (segid A and resid 37 and name HA)(segid A and resid 37 and name HB2) 3.0 1.4 0.5
assign (segid A and resid 37 and name HA)(segid A and resid 37 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 37 and name HA)(segid A and resid 37 and name HG2) 4.0 2.4 1.0
assign (segid A and resid 37 and name HA)(segid A and resid 37 and name HG1) 4.0 2.4 1.0
assign (segid A and resid 37 and name HA)(segid A and resid 12 and name HD21) 2.4 0.8 0.5
assign (segid A and resid 37 and name HA)(segid A and resid 12 and name HD22) 3.0 1.4 0.5
assign (segid A and resid 37 and name HA)(segid A and resid 11 and name HB2) 4.0 2.4 1.0
assign (segid A and resid 37 and name HA)(segid A and resid 11 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 37 and name HA)(segid A and resid 11 and name HG#) 4.0 2.4 2.0
assign (segid A and resid 37 and name HB2)(segid A and resid 37 and name HB1) 2.4 0.8 0.2
assign (segid A and resid 37 and name HB2)(segid A and resid 37 and name HG2) 3.0 1.4 0.5
assign (segid A and resid 37 and name HB2)(segid A and resid 35 and name HB1) 4.0 2.4 1.0
assign (segid A and resid 37 and name HG2)(segid A and resid 37 and name HB1) 3.0 1.4 0.5
assign (segid A and resid 37 and name HG2)(segid A and resid 38 and name HG1#) 4.0 2.4 2.0   
assign (segid A and resid 37 and name HG1)(segid A and resid 37 and name HG2#) 2.4 0.8 0.2
assign (segid A and resid 38 and name HA)(segid A and resid 38 and name HB) 4.0 2.4 1.0
assign (segid A and resid 38 and name HA)(segid A and resid 38 and name HD1#) 3.0 1.4 0.5
assign (segid A and resid 38 and name HA)(segid A and resid 38 and name HG1#) 4.0 2.4 1.0
assign (segid A and resid 38 and name HA)(segid A and resid 38 and name HG2#) 4.0 2.4 1.0   
assign (segid A and resid 38 and name HB)(segid A and resid 38 and name HG1#) 3.0 1.4 0.5
assign (segid A and resid 38 and name HB)(segid A and resid 38 and name HG2#) 3.0 1.4 0.5
assign (segid A and resid 38 and name HD1#)(segid A and resid 37 and name HB2) 4.0 2.4 2.0
assign (segid A and resid 38 and name HG1#)(segid A and resid 37 and name HG1) 4.0 2.4 2.0
assign (segid A and resid 38 and name HG1#)(segid A and resid 38 and name HN) 4.0 2.4 1.0
assign (segid A and resid 38 and name HG1#)(segid A and resid 38 and name HG2#) 3.0 1.4 0.5
assign (segid A and resid 38 and name HN)(segid A and resid 38 and name HA) 4.0 2.4 1.0
assign (segid A and resid 38 and name HN)(segid A and resid 38 and name HB) 3.0 1.4 0.5
assign (segid A and resid 14 and name HA)(segid B and resid 1 and name H6#) 4.0 2.4 2.0
assign (segid A and resid 15 and name HN)(segid B and resid 1 and name H1) 4.0 2.4 2.0
assign (segid A and resid 15 and name HG2#)(segid B and resid 1 and name H1) 2.4 0.8 0.5
assign (segid A and resid 15 and name HB)(segid B and resid 1 and name H1) 2.4 0.8 0.2
assign (segid A and resid 15 and name HG2#)(segid B and resid 1 and name H2) 4.0 2.4 2.0
assign (segid A and resid 14 and name HB#)(segid B and resid 1 and name H5) 4.0 2.4 2.0
assign (segid A and resid 15 and name HN)(segid B and resid 1 and name H5) 3.0 1.4 0.5
assign (segid A and resid 28 and name HA)(segid B and resid 1 and name H6#) 3.0 1.4 0.5
assign (segid A and resid 28 and name HG1)(segid B and resid 1 and name H6#) 4.0 2.4 1.0
assign (segid A and resid 28 and name HG2)(segid B and resid 1 and name H6#) 4.0 2.4 2.0
assign (segid B and resid 1 and name H2)(segid B and resid 2 and name H1) 4.0 2.4 1.0
assign (segid B and resid 1 and name H3)(segid B and resid 2 and name H1) 2.4 0.8 0.2
assign (segid B and resid 1 and name H4)(segid B and resid 2 and name H1) 2.4 0.8 0.2
assign (segid B and resid 2 and name H1)(segid B and resid 2 and name HN2) 3.0 1.4 0.5
assign (segid B and resid 2 and name H3)(segid B and resid 2 and name HN2) 3.0 1.4 0.5
assign (segid B and resid 1 and name H4)(segid B and resid 2 and name HN2) 4.0 2.4 1.0
assign (segid A and resid 17 and name N)(segid A and resid 24 and name O) 2.8 0.4 0.5
assign (segid A and resid 17 and name NH)(segid A and resid 24 and name O) 1.8 0.4 0.5
assign (segid A and resid 15 and name N)(segid A and resid 26 and name O) 2.8 0.4 0.5
assign (segid A and resid 15 and name NH)(segid A and resid 26 and name O) 1.8 0.4 0.5
assign (segid A and resid 26 and name N)(segid A and resid 15 and name O) 2.8 0.4 0.5
assign (segid A and resid 26 and name NH)(segid A and resid 15 and name O) 1.8 0.4 0.5
!
! B-CHAIN ; FUC NAG

! 39 FUC (B1)

assign ( segid B and resid 1 and name C2) ( segid B and resid 1 and name C3)
       ( segid B and resid 1 and name C4) ( segid B and resid 1 and name C5) 1.0 -60.0 10.0 2
assign ( segid B and resid 1 and name C4) ( segid B and resid 1 and name C5)
       ( segid B and resid 1 and name O5) ( segid B and resid 1 and name C1) 1.0 -60.0 10.0 2
assign ( segid B and resid 1 and name C1) ( segid B and resid 1 and name C2)
       ( segid B and resid 1 and name C3) ( segid B and resid 1 and name C4) 1.0 60.0 10.0 2
assign ( segid B and resid 1 and name C3) ( segid B and resid 1 and name C4)
       ( segid B and resid 1 and name C5) ( segid B and resid 1 and name O5) 1.0 60.0 10.0 2
assign ( segid B and resid 1 and name C5) ( segid B and resid 1 and name O5)
       ( segid B and resid 1 and name C1) ( segid B and resid 1 and name O2) 1.0 60.0 10.0 2
assign ( segid B and resid 1 and name O5) ( segid B and resid 1 and name C1)
       ( segid B and resid 1 and name C2) ( segid B and resid 1 and name C3) 1.0 -60.0 10.0 2
assign ( segid B and resid 1 and name H5) ( segid B and resid 1 and name C5)
       ( segid B and resid 1 and name C4) ( segid B and resid 1 and name O4) 1.0 180.0 10.0 2
assign ( segid B and resid 1 and name H3) ( segid B and resid 1 and name C3)
       ( segid B and resid 1 and name C4) ( segid B and resid 1 and name O4) 1.0 180.0 10.0 2
assign ( segid B and resid 1 and name H2) ( segid B and resid 1 and name C2)
       ( segid B and resid 1 and name C1) ( segid B and resid 1 and name O5) 1.0 60.0 10.0 2
! 40 NAG (B2)

assign ( segid B and resid 2 and name C2) ( segid B and resid 2 and name C3)
       ( segid B and resid 2 and name C4) ( segid B and resid 2 and name C5) 1.0 60.0 10.0 2
assign ( segid B and resid 2 and name C4) ( segid B and resid 2 and name C5)
       ( segid B and resid 2 and name O5) ( segid B and resid 2 and name C1) 1.0 60.0 10.0 2
assign ( segid B and resid 2 and name C1) ( segid B and resid 2 and name C2)
       ( segid B and resid 2 and name C3) ( segid B and resid 2 and name C4) 1.0 -60.0 10.0 2
assign ( segid B and resid 2 and name C3) ( segid B and resid 2 and name C4)
       ( segid B and resid 2 and name C5) ( segid B and resid 2 and name O5) 1.0 -60.0 10.0 2
assign ( segid B and resid 2 and name C5) ( segid B and resid 2 and name O5)
       ( segid B and resid 2 and name C1) ( segid B and resid 2 and name C2) 1.0 -60.0 10.0 2
assign ( segid B and resid 2 and name O5) ( segid B and resid 2 and name C1)
       ( segid B and resid 2 and name C2) ( segid B and resid 2 and name C3) 1.0 60.0 10.0 2
assign ( segid B and resid 2 and name HN2) (segid B and resid 2 and name N2)
       ( segid B and resid 2 and name C7) ( segid B and resid 2 and name O7) 1.0 180.0 10.0 2
assign ( segid B and resid 2 and name C2) ( segid B and resid 2 and name N2)
       ( segid B and resid 2 and name C7) ( segid B and resid 2 and name C8) 1.0 180.0 10.0 2
assign ( segid B and resid 2 and name HN2) ( segid B and resid 2 and name N2)
       ( segid B and resid 2 and name C2) ( segid B and resid 2 and name H2) 1.0 180.0 90.0 2
!
! A-CHAIN (38AA)
!
!!! PHI angle(C'-N-CA-C)
assign ( segid A and resid 5 and name C)( segid A and resid 6 and name N) ( segid A and resid 6 and name CA)( segid A and resid 6 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 6 and name C)( segid A and resid 7 and name N) ( segid A and resid 7 and name CA)( segid A and resid 7 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 11 and name C)( segid A and resid 12 and name N) ( segid A and resid 12 and name CA)( segid A and resid 12 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 18 and name C)( segid A and resid 19 and name N) ( segid A and resid 19 and name CA)( segid A and resid 19 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 22 and name C)( segid A and resid 23 and name N) ( segid A and resid 23 and name CA)( segid A and resid 23 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 23 and name C)( segid A and resid 24 and name N) ( segid A and resid 24 and name CA)( segid A and resid 24 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 24 and name C)( segid A and resid 25 and name N) ( segid A and resid 25 and name CA)( segid A and resid 25 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 30 and name C)( segid A and resid 31 and name N) ( segid A and resid 31 and name CA)( segid A and resid 31 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 34 and name C)( segid A and resid 35 and name N) ( segid A and resid 35 and name CA)( segid A and resid 35 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 37 and name C)( segid A and resid 38 and name N) ( segid A and resid 38 and name CA)( segid A and resid 38 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 4 and name C)( segid A and resid 5 and name N) ( segid A and resid 5 and name CA)( segid A and resid 5 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 3 and name C)( segid A and resid 4 and name N) ( segid A and resid 4 and name CA)( segid A and resid 4 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 25 and name C)( segid A and resid 26 and name N) ( segid A and resid 26 and name CA)( segid A and resid 26 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 14 and name C)( segid A and resid 15 and name N) ( segid A and resid 15 and name CA)( segid A and resid 15 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 15 and name C)( segid A and resid 16 and name N) ( segid A and resid 16 and name CA)( segid A and resid 16 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 19 and name C)( segid A and resid 20 and name N) ( segid A and resid 20 and name CA)( segid A and resid 20 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 33 and name C)( segid A and resid 34 and name N) ( segid A and resid 34 and name CA)( segid A and resid 34 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 21 and name C)( segid A and resid 22 and name N) ( segid A and resid 22 and name CA)( segid A and resid 22 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 10 and name C)( segid A and resid 11 and name N) ( segid A and resid 11 and name CA)( segid A and resid 11 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 13 and name C)( segid A and resid 14 and name N) ( segid A and resid 14 and name CA)( segid A and resid 14 and name C) 1.0 -120.0 30.0 2
assign ( segid A and resid 31 and name C)( segid A and resid 32 and name N) ( segid A and resid 32 and name CA)( segid A and resid 32 and name C) 1.0 -120.0 30.0 2



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ASP   1           H1       ASP   1  -6.226  13.599  -0.028
    2    HA   ASP   1           HA       ASP   1  -6.936  13.644   2.352
    3    HB2  ASP   1           HB2      ASP   1  -9.349  13.368   2.786
    4    HB3  ASP   1           HB3      ASP   1  -9.007  14.869   1.931
    5    H    VAL   2           H        VAL   2  -7.732  11.696   3.516
    6    HA   VAL   2           HA       VAL   2  -7.770   9.442   3.837
    7    HB   VAL   2           HB       VAL   2  -8.570   9.210   0.936
    8   HG11  VAL   2          HG11      VAL   2  -9.725   7.171   1.738
    9   HG12  VAL   2          HG12      VAL   2  -8.998   7.421   3.326
   10   HG13  VAL   2          HG13      VAL   2  -7.973   7.097   1.928
   11   HG21  VAL   2          HG21      VAL   2 -10.317  10.495   1.529
   12   HG22  VAL   2          HG22      VAL   2 -10.030  10.264   3.254
   13   HG23  VAL   2          HG23      VAL   2 -10.895   9.034   2.331
   14    H    ASN   3           H        ASN   3  -6.395   7.682   3.678
   15    HA   ASN   3           HA       ASN   3  -4.144   8.013   1.804
   16    HB2  ASN   3           HB2      ASN   3  -4.146   6.765   4.561
   17    HB3  ASN   3           HB3      ASN   3  -2.754   6.858   3.487
   18   HD21  ASN   3          HD21      ASN   3  -2.721   7.899   6.041
   19   HD22  ASN   3          HD22      ASN   3  -2.616   9.620   5.948
   20    H    GLU   4           H        GLU   4  -2.890   5.706   1.840
   21    HA   GLU   4           HA       GLU   4  -4.917   3.752   0.977
   22    HB2  GLU   4           HB2      GLU   4  -2.648   4.806  -0.361
   23    HB3  GLU   4           HB3      GLU   4  -2.309   3.113  -0.024
   24    HG2  GLU   4           HG2      GLU   4  -4.746   4.161  -1.446
   25    HG3  GLU   4           HG3      GLU   4  -3.337   3.430  -2.215
   26    H    CYS   5           H        CYS   5  -1.978   4.227   2.829
   27    HA   CYS   5           HA       CYS   5  -2.023   1.430   3.691
   28    HB2  CYS   5           HB2      CYS   5   0.125   2.401   2.910
   29    HB3  CYS   5           HB3      CYS   5   0.048   3.544   4.241
   30    H    ILE   6           H        ILE   6  -3.879   1.607   5.029
   31    HA   ILE   6           HA       ILE   6  -3.579   3.289   7.412
   32    HB   ILE   6           HB       ILE   6  -6.031   1.763   6.601
   33   HG12  ILE   6          HG12      ILE   6  -5.387   3.365   4.827
   34   HG13  ILE   6          HG13      ILE   6  -6.888   3.822   5.624
   35   HG21  ILE   6          HG21      ILE   6  -5.497   3.971   8.566
   36   HG22  ILE   6          HG22      ILE   6  -6.115   2.351   8.887
   37   HG23  ILE   6          HG23      ILE   6  -7.120   3.526   8.040
   38   HD11  ILE   6          HD11      ILE   6  -5.826   5.836   5.529
   39   HD12  ILE   6          HD12      ILE   6  -4.222   5.125   5.703
   40   HD13  ILE   6          HD13      ILE   6  -5.278   5.269   7.108
   41    H    SER   7           H        SER   7  -4.980   0.093   6.747
   42    HA   SER   7           HA       SER   7  -3.820  -0.848   9.277
   43    HB2  SER   7           HB2      SER   7  -6.401  -0.870   8.756
   44    HB3  SER   7           HB3      SER   7  -5.998  -2.334   7.859
   45    HG   SER   7           HG       SER   7  -5.322  -1.871  10.576
   46    H    ASN   8           H        ASN   8  -1.946  -0.858   7.475
   47    HA   ASN   8           HA       ASN   8  -0.439  -2.111   6.323
   48    HB2  ASN   8           HB2      ASN   8  -0.469  -3.467   8.356
   49    HB3  ASN   8           HB3      ASN   8  -1.850  -4.371   7.754
   50   HD21  ASN   8          HD21      ASN   8  -0.010  -5.941   8.436
   51   HD22  ASN   8          HD22      ASN   8   0.947  -6.512   7.124
   52    HA   PRO   9           HA       PRO   9  -3.379  -2.867   2.864
   53    HB2  PRO   9           HB2      PRO   9  -1.479  -2.250   0.960
   54    HB3  PRO   9           HB3      PRO   9  -2.587  -1.084   1.687
   55    HG2  PRO   9           HG2      PRO   9   0.266  -1.664   2.353
   56    HG3  PRO   9           HG3      PRO   9  -0.577  -0.105   2.286
   57    HD2  PRO   9           HD2      PRO   9  -0.033  -1.324   4.618
   58    HD3  PRO   9           HD3      PRO   9  -1.521  -0.385   4.381
   59    H    CYS  10           H        CYS  10  -0.052  -3.949   3.315
   60    HA   CYS  10           HA       CYS  10  -0.002  -5.940   1.344
   61    HB2  CYS  10           HB2      CYS  10   1.439  -6.115   3.989
   62    HB3  CYS  10           HB3      CYS  10   1.925  -6.804   2.446
   63    H    GLN  11           H        GLN  11  -0.177  -8.245   1.554
   64    HA   GLN  11           HA       GLN  11  -2.012  -9.086   3.703
   65    HB2  GLN  11           HB2      GLN  11  -2.234  -9.320   0.780
   66    HB3  GLN  11           HB3      GLN  11  -2.573 -10.808   1.653
   67    HG2  GLN  11           HG2      GLN  11  -3.870  -8.217   2.407
   68    HG3  GLN  11           HG3      GLN  11  -4.520  -9.247   1.132
   69   HE21  GLN  11          HE21      GLN  11  -3.824  -8.999   4.544
   70   HE22  GLN  11          HE22      GLN  11  -4.863 -10.282   5.050
   71    H    ASN  12           H        ASN  12   0.892  -9.299   3.653
   72    HA   ASN  12           HA       ASN  12   1.061 -12.158   4.129
   73    HB2  ASN  12           HB2      ASN  12   2.476 -10.765   1.919
   74    HB3  ASN  12           HB3      ASN  12   3.391 -11.962   2.825
   75   HD21  ASN  12          HD21      ASN  12   3.037 -12.441   0.271
   76   HD22  ASN  12          HD22      ASN  12   1.884 -13.695   0.025
   77    H    ASP  13           H        ASP  13   1.288  -9.468   5.563
   78    HA   ASP  13           HA       ASP  13   2.378  -8.726   7.420
   79    HB2  ASP  13           HB2      ASP  13   2.763 -11.403   7.569
   80    HB3  ASP  13           HB3      ASP  13   4.433 -10.859   7.433
   81    H    ALA  14           H        ALA  14   3.034  -7.711   4.971
   82    HA   ALA  14           HA       ALA  14   5.937  -7.555   4.816
   83    HB1  ALA  14           HB1      ALA  14   5.478  -7.424   2.650
   84    HB2  ALA  14           HB2      ALA  14   4.790  -5.825   2.931
   85    HB3  ALA  14           HB3      ALA  14   3.755  -7.252   2.981
   86    H    THR  15           H        THR  15   6.927  -5.371   4.514
   87    HA   THR  15           HA       THR  15   5.976  -3.604   6.621
   88    HB   THR  15           HB       THR  15   8.522  -3.582   4.985
   89   HG21  THR  15          HG21      THR  15   9.403  -1.927   6.412
   90   HG22  THR  15          HG22      THR  15   7.998  -1.992   7.476
   91   HG23  THR  15          HG23      THR  15   7.843  -1.323   5.851
   92    H    CYS  16           H        CYS  16   5.023  -1.691   6.299
   93    HA   CYS  16           HA       CYS  16   4.598  -0.827   3.536
   94    HB2  CYS  16           HB2      CYS  16   2.678  -1.184   5.184
   95    HB3  CYS  16           HB3      CYS  16   3.237   0.279   5.990
   96    H    LEU  17           H        LEU  17   5.428   1.004   2.728
   97    HA   LEU  17           HA       LEU  17   6.814   2.824   4.587
   98    HB2  LEU  17           HB2      LEU  17   7.782   1.410   2.250
   99    HB3  LEU  17           HB3      LEU  17   7.997   3.143   2.076
  100    HG   LEU  17           HG       LEU  17   9.009   1.511   4.406
  101   HD11  LEU  17          HD11      LEU  17  10.172   2.206   1.782
  102   HD12  LEU  17          HD12      LEU  17  10.492   0.833   2.842
  103   HD13  LEU  17          HD13      LEU  17  11.220   2.401   3.187
  104   HD21  LEU  17          HD21      LEU  17   8.422   4.004   4.689
  105   HD22  LEU  17          HD22      LEU  17   9.836   4.296   3.677
  106   HD23  LEU  17          HD23      LEU  17  10.011   3.447   5.213
  107    H    ASP  18           H        ASP  18   7.449   4.866   2.925
  108    HA   ASP  18           HA       ASP  18   4.808   5.954   2.284
  109    HB2  ASP  18           HB2      ASP  18   7.405   7.116   3.141
  110    HB3  ASP  18           HB3      ASP  18   6.408   8.098   2.072
  111    H    GLN  19           H        GLN  19   4.345   6.930   0.312
  112    HA   GLN  19           HA       GLN  19   6.338   6.806  -1.810
  113    HB2  GLN  19           HB2      GLN  19   4.056   4.984  -1.566
  114    HB3  GLN  19           HB3      GLN  19   4.130   5.806  -3.117
  115    HG2  GLN  19           HG2      GLN  19   6.735   4.980  -2.660
  116    HG3  GLN  19           HG3      GLN  19   5.743   3.641  -2.087
  117   HE21  GLN  19          HE21      GLN  19   6.696   2.461  -3.857
  118   HE22  GLN  19          HE22      GLN  19   6.031   2.615  -5.443
  119    H    ILE  20           H        ILE  20   5.076   7.548  -3.964
  120    HA   ILE  20           HA       ILE  20   4.000  10.158  -3.284
  121    HB   ILE  20           HB       ILE  20   4.110  10.485  -5.802
  122   HG12  ILE  20          HG12      ILE  20   6.047   8.242  -5.933
  123   HG13  ILE  20          HG13      ILE  20   4.340   7.815  -5.962
  124   HG21  ILE  20          HG21      ILE  20   5.805  11.586  -4.759
  125   HG22  ILE  20          HG22      ILE  20   6.754  10.402  -5.657
  126   HG23  ILE  20          HG23      ILE  20   6.396  10.133  -3.951
  127   HD11  ILE  20          HD11      ILE  20   5.493   8.136  -8.192
  128   HD12  ILE  20          HD12      ILE  20   5.503   9.859  -7.820
  129   HD13  ILE  20          HD13      ILE  20   3.971   8.995  -7.952
  130    H    GLY  21           H        GLY  21   1.884   9.964  -2.713
  131    HA2  GLY  21           HA2      GLY  21  -0.377   9.675  -2.967
  132    HA3  GLY  21           HA3      GLY  21  -0.076   9.753  -4.695
  133    H    GLU  22           H        GLU  22   1.509   7.274  -2.891
  134    HA   GLU  22           HA       GLU  22  -0.565   5.310  -3.445
  135    HB2  GLU  22           HB2      GLU  22   2.220   5.067  -4.599
  136    HB3  GLU  22           HB3      GLU  22   0.969   3.832  -4.673
  137    HG2  GLU  22           HG2      GLU  22  -0.395   5.779  -5.812
  138    HG3  GLU  22           HG3      GLU  22   1.223   6.374  -6.181
  139    H    PHE  23           H        PHE  23   0.494   3.016  -2.838
  140    HA   PHE  23           HA       PHE  23   1.620   3.407  -0.161
  141    HB2  PHE  23           HB2      PHE  23   0.760   1.128   0.312
  142    HB3  PHE  23           HB3      PHE  23  -0.507   2.264  -0.143
  143    HD1  PHE  23           HD1      PHE  23   1.550  -0.553  -1.319
  144    HD2  PHE  23           HD2      PHE  23  -1.824   1.926  -2.067
  145    HE1  PHE  23           HE1      PHE  23   0.818  -2.095  -3.095
  146    HE2  PHE  23           HE2      PHE  23  -2.565   0.391  -3.844
  147    HZ   PHE  23           HZ       PHE  23  -1.243  -1.623  -4.360
  148    H    GLN  24           H        GLN  24   3.206   1.872   0.621
  149    HA   GLN  24           HA       GLN  24   4.843   0.724  -1.543
  150    HB2  GLN  24           HB2      GLN  24   5.608   2.834  -0.038
  151    HB3  GLN  24           HB3      GLN  24   6.200   1.517   0.963
  152    HG2  GLN  24           HG2      GLN  24   6.822   1.423  -1.931
  153    HG3  GLN  24           HG3      GLN  24   7.661   2.622  -0.948
  154   HE21  GLN  24          HE21      GLN  24   9.494   1.982  -0.089
  155   HE22  GLN  24          HE22      GLN  24   9.944   0.352   0.264
  156    H    CYS  25           H        CYS  25   3.912  -1.326  -1.280
  157    HA   CYS  25           HA       CYS  25   4.106  -2.622   1.318
  158    HB2  CYS  25           HB2      CYS  25   2.600  -3.045  -1.144
  159    HB3  CYS  25           HB3      CYS  25   3.280  -4.539  -0.511
  160    H    ILE  26           H        ILE  26   6.064  -3.341   1.865
  161    HA   ILE  26           HA       ILE  26   7.889  -4.345  -0.172
  162    HB   ILE  26           HB       ILE  26   8.398  -4.143   2.793
  163   HG12  ILE  26          HG12      ILE  26   9.081  -2.096   0.674
  164   HG13  ILE  26          HG13      ILE  26   7.716  -1.952   1.777
  165   HG21  ILE  26          HG21      ILE  26  10.769  -4.002   2.013
  166   HG22  ILE  26          HG22      ILE  26  10.196  -4.389   0.391
  167   HG23  ILE  26          HG23      ILE  26   9.984  -5.549   1.701
  168   HD11  ILE  26          HD11      ILE  26   9.628  -2.306   3.577
  169   HD12  ILE  26          HD12      ILE  26   9.236  -0.720   2.913
  170   HD13  ILE  26          HD13      ILE  26  10.611  -1.625   2.281
  171    H    CYS  27           H        CYS  27   7.145  -6.341  -0.785
  172    HA   CYS  27           HA       CYS  27   6.222  -8.309   1.042
  173    HB2  CYS  27           HB2      CYS  27   7.254  -8.815  -1.746
  174    HB3  CYS  27           HB3      CYS  27   6.072  -9.750  -0.843
  175    H    MET  28           H        MET  28   7.288 -10.595   0.866
  176    HA   MET  28           HA       MET  28   9.819 -10.408   2.148
  177    HB2  MET  28           HB2      MET  28   7.814 -12.428   1.674
  178    HB3  MET  28           HB3      MET  28   9.415 -13.080   1.360
  179    HG2  MET  28           HG2      MET  28   9.940 -11.897   3.670
  180    HG3  MET  28           HG3      MET  28   8.208 -12.135   3.894
  181    HE1  MET  28           HE1      MET  28  11.281 -14.879   5.096
  182    HE2  MET  28           HE2      MET  28  11.305 -13.149   4.753
  183    HE3  MET  28           HE3      MET  28  11.736 -14.304   3.491
  184    HA   PRO  29           HA       PRO  29  12.643 -11.022  -1.188
  185    HB2  PRO  29           HB2      PRO  29  14.403 -12.839  -0.312
  186    HB3  PRO  29           HB3      PRO  29  14.281 -11.235   0.418
  187    HG2  PRO  29           HG2      PRO  29  13.155 -13.840   1.374
  188    HG3  PRO  29           HG3      PRO  29  13.967 -12.565   2.302
  189    HD2  PRO  29           HD2      PRO  29  11.255 -12.855   2.200
  190    HD3  PRO  29           HD3      PRO  29  12.061 -11.295   2.459
  191    H    GLY  30           H        GLY  30  11.510 -11.874  -2.909
  192    HA2  GLY  30           HA2      GLY  30  11.659 -13.606  -4.566
  193    HA3  GLY  30           HA3      GLY  30  11.786 -14.783  -3.268
  194    H    TYR  31           H        TYR  31   9.445 -12.214  -3.114
  195    HA   TYR  31           HA       TYR  31   7.314 -14.215  -3.403
  196    HB2  TYR  31           HB2      TYR  31   7.639 -11.749  -1.779
  197    HB3  TYR  31           HB3      TYR  31   6.019 -12.100  -2.370
  198    HD1  TYR  31           HD1      TYR  31   8.769 -14.266  -1.053
  199    HD2  TYR  31           HD2      TYR  31   4.736 -12.969  -0.663
  200    HE1  TYR  31           HE1      TYR  31   8.445 -15.855   0.796
  201    HE2  TYR  31           HE2      TYR  31   4.400 -14.553   1.188
  202    HH   TYR  31           HH       TYR  31   5.878 -15.720   2.905
  203    H    GLU  32           H        GLU  32   5.141 -12.826  -3.993
  204    HA   GLU  32           HA       GLU  32   5.678 -11.076  -6.261
  205    HB2  GLU  32           HB2      GLU  32   4.095 -13.639  -6.506
  206    HB3  GLU  32           HB3      GLU  32   4.197 -12.395  -7.744
  207    HG2  GLU  32           HG2      GLU  32   6.793 -12.831  -7.425
  208    HG3  GLU  32           HG3      GLU  32   6.198 -14.404  -6.898
  209    H    GLY  33           H        GLY  33   3.381 -10.521  -7.293
  210    HA2  GLY  33           HA2      GLY  33   1.101  -9.996  -6.895
  211    HA3  GLY  33           HA3      GLY  33   1.363 -10.278  -5.180
  212    H    VAL  34           H        VAL  34   0.004  -8.050  -6.006
  213    HA   VAL  34           HA       VAL  34   1.867  -5.816  -6.039
  214    HB   VAL  34           HB       VAL  34  -1.149  -5.704  -5.977
  215   HG11  VAL  34          HG11      VAL  34   0.458  -3.611  -7.291
  216   HG12  VAL  34          HG12      VAL  34   0.592  -3.695  -5.535
  217   HG13  VAL  34          HG13      VAL  34  -0.987  -3.475  -6.288
  218   HG21  VAL  34          HG21      VAL  34   0.730  -6.305  -8.172
  219   HG22  VAL  34          HG22      VAL  34  -0.531  -5.127  -8.532
  220   HG23  VAL  34          HG23      VAL  34  -0.967  -6.744  -7.976
  221    H    TYR  35           H        TYR  35  -0.667  -7.154  -3.951
  222    HA   TYR  35           HA       TYR  35   0.112  -5.281  -1.833
  223    HB2  TYR  35           HB2      TYR  35  -2.355  -6.811  -2.465
  224    HB3  TYR  35           HB3      TYR  35  -1.992  -6.557  -0.762
  225    HD1  TYR  35           HD1      TYR  35  -0.810  -3.853  -0.805
  226    HD2  TYR  35           HD2      TYR  35  -4.165  -5.417  -2.904
  227    HE1  TYR  35           HE1      TYR  35  -1.772  -1.594  -0.942
  228    HE2  TYR  35           HE2      TYR  35  -5.135  -3.162  -3.046
  229    HH   TYR  35           HH       TYR  35  -4.458  -0.855  -2.941
  230    H    CYS  36           H        CYS  36   1.723  -7.613  -2.644
  231    HA   CYS  36           HA       CYS  36   2.878  -9.351  -1.731
  232    HB2  CYS  36           HB2      CYS  36   2.133  -7.943   0.841
  233    HB3  CYS  36           HB3      CYS  36   3.400  -9.154   0.670
  234    H    GLU  37           H        GLU  37   1.250 -10.857  -2.445
  235    HA   GLU  37           HA       GLU  37   0.160 -12.368  -0.226
  236    HB2  GLU  37           HB2      GLU  37  -1.674 -10.844  -0.710
  237    HB3  GLU  37           HB3      GLU  37  -1.614 -11.271  -2.415
  238    HG2  GLU  37           HG2      GLU  37  -3.460 -12.391  -1.366
  239    HG3  GLU  37           HG3      GLU  37  -2.243 -13.578  -1.835
  240    H    ILE  38           H        ILE  38   0.418 -12.049  -3.750
  241    HA   ILE  38           HA       ILE  38   0.307 -14.938  -4.082
  242    HB   ILE  38           HB       ILE  38   0.800 -12.887  -6.235
  243   HG12  ILE  38          HG12      ILE  38  -1.272 -12.300  -5.087
  244   HG13  ILE  38          HG13      ILE  38  -1.631 -12.978  -6.673
  245   HG21  ILE  38          HG21      ILE  38   1.235 -15.381  -6.589
  246   HG22  ILE  38          HG22      ILE  38   0.204 -14.557  -7.760
  247   HG23  ILE  38          HG23      ILE  38  -0.517 -15.568  -6.508
  248   HD11  ILE  38          HD11      ILE  38  -2.141 -15.131  -5.606
  249   HD12  ILE  38          HD12      ILE  38  -3.176 -13.824  -5.031
  250   HD13  ILE  38          HD13      ILE  38  -1.843 -14.399  -4.030
  251    H1   FUC  39           H1       FUC  39  10.398  -3.712   6.793
  252    H2   FUC  39           H2       FUC  39  11.350  -5.680   7.928
  253    H3   FUC  39           H3       FUC  39   8.465  -6.654   8.110
  254    H4   FUC  39           H4       FUC  39   9.141  -8.434   6.606
  255    H5   FUC  39           H5       FUC  39   8.293  -6.360   5.584
  256    H61  FUC  39           H61      FUC  39   9.026  -8.121   4.005
  257    H62  FUC  39           H62      FUC  39   9.373  -6.491   3.351
  258    H63  FUC  39           H63      FUC  39  10.697  -7.474   4.050
  259    HO2  FUC  39           HO2      FUC  39   9.019  -4.636   9.231
  260    HO4  FUC  39           HO4      FUC  39  11.673  -7.088   6.547
  261    H1   NAG  40           H1       NAG  40   8.528  -9.023   9.056
  262    H2   NAG  40           H2       NAG  40  10.356  -8.495  11.470
  263    H3   NAG  40           H3       NAG  40   8.234 -10.676  11.073
  264    H4   NAG  40           H4       NAG  40   8.171  -8.237  12.936
  265    H5   NAG  40           H5       NAG  40   6.548  -8.784  10.375
  266    H61  NAG  40           H61      NAG  40   6.410  -6.073  11.011
  267    H62  NAG  40           H62      NAG  40   6.240  -6.889  12.582
  268    H81  NAG  40           H81      NAG  40  12.549 -12.465  11.034
  269    H82  NAG  40           H82      NAG  40  12.209 -11.922   9.364
  270    H83  NAG  40           H83      NAG  40  13.662 -11.327  10.220
  271    HN2  NAG  40           HN2      NAG  40  10.370 -10.705   9.519
  272    HO3  NAG  40           HO3      NAG  40   9.935  -9.930  13.221
  273    HO4  NAG  40           HO4      NAG  40   5.858  -9.013  12.933
  274    HO6  NAG  40           HO6      NAG  40   4.675  -8.307  11.266
  Start of MODEL    2
    1    H1   ASP   1           H1       ASP   1   1.530  11.669   5.273
    2    HA   ASP   1           HA       ASP   1  -0.703  11.653   4.551
    3    HB2  ASP   1           HB2      ASP   1   0.505  10.755   1.929
    4    HB3  ASP   1           HB3      ASP   1  -1.228  10.866   2.221
    5    H    VAL   2           H        VAL   2  -2.068  10.055   5.123
    6    HA   VAL   2           HA       VAL   2  -1.206   7.271   4.771
    7    HB   VAL   2           HB       VAL   2  -0.572   7.885   7.045
    8   HG11  VAL   2          HG11      VAL   2  -1.913   8.925   8.569
    9   HG12  VAL   2          HG12      VAL   2  -3.398   8.282   7.870
   10   HG13  VAL   2          HG13      VAL   2  -2.563   9.623   7.086
   11   HG21  VAL   2          HG21      VAL   2  -1.206   5.895   7.860
   12   HG22  VAL   2          HG22      VAL   2  -2.014   5.683   6.307
   13   HG23  VAL   2          HG23      VAL   2  -2.922   6.269   7.701
   14    H    ASN   3           H        ASN   3  -2.815   7.444   3.038
   15    HA   ASN   3           HA       ASN   3  -5.573   7.248   4.057
   16    HB2  ASN   3           HB2      ASN   3  -4.451   8.404   1.537
   17    HB3  ASN   3           HB3      ASN   3  -6.070   7.714   1.508
   18   HD21  ASN   3          HD21      ASN   3  -5.600  10.380   0.994
   19   HD22  ASN   3          HD22      ASN   3  -6.275  11.332   2.268
   20    H    GLU   4           H        GLU   4  -3.173   5.868   1.880
   21    HA   GLU   4           HA       GLU   4  -4.941   3.667   1.180
   22    HB2  GLU   4           HB2      GLU   4  -2.356   4.722   0.189
   23    HB3  GLU   4           HB3      GLU   4  -2.590   2.984   0.049
   24    HG2  GLU   4           HG2      GLU   4  -3.605   3.433  -1.873
   25    HG3  GLU   4           HG3      GLU   4  -4.961   3.986  -0.891
   26    H    CYS   5           H        CYS   5  -2.064   4.292   3.096
   27    HA   CYS   5           HA       CYS   5  -1.970   1.480   3.915
   28    HB2  CYS   5           HB2      CYS   5   0.029   3.406   3.398
   29    HB3  CYS   5           HB3      CYS   5   0.083   3.094   5.129
   30    H    ILE   6           H        ILE   6  -3.935   1.688   5.169
   31    HA   ILE   6           HA       ILE   6  -3.664   3.253   7.631
   32    HB   ILE   6           HB       ILE   6  -6.130   1.832   6.689
   33   HG12  ILE   6          HG12      ILE   6  -5.414   3.465   4.987
   34   HG13  ILE   6          HG13      ILE   6  -6.901   3.969   5.786
   35   HG21  ILE   6          HG21      ILE   6  -5.605   2.812   9.127
   36   HG22  ILE   6          HG22      ILE   6  -7.220   2.787   8.420
   37   HG23  ILE   6          HG23      ILE   6  -6.251   4.259   8.355
   38   HD11  ILE   6          HD11      ILE   6  -5.623   5.507   7.186
   39   HD12  ILE   6          HD12      ILE   6  -5.401   5.844   5.469
   40   HD13  ILE   6          HD13      ILE   6  -4.139   5.007   6.374
   41    H    SER   7           H        SER   7  -5.138   0.130   6.799
   42    HA   SER   7           HA       SER   7  -4.076  -0.943   9.317
   43    HB2  SER   7           HB2      SER   7  -6.630  -0.875   8.782
   44    HB3  SER   7           HB3      SER   7  -6.273  -2.265   7.758
   45    HG   SER   7           HG       SER   7  -5.426  -3.311   9.599
   46    H    ASN   8           H        ASN   8  -2.169  -0.917   7.531
   47    HA   ASN   8           HA       ASN   8  -0.688  -2.148   6.315
   48    HB2  ASN   8           HB2      ASN   8  -0.673  -3.478   8.373
   49    HB3  ASN   8           HB3      ASN   8  -2.035  -4.422   7.785
   50   HD21  ASN   8          HD21      ASN   8  -0.152  -5.941   8.463
   51   HD22  ASN   8          HD22      ASN   8   0.811  -6.494   7.148
   52    HA   PRO   9           HA       PRO   9  -3.648  -2.986   2.903
   53    HB2  PRO   9           HB2      PRO   9  -1.749  -2.472   0.967
   54    HB3  PRO   9           HB3      PRO   9  -2.829  -1.260   1.661
   55    HG2  PRO   9           HG2      PRO   9   0.017  -1.875   2.330
   56    HG3  PRO   9           HG3      PRO   9  -0.795  -0.303   2.217
   57    HD2  PRO   9           HD2      PRO   9  -0.262  -1.452   4.585
   58    HD3  PRO   9           HD3      PRO   9  -1.735  -0.496   4.324
   59    H    CYS  10           H        CYS  10  -0.340  -4.123   3.365
   60    HA   CYS  10           HA       CYS  10  -0.417  -6.207   1.468
   61    HB2  CYS  10           HB2      CYS  10   1.224  -6.242   3.999
   62    HB3  CYS  10           HB3      CYS  10   1.594  -6.998   2.454
   63    H    GLN  11           H        GLN  11  -0.357  -8.544   1.990
   64    HA   GLN  11           HA       GLN  11  -2.354  -9.176   4.063
   65    HB2  GLN  11           HB2      GLN  11  -2.011 -10.037   1.272
   66    HB3  GLN  11           HB3      GLN  11  -2.383 -11.336   2.394
   67    HG2  GLN  11           HG2      GLN  11  -4.032  -8.889   2.570
   68    HG3  GLN  11           HG3      GLN  11  -4.252  -9.913   1.153
   69   HE21  GLN  11          HE21      GLN  11  -5.111 -11.960   1.393
   70   HE22  GLN  11          HE22      GLN  11  -5.884 -12.481   2.847
   71    H    ASN  12           H        ASN  12   0.757 -10.011   2.721
   72    HA   ASN  12           HA       ASN  12   1.023 -12.336   4.441
   73    HB2  ASN  12           HB2      ASN  12   2.527 -11.193   2.154
   74    HB3  ASN  12           HB3      ASN  12   3.448 -12.139   3.314
   75   HD21  ASN  12          HD21      ASN  12   3.179 -12.910   0.718
   76   HD22  ASN  12          HD22      ASN  12   2.239 -14.350   0.657
   77    H    ASP  13           H        ASP  13   1.059  -9.287   5.239
   78    HA   ASP  13           HA       ASP  13   1.897  -8.168   7.038
   79    HB2  ASP  13           HB2      ASP  13   2.431 -10.825   7.678
   80    HB3  ASP  13           HB3      ASP  13   3.986 -10.022   7.870
   81    H    ALA  14           H        ALA  14   2.744  -7.304   4.768
   82    HA   ALA  14           HA       ALA  14   5.654  -7.313   4.657
   83    HB1  ALA  14           HB1      ALA  14   5.242  -7.232   2.478
   84    HB2  ALA  14           HB2      ALA  14   4.636  -5.590   2.694
   85    HB3  ALA  14           HB3      ALA  14   3.525  -6.958   2.769
   86    H    THR  15           H        THR  15   6.691  -5.124   4.166
   87    HA   THR  15           HA       THR  15   5.892  -3.292   6.279
   88    HB   THR  15           HB       THR  15   8.335  -3.329   4.494
   89   HG21  THR  15          HG21      THR  15   8.686  -1.243   5.159
   90   HG22  THR  15          HG22      THR  15   8.981  -1.920   6.760
   91   HG23  THR  15          HG23      THR  15   7.380  -1.310   6.342
   92    H    CYS  16           H        CYS  16   5.401  -1.126   5.979
   93    HA   CYS  16           HA       CYS  16   4.572  -0.427   3.247
   94    HB2  CYS  16           HB2      CYS  16   2.767  -0.448   4.903
   95    HB3  CYS  16           HB3      CYS  16   3.656   0.696   5.904
   96    H    LEU  17           H        LEU  17   5.364   1.334   2.232
   97    HA   LEU  17           HA       LEU  17   7.155   3.106   3.756
   98    HB2  LEU  17           HB2      LEU  17   8.059   1.296   1.958
   99    HB3  LEU  17           HB3      LEU  17   7.778   2.668   0.902
  100    HG   LEU  17           HG       LEU  17   9.206   4.031   2.498
  101   HD11  LEU  17          HD11      LEU  17   9.394   1.354   3.732
  102   HD12  LEU  17          HD12      LEU  17   9.494   2.955   4.466
  103   HD13  LEU  17          HD13      LEU  17  10.889   2.283   3.621
  104   HD21  LEU  17          HD21      LEU  17  11.343   2.959   1.623
  105   HD22  LEU  17          HD22      LEU  17  10.153   3.466   0.424
  106   HD23  LEU  17          HD23      LEU  17  10.298   1.763   0.859
  107    H    ASP  18           H        ASP  18   7.062   5.264   3.284
  108    HA   ASP  18           HA       ASP  18   4.820   6.094   1.601
  109    HB2  ASP  18           HB2      ASP  18   5.619   6.898   4.115
  110    HB3  ASP  18           HB3      ASP  18   6.218   8.195   3.087
  111    H    GLN  19           H        GLN  19   5.042   7.897   0.144
  112    HA   GLN  19           HA       GLN  19   7.777   8.468  -0.741
  113    HB2  GLN  19           HB2      GLN  19   5.595   7.202  -2.336
  114    HB3  GLN  19           HB3      GLN  19   6.680   8.323  -3.145
  115    HG2  GLN  19           HG2      GLN  19   8.534   6.849  -2.020
  116    HG3  GLN  19           HG3      GLN  19   7.242   5.649  -1.973
  117   HE21  GLN  19          HE21      GLN  19   9.791   6.659  -3.713
  118   HE22  GLN  19          HE22      GLN  19   9.318   6.129  -5.288
  119    H    ILE  20           H        ILE  20   4.613   9.192  -2.155
  120    HA   ILE  20           HA       ILE  20   4.828  11.975  -1.326
  121    HB   ILE  20           HB       ILE  20   4.453  11.293  -4.238
  122   HG12  ILE  20          HG12      ILE  20   6.931  12.344  -2.853
  123   HG13  ILE  20          HG13      ILE  20   6.740  10.718  -3.499
  124   HG21  ILE  20          HG21      ILE  20   5.312  13.971  -3.351
  125   HG22  ILE  20          HG22      ILE  20   3.661  13.507  -2.938
  126   HG23  ILE  20          HG23      ILE  20   4.184  13.502  -4.623
  127   HD11  ILE  20          HD11      ILE  20   7.949  12.643  -4.845
  128   HD12  ILE  20          HD12      ILE  20   6.294  12.985  -5.349
  129   HD13  ILE  20          HD13      ILE  20   6.995  11.395  -5.647
  130    H    GLY  21           H        GLY  21   2.985   9.607  -3.212
  131    HA2  GLY  21           HA2      GLY  21   0.571  10.286  -1.786
  132    HA3  GLY  21           HA3      GLY  21   0.556  10.786  -3.471
  133    H    GLU  22           H        GLU  22   2.239   7.917  -2.424
  134    HA   GLU  22           HA       GLU  22   0.048   6.210  -3.338
  135    HB2  GLU  22           HB2      GLU  22   2.863   5.935  -4.403
  136    HB3  GLU  22           HB3      GLU  22   1.470   4.954  -4.840
  137    HG2  GLU  22           HG2      GLU  22   0.605   7.482  -5.414
  138    HG3  GLU  22           HG3      GLU  22   2.318   7.563  -5.825
  139    H    PHE  23           H        PHE  23   0.374   3.929  -2.787
  140    HA   PHE  23           HA       PHE  23   1.800   3.692  -0.251
  141    HB2  PHE  23           HB2      PHE  23   0.450   1.693   0.120
  142    HB3  PHE  23           HB3      PHE  23  -0.573   3.068  -0.284
  143    HD1  PHE  23           HD1      PHE  23  -1.698   3.192  -2.431
  144    HD2  PHE  23           HD2      PHE  23   0.658  -0.181  -1.351
  145    HE1  PHE  23           HE1      PHE  23  -2.728   1.896  -4.256
  146    HE2  PHE  23           HE2      PHE  23  -0.364  -1.486  -3.174
  147    HZ   PHE  23           HZ       PHE  23  -2.060  -0.447  -4.628
  148    H    GLN  24           H        GLN  24   3.258   2.030   0.191
  149    HA   GLN  24           HA       GLN  24   4.192   0.477  -2.126
  150    HB2  GLN  24           HB2      GLN  24   5.612   2.549  -0.735
  151    HB3  GLN  24           HB3      GLN  24   6.435   1.016  -0.486
  152    HG2  GLN  24           HG2      GLN  24   7.347   1.187  -2.487
  153    HG3  GLN  24           HG3      GLN  24   5.743   1.155  -3.217
  154   HE21  GLN  24          HE21      GLN  24   4.585   3.322  -3.107
  155   HE22  GLN  24          HE22      GLN  24   5.530   4.712  -3.508
  156    H    CYS  25           H        CYS  25   4.058  -1.615  -1.699
  157    HA   CYS  25           HA       CYS  25   4.216  -2.503   1.099
  158    HB2  CYS  25           HB2      CYS  25   2.126  -3.071  -0.035
  159    HB3  CYS  25           HB3      CYS  25   3.022  -3.879  -1.316
  160    H    ILE  26           H        ILE  26   6.123  -3.289   1.680
  161    HA   ILE  26           HA       ILE  26   7.933  -4.390  -0.317
  162    HB   ILE  26           HB       ILE  26   8.437  -4.070   2.640
  163   HG12  ILE  26          HG12      ILE  26   9.147  -2.141   0.421
  164   HG13  ILE  26          HG13      ILE  26   7.807  -1.915   1.541
  165   HG21  ILE  26          HG21      ILE  26  10.605  -3.900   0.646
  166   HG22  ILE  26          HG22      ILE  26   9.871  -5.488   0.868
  167   HG23  ILE  26          HG23      ILE  26  10.585  -4.646   2.244
  168   HD11  ILE  26          HD11      ILE  26   9.236  -0.805   2.820
  169   HD12  ILE  26          HD12      ILE  26  10.621  -1.360   1.880
  170   HD13  ILE  26          HD13      ILE  26   9.983  -2.360   3.185
  171    H    CYS  27           H        CYS  27   7.488  -6.442  -0.855
  172    HA   CYS  27           HA       CYS  27   6.529  -8.327   1.126
  173    HB2  CYS  27           HB2      CYS  27   5.900  -8.097  -1.443
  174    HB3  CYS  27           HB3      CYS  27   7.274  -9.180  -1.632
  175    H    MET  28           H        MET  28   7.533 -10.534   1.188
  176    HA   MET  28           HA       MET  28  10.174 -10.373   2.098
  177    HB2  MET  28           HB2      MET  28   8.132 -12.388   1.859
  178    HB3  MET  28           HB3      MET  28   9.687 -13.060   1.389
  179    HG2  MET  28           HG2      MET  28  10.483 -11.883   3.603
  180    HG3  MET  28           HG3      MET  28   8.777 -12.030   4.020
  181    HE1  MET  28           HE1      MET  28  11.836 -14.881   4.952
  182    HE2  MET  28           HE2      MET  28  11.911 -13.174   4.515
  183    HE3  MET  28           HE3      MET  28  12.127 -14.412   3.277
  184    HA   PRO  29           HA       PRO  29  12.683 -11.081  -1.465
  185    HB2  PRO  29           HB2      PRO  29  14.539 -12.842  -0.695
  186    HB3  PRO  29           HB3      PRO  29  14.449 -11.226   0.013
  187    HG2  PRO  29           HG2      PRO  29  13.462 -13.831   1.111
  188    HG3  PRO  29           HG3      PRO  29  14.313 -12.517   1.942
  189    HD2  PRO  29           HD2      PRO  29  11.600 -12.881   2.044
  190    HD3  PRO  29           HD3      PRO  29  12.391 -11.308   2.251
  191    H    GLY  30           H        GLY  30  11.674 -12.000  -3.173
  192    HA2  GLY  30           HA2      GLY  30  11.668 -13.803  -4.729
  193    HA3  GLY  30           HA3      GLY  30  11.818 -14.925  -3.385
  194    H    TYR  31           H        TYR  31   9.533 -12.328  -3.176
  195    HA   TYR  31           HA       TYR  31   7.360 -14.290  -3.316
  196    HB2  TYR  31           HB2      TYR  31   7.766 -11.712  -1.884
  197    HB3  TYR  31           HB3      TYR  31   6.122 -12.126  -2.358
  198    HD1  TYR  31           HD1      TYR  31   9.060 -13.859  -0.810
  199    HD2  TYR  31           HD2      TYR  31   4.862 -13.170  -0.742
  200    HE1  TYR  31           HE1      TYR  31   8.859 -15.306   1.168
  201    HE2  TYR  31           HE2      TYR  31   4.650 -14.614   1.237
  202    HH   TYR  31           HH       TYR  31   5.955 -16.522   2.273
  203    H    GLU  32           H        GLU  32   5.189 -12.917  -3.924
  204    HA   GLU  32           HA       GLU  32   5.646 -11.260  -6.266
  205    HB2  GLU  32           HB2      GLU  32   4.602 -14.050  -6.373
  206    HB3  GLU  32           HB3      GLU  32   3.880 -12.856  -7.444
  207    HG2  GLU  32           HG2      GLU  32   5.617 -12.903  -8.821
  208    HG3  GLU  32           HG3      GLU  32   6.768 -12.731  -7.496
  209    H    GLY  33           H        GLY  33   3.255 -10.968  -7.326
  210    HA2  GLY  33           HA2      GLY  33   0.962 -10.542  -6.896
  211    HA3  GLY  33           HA3      GLY  33   1.291 -10.652  -5.173
  212    H    VAL  34           H        VAL  34  -0.231  -8.610  -5.894
  213    HA   VAL  34           HA       VAL  34   1.419  -6.263  -6.378
  214    HB   VAL  34           HB       VAL  34  -1.552  -6.354  -5.852
  215   HG11  VAL  34          HG11      VAL  34  -1.591  -4.185  -6.912
  216   HG12  VAL  34          HG12      VAL  34   0.139  -4.278  -7.240
  217   HG13  VAL  34          HG13      VAL  34  -0.437  -4.165  -5.578
  218   HG21  VAL  34          HG21      VAL  34  -1.834  -6.281  -8.288
  219   HG22  VAL  34          HG22      VAL  34  -1.032  -7.762  -7.766
  220   HG23  VAL  34          HG23      VAL  34  -0.091  -6.458  -8.489
  221    H    TYR  35           H        TYR  35  -0.845  -7.413  -3.878
  222    HA   TYR  35           HA       TYR  35   0.241  -5.424  -2.021
  223    HB2  TYR  35           HB2      TYR  35  -2.284  -7.021  -2.138
  224    HB3  TYR  35           HB3      TYR  35  -1.701  -6.479  -0.569
  225    HD1  TYR  35           HD1      TYR  35  -1.008  -3.897  -0.523
  226    HD2  TYR  35           HD2      TYR  35  -3.750  -5.647  -3.265
  227    HE1  TYR  35           HE1      TYR  35  -2.023  -1.691  -0.908
  228    HE2  TYR  35           HE2      TYR  35  -4.772  -3.446  -3.658
  229    HH   TYR  35           HH       TYR  35  -4.928  -1.200  -2.190
  230    H    CYS  36           H        CYS  36   1.749  -7.793  -2.835
  231    HA   CYS  36           HA       CYS  36   3.064  -9.413  -1.932
  232    HB2  CYS  36           HB2      CYS  36   3.739  -7.592  -0.437
  233    HB3  CYS  36           HB3      CYS  36   2.400  -7.968   0.642
  234    H    GLU  37           H        GLU  37   1.164 -10.795  -2.584
  235    HA   GLU  37           HA       GLU  37   0.497 -12.518  -0.359
  236    HB2  GLU  37           HB2      GLU  37  -1.316 -10.815  -0.365
  237    HB3  GLU  37           HB3      GLU  37  -1.713 -11.280  -2.012
  238    HG2  GLU  37           HG2      GLU  37  -3.137 -12.240  -0.140
  239    HG3  GLU  37           HG3      GLU  37  -2.532 -13.363  -1.354
  240    H    ILE  38           H        ILE  38   1.991 -12.581  -2.933
  241    HA   ILE  38           HA       ILE  38   0.802 -15.050  -3.945
  242    HB   ILE  38           HB       ILE  38   1.751 -12.890  -5.824
  243   HG12  ILE  38          HG12      ILE  38  -0.345 -12.250  -4.642
  244   HG13  ILE  38          HG13      ILE  38  -0.572 -12.475  -6.373
  245   HG21  ILE  38          HG21      ILE  38   0.933 -14.283  -7.572
  246   HG22  ILE  38          HG22      ILE  38   0.193 -15.395  -6.420
  247   HG23  ILE  38          HG23      ILE  38   1.949 -15.284  -6.535
  248   HD11  ILE  38          HD11      ILE  38  -1.884 -14.308  -6.101
  249   HD12  ILE  38          HD12      ILE  38  -2.252 -13.461  -4.598
  250   HD13  ILE  38          HD13      ILE  38  -1.093 -14.790  -4.600
  251    H1   FUC  39           H1       FUC  39  10.273  -3.355   6.252
  252    H2   FUC  39           H2       FUC  39  11.346  -5.219   7.453
  253    H3   FUC  39           H3       FUC  39   8.524  -6.355   7.706
  254    H4   FUC  39           H4       FUC  39   9.289  -8.146   6.261
  255    H5   FUC  39           H5       FUC  39   8.309  -6.164   5.172
  256    H61  FUC  39           H61      FUC  39   9.127  -7.943   3.657
  257    H62  FUC  39           H62      FUC  39   9.375  -6.324   2.929
  258    H63  FUC  39           H63      FUC  39  10.756  -7.202   3.655
  259    HO2  FUC  39           HO2      FUC  39  10.338  -3.499   8.655
  260    HO4  FUC  39           HO4      FUC  39  11.735  -6.658   6.122
  261    H1   NAG  40           H1       NAG  40   8.858  -8.783   8.594
  262    H2   NAG  40           H2       NAG  40  10.470  -8.019  11.099
  263    H3   NAG  40           H3       NAG  40   8.699 -10.476  10.589
  264    H4   NAG  40           H4       NAG  40   8.206  -8.086  12.452
  265    H5   NAG  40           H5       NAG  40   6.802  -8.830   9.814
  266    H61  NAG  40           H61      NAG  40   5.146  -7.707  10.891
  267    H62  NAG  40           H62      NAG  40   6.027  -6.334  10.181
  268    H81  NAG  40           H81      NAG  40  14.375  -9.621   9.454
  269    H82  NAG  40           H82      NAG  40  13.360 -11.021   9.909
  270    H83  NAG  40           H83      NAG  40  13.220 -10.307   8.274
  271    HN2  NAG  40           HN2      NAG  40  10.861 -10.477   9.508
  272    HO3  NAG  40           HO3      NAG  40  10.335 -10.840  12.078
  273    HO4  NAG  40           HO4      NAG  40   7.069  -9.712  13.250
  274    HO6  NAG  40           HO6      NAG  40   6.009  -7.249  12.869
  Start of MODEL    3
    1    H1   ASP   1           H1       ASP   1  -5.547  12.878  -3.720
    2    HA   ASP   1           HA       ASP   1  -5.054  13.242  -1.440
    3    HB2  ASP   1           HB2      ASP   1  -6.975  14.578  -0.543
    4    HB3  ASP   1           HB3      ASP   1  -6.477  15.040  -2.169
    5    H    VAL   2           H        VAL   2  -5.728  10.487  -1.737
    6    HA   VAL   2           HA       VAL   2  -6.927  10.025   0.899
    7    HB   VAL   2           HB       VAL   2  -7.599   8.320  -1.500
    8   HG11  VAL   2          HG11      VAL   2  -7.784   7.007   0.433
    9   HG12  VAL   2          HG12      VAL   2  -9.427   7.562   0.114
   10   HG13  VAL   2          HG13      VAL   2  -8.465   8.333   1.375
   11   HG21  VAL   2          HG21      VAL   2  -8.530  10.677  -1.565
   12   HG22  VAL   2          HG22      VAL   2  -9.459  10.247  -0.129
   13   HG23  VAL   2          HG23      VAL   2  -9.710   9.368  -1.637
   14    H    ASN   3           H        ASN   3  -6.073   8.317   2.041
   15    HA   ASN   3           HA       ASN   3  -3.583   7.225   0.969
   16    HB2  ASN   3           HB2      ASN   3  -4.726   7.384   3.756
   17    HB3  ASN   3           HB3      ASN   3  -3.286   6.443   3.378
   18   HD21  ASN   3          HD21      ASN   3  -2.152   7.807   4.835
   19   HD22  ASN   3          HD22      ASN   3  -1.623   9.374   4.337
   20    H    GLU   4           H        GLU   4  -3.094   4.993   1.057
   21    HA   GLU   4           HA       GLU   4  -5.484   3.273   1.045
   22    HB2  GLU   4           HB2      GLU   4  -3.205   3.518  -0.756
   23    HB3  GLU   4           HB3      GLU   4  -3.464   1.860  -0.231
   24    HG2  GLU   4           HG2      GLU   4  -5.513   1.711  -1.248
   25    HG3  GLU   4           HG3      GLU   4  -5.787   3.451  -1.195
   26    H    CYS   5           H        CYS   5  -2.354   3.778   2.440
   27    HA   CYS   5           HA       CYS   5  -2.284   1.132   3.638
   28    HB2  CYS   5           HB2      CYS   5  -0.236   2.409   2.765
   29    HB3  CYS   5           HB3      CYS   5  -0.379   3.369   4.231
   30    H    ILE   6           H        ILE   6  -4.178   1.283   4.925
   31    HA   ILE   6           HA       ILE   6  -3.983   3.118   7.213
   32    HB   ILE   6           HB       ILE   6  -6.414   1.572   6.376
   33   HG12  ILE   6          HG12      ILE   6  -5.700   3.114   4.575
   34   HG13  ILE   6          HG13      ILE   6  -7.230   3.597   5.302
   35   HG21  ILE   6          HG21      ILE   6  -6.597   2.227   8.630
   36   HG22  ILE   6          HG22      ILE   6  -7.536   3.406   7.713
   37   HG23  ILE   6          HG23      ILE   6  -5.926   3.824   8.299
   38   HD11  ILE   6          HD11      ILE   6  -6.413   5.568   5.900
   39   HD12  ILE   6          HD12      ILE   6  -5.015   5.192   4.891
   40   HD13  ILE   6          HD13      ILE   6  -4.977   4.839   6.619
   41    H    SER   7           H        SER   7  -5.380  -0.096   6.630
   42    HA   SER   7           HA       SER   7  -4.301  -0.946   9.225
   43    HB2  SER   7           HB2      SER   7  -6.782  -0.996   8.992
   44    HB3  SER   7           HB3      SER   7  -6.602  -2.158   7.677
   45    HG   SER   7           HG       SER   7  -5.823  -3.648   9.098
   46    H    ASN   8           H        ASN   8  -2.387  -1.030   7.462
   47    HA   ASN   8           HA       ASN   8  -0.852  -2.341   6.416
   48    HB2  ASN   8           HB2      ASN   8  -0.974  -3.645   8.478
   49    HB3  ASN   8           HB3      ASN   8  -2.352  -4.539   7.853
   50   HD21  ASN   8          HD21      ASN   8  -0.564  -6.122   8.637
   51   HD22  ASN   8          HD22      ASN   8   0.423  -6.746   7.373
   52    HA   PRO   9           HA       PRO   9  -3.713  -3.172   2.901
   53    HB2  PRO   9           HB2      PRO   9  -1.841  -2.449   1.022
   54    HB3  PRO   9           HB3      PRO   9  -2.983  -1.330   1.769
   55    HG2  PRO   9           HG2      PRO   9  -0.113  -1.834   2.428
   56    HG3  PRO   9           HG3      PRO   9  -1.000  -0.299   2.376
   57    HD2  PRO   9           HD2      PRO   9  -0.425  -1.541   4.695
   58    HD3  PRO   9           HD3      PRO   9  -1.926  -0.620   4.470
   59    H    CYS  10           H        CYS  10  -0.277  -4.001   3.209
   60    HA   CYS  10           HA       CYS  10  -0.177  -6.026   1.294
   61    HB2  CYS  10           HB2      CYS  10   1.379  -6.101   3.876
   62    HB3  CYS  10           HB3      CYS  10   1.851  -6.729   2.302
   63    H    GLN  11           H        GLN  11  -0.290  -8.308   1.471
   64    HA   GLN  11           HA       GLN  11  -1.974  -9.237   3.705
   65    HB2  GLN  11           HB2      GLN  11  -2.208  -9.567   0.786
   66    HB3  GLN  11           HB3      GLN  11  -2.483 -11.030   1.720
   67    HG2  GLN  11           HG2      GLN  11  -3.929  -8.412   2.049
   68    HG3  GLN  11           HG3      GLN  11  -4.563  -9.868   1.285
   69   HE21  GLN  11          HE21      GLN  11  -4.157 -11.869   2.837
   70   HE22  GLN  11          HE22      GLN  11  -4.766 -11.637   4.437
   71    H    ASN  12           H        ASN  12   0.968  -9.276   3.525
   72    HA   ASN  12           HA       ASN  12   1.299 -12.098   4.124
   73    HB2  ASN  12           HB2      ASN  12   2.399 -10.813   1.723
   74    HB3  ASN  12           HB3      ASN  12   3.584 -11.706   2.667
   75   HD21  ASN  12          HD21      ASN  12   3.141 -12.576   0.241
   76   HD22  ASN  12          HD22      ASN  12   2.215 -14.028   0.253
   77    H    ASP  13           H        ASP  13   1.510  -9.277   5.369
   78    HA   ASP  13           HA       ASP  13   2.661  -8.400   7.128
   79    HB2  ASP  13           HB2      ASP  13   2.964 -10.905   7.688
   80    HB3  ASP  13           HB3      ASP  13   4.585 -10.715   7.027
   81    H    ALA  14           H        ALA  14   3.160  -7.135   4.995
   82    HA   ALA  14           HA       ALA  14   6.053  -7.097   4.519
   83    HB1  ALA  14           HB1      ALA  14   4.980  -5.408   2.663
   84    HB2  ALA  14           HB2      ALA  14   3.700  -6.604   2.861
   85    HB3  ALA  14           HB3      ALA  14   5.322  -7.118   2.403
   86    H    THR  15           H        THR  15   6.980  -4.884   4.102
   87    HA   THR  15           HA       THR  15   6.202  -3.138   6.295
   88    HB   THR  15           HB       THR  15   8.585  -3.102   4.433
   89   HG21  THR  15          HG21      THR  15   8.236  -1.435   6.906
   90   HG22  THR  15          HG22      THR  15   7.984  -0.825   5.271
   91   HG23  THR  15          HG23      THR  15   9.575  -1.408   5.759
   92    H    CYS  16           H        CYS  16   5.222  -1.216   6.072
   93    HA   CYS  16           HA       CYS  16   4.579  -0.340   3.347
   94    HB2  CYS  16           HB2      CYS  16   2.658  -0.794   4.800
   95    HB3  CYS  16           HB3      CYS  16   3.262   0.368   5.976
   96    H    LEU  17           H        LEU  17   5.412   1.471   2.540
   97    HA   LEU  17           HA       LEU  17   6.530   3.459   4.400
   98    HB2  LEU  17           HB2      LEU  17   7.889   1.914   2.336
   99    HB3  LEU  17           HB3      LEU  17   8.101   3.642   2.125
  100    HG   LEU  17           HG       LEU  17   8.609   3.342   4.801
  101   HD11  LEU  17          HD11      LEU  17   8.660   1.035   4.966
  102   HD12  LEU  17          HD12      LEU  17  10.357   1.439   4.708
  103   HD13  LEU  17          HD13      LEU  17   9.382   0.833   3.370
  104   HD21  LEU  17          HD21      LEU  17  10.673   4.125   4.261
  105   HD22  LEU  17          HD22      LEU  17   9.874   4.399   2.713
  106   HD23  LEU  17          HD23      LEU  17  10.888   2.974   2.942
  107    H    ASP  18           H        ASP  18   7.325   5.386   2.699
  108    HA   ASP  18           HA       ASP  18   5.097   5.959   0.894
  109    HB2  ASP  18           HB2      ASP  18   4.977   6.960   3.394
  110    HB3  ASP  18           HB3      ASP  18   5.937   8.218   2.621
  111    H    GLN  19           H        GLN  19   5.527   7.917  -0.451
  112    HA   GLN  19           HA       GLN  19   8.363   8.568  -0.728
  113    HB2  GLN  19           HB2      GLN  19   6.782   6.964  -2.602
  114    HB3  GLN  19           HB3      GLN  19   7.590   8.330  -3.358
  115    HG2  GLN  19           HG2      GLN  19   9.349   6.902  -1.561
  116    HG3  GLN  19           HG3      GLN  19   8.681   5.851  -2.807
  117   HE21  GLN  19          HE21      GLN  19  11.393   7.105  -2.275
  118   HE22  GLN  19          HE22      GLN  19  11.834   7.801  -3.793
  119    H    ILE  20           H        ILE  20   5.121   9.138  -2.058
  120    HA   ILE  20           HA       ILE  20   5.563  12.010  -1.814
  121    HB   ILE  20           HB       ILE  20   4.523  10.839  -4.388
  122   HG12  ILE  20          HG12      ILE  20   7.264  12.000  -3.847
  123   HG13  ILE  20          HG13      ILE  20   6.923  10.283  -4.031
  124   HG21  ILE  20          HG21      ILE  20   5.611  13.575  -4.238
  125   HG22  ILE  20          HG22      ILE  20   4.090  13.294  -3.389
  126   HG23  ILE  20          HG23      ILE  20   4.213  12.952  -5.115
  127   HD11  ILE  20          HD11      ILE  20   6.880  12.449  -6.083
  128   HD12  ILE  20          HD12      ILE  20   5.951  10.969  -6.322
  129   HD13  ILE  20          HD13      ILE  20   7.700  10.888  -6.116
  130    H    GLY  21           H        GLY  21   3.159   9.865  -3.324
  131    HA2  GLY  21           HA2      GLY  21   1.197  10.613  -1.308
  132    HA3  GLY  21           HA3      GLY  21   0.854  11.140  -2.948
  133    H    GLU  22           H        GLU  22   2.512   8.139  -2.364
  134    HA   GLU  22           HA       GLU  22   0.033   6.664  -2.956
  135    HB2  GLU  22           HB2      GLU  22   2.766   6.265  -4.176
  136    HB3  GLU  22           HB3      GLU  22   1.469   5.085  -4.302
  137    HG2  GLU  22           HG2      GLU  22   0.619   7.742  -5.090
  138    HG3  GLU  22           HG3      GLU  22   1.984   7.160  -6.042
  139    H    PHE  23           H        PHE  23   0.366   4.240  -2.530
  140    HA   PHE  23           HA       PHE  23   1.601   3.994   0.106
  141    HB2  PHE  23           HB2      PHE  23   0.203   2.030   0.408
  142    HB3  PHE  23           HB3      PHE  23  -0.781   3.396  -0.110
  143    HD1  PHE  23           HD1      PHE  23  -1.641   3.498  -2.408
  144    HD2  PHE  23           HD2      PHE  23   0.431   0.090  -0.928
  145    HE1  PHE  23           HE1      PHE  23  -2.528   2.155  -4.273
  146    HE2  PHE  23           HE2      PHE  23  -0.450  -1.261  -2.790
  147    HZ   PHE  23           HZ       PHE  23  -1.933  -0.227  -4.465
  148    H    GLN  24           H        GLN  24   3.218   2.591   0.560
  149    HA   GLN  24           HA       GLN  24   4.285   1.026  -1.698
  150    HB2  GLN  24           HB2      GLN  24   5.725   2.915  -0.958
  151    HB3  GLN  24           HB3      GLN  24   5.818   2.183   0.638
  152    HG2  GLN  24           HG2      GLN  24   7.615   1.098  -0.054
  153    HG3  GLN  24           HG3      GLN  24   6.567   0.158  -1.114
  154   HE21  GLN  24          HE21      GLN  24   8.629   2.985  -0.912
  155   HE22  GLN  24          HE22      GLN  24   8.948   3.108  -2.606
  156    H    CYS  25           H        CYS  25   5.022  -1.064  -1.317
  157    HA   CYS  25           HA       CYS  25   4.652  -2.181   1.362
  158    HB2  CYS  25           HB2      CYS  25   2.521  -2.563   0.215
  159    HB3  CYS  25           HB3      CYS  25   3.367  -3.317  -1.132
  160    H    ILE  26           H        ILE  26   6.501  -3.140   1.859
  161    HA   ILE  26           HA       ILE  26   8.263  -4.104  -0.247
  162    HB   ILE  26           HB       ILE  26   8.767  -4.120   2.729
  163   HG12  ILE  26          HG12      ILE  26   9.458  -1.999   0.681
  164   HG13  ILE  26          HG13      ILE  26   8.277  -1.837   1.977
  165   HG21  ILE  26          HG21      ILE  26  10.935  -3.869   0.730
  166   HG22  ILE  26          HG22      ILE  26  10.141  -5.439   0.860
  167   HG23  ILE  26          HG23      ILE  26  10.906  -4.718   2.276
  168   HD11  ILE  26          HD11      ILE  26  11.209  -2.324   2.424
  169   HD12  ILE  26          HD12      ILE  26   9.990  -1.930   3.636
  170   HD13  ILE  26          HD13      ILE  26  10.450  -0.732   2.425
  171    H    CYS  27           H        CYS  27   8.040  -6.110  -0.959
  172    HA   CYS  27           HA       CYS  27   6.750  -8.138   0.651
  173    HB2  CYS  27           HB2      CYS  27   7.226  -7.684  -2.150
  174    HB3  CYS  27           HB3      CYS  27   7.775  -9.298  -1.710
  175    H    MET  28           H        MET  28   7.753 -10.390   0.612
  176    HA   MET  28           HA       MET  28  10.291 -10.241   1.924
  177    HB2  MET  28           HB2      MET  28   8.160 -12.167   1.622
  178    HB3  MET  28           HB3      MET  28   9.718 -12.939   1.365
  179    HG2  MET  28           HG2      MET  28  10.289 -11.554   3.575
  180    HG3  MET  28           HG3      MET  28   8.555 -11.767   3.811
  181    HE1  MET  28           HE1      MET  28  11.526 -14.472   5.322
  182    HE2  MET  28           HE2      MET  28  11.445 -12.723   5.106
  183    HE3  MET  28           HE3      MET  28  12.098 -13.740   3.822
  184    HA   PRO  29           HA       PRO  29  13.039 -11.306  -1.363
  185    HB2  PRO  29           HB2      PRO  29  14.655 -13.204  -0.380
  186    HB3  PRO  29           HB3      PRO  29  14.676 -11.551   0.238
  187    HG2  PRO  29           HG2      PRO  29  13.350 -13.981   1.380
  188    HG3  PRO  29           HG3      PRO  29  14.277 -12.717   2.212
  189    HD2  PRO  29           HD2      PRO  29  11.551 -12.786   2.154
  190    HD3  PRO  29           HD3      PRO  29  12.485 -11.283   2.289
  191    H    GLY  30           H        GLY  30  11.239 -12.197  -2.665
  192    HA2  GLY  30           HA2      GLY  30  11.345 -13.999  -4.360
  193    HA3  GLY  30           HA3      GLY  30  11.537 -15.118  -3.018
  194    H    TYR  31           H        TYR  31   9.309 -12.384  -3.199
  195    HA   TYR  31           HA       TYR  31   7.088 -14.289  -2.914
  196    HB2  TYR  31           HB2      TYR  31   7.613 -11.564  -1.847
  197    HB3  TYR  31           HB3      TYR  31   5.945 -11.964  -2.238
  198    HD1  TYR  31           HD1      TYR  31   8.491 -14.323  -0.938
  199    HD2  TYR  31           HD2      TYR  31   5.026 -12.017  -0.059
  200    HE1  TYR  31           HE1      TYR  31   8.270 -15.486   1.216
  201    HE2  TYR  31           HE2      TYR  31   4.796 -13.173   2.099
  202    HH   TYR  31           HH       TYR  31   7.252 -15.095   3.425
  203    H    GLU  32           H        GLU  32   4.936 -12.948  -3.645
  204    HA   GLU  32           HA       GLU  32   5.364 -11.648  -6.209
  205    HB2  GLU  32           HB2      GLU  32   3.932 -14.287  -5.909
  206    HB3  GLU  32           HB3      GLU  32   3.699 -13.229  -7.294
  207    HG2  GLU  32           HG2      GLU  32   6.402 -14.237  -6.467
  208    HG3  GLU  32           HG3      GLU  32   5.348 -15.123  -7.567
  209    H    GLY  33           H        GLY  33   3.035 -11.256  -7.222
  210    HA2  GLY  33           HA2      GLY  33   0.802 -10.597  -6.883
  211    HA3  GLY  33           HA3      GLY  33   1.043 -10.747  -5.150
  212    H    VAL  34           H        VAL  34  -0.284  -8.583  -5.992
  213    HA   VAL  34           HA       VAL  34   1.577  -6.372  -6.316
  214    HB   VAL  34           HB       VAL  34  -1.425  -6.230  -6.038
  215   HG11  VAL  34          HG11      VAL  34   0.442  -4.286  -7.375
  216   HG12  VAL  34          HG12      VAL  34  -0.029  -4.155  -5.680
  217   HG13  VAL  34          HG13      VAL  34  -1.252  -4.051  -6.946
  218   HG21  VAL  34          HG21      VAL  34  -1.597  -6.270  -8.421
  219   HG22  VAL  34          HG22      VAL  34  -0.677  -7.690  -7.927
  220   HG23  VAL  34          HG23      VAL  34   0.157  -6.291  -8.603
  221    H    TYR  35           H        TYR  35  -0.910  -7.422  -3.998
  222    HA   TYR  35           HA       TYR  35   0.103  -5.475  -2.058
  223    HB2  TYR  35           HB2      TYR  35  -2.467  -6.903  -2.451
  224    HB3  TYR  35           HB3      TYR  35  -1.986  -6.612  -0.784
  225    HD1  TYR  35           HD1      TYR  35  -1.278  -4.387  -3.661
  226    HD2  TYR  35           HD2      TYR  35  -3.620  -5.014  -0.165
  227    HE1  TYR  35           HE1      TYR  35  -2.126  -2.087  -3.825
  228    HE2  TYR  35           HE2      TYR  35  -4.474  -2.714  -0.319
  229    HH   TYR  35           HH       TYR  35  -3.346  -0.410  -1.561
  230    H    CYS  36           H        CYS  36   1.594  -7.888  -2.783
  231    HA   CYS  36           HA       CYS  36   2.746  -9.602  -1.826
  232    HB2  CYS  36           HB2      CYS  36   2.213  -7.791   0.517
  233    HB3  CYS  36           HB3      CYS  36   3.122  -9.286   0.710
  234    H    GLU  37           H        GLU  37   1.396 -11.323  -2.234
  235    HA   GLU  37           HA       GLU  37   0.322 -12.671   0.014
  236    HB2  GLU  37           HB2      GLU  37  -1.511 -11.105  -0.228
  237    HB3  GLU  37           HB3      GLU  37  -1.657 -11.484  -1.937
  238    HG2  GLU  37           HG2      GLU  37  -1.891 -13.926  -0.586
  239    HG3  GLU  37           HG3      GLU  37  -2.856 -12.768   0.327
  240    H    ILE  38           H        ILE  38   0.342 -12.331  -3.500
  241    HA   ILE  38           HA       ILE  38  -0.030 -15.193  -3.868
  242    HB   ILE  38           HB       ILE  38   0.517 -13.130  -5.997
  243   HG12  ILE  38          HG12      ILE  38  -1.478 -12.522  -4.652
  244   HG13  ILE  38          HG13      ILE  38  -1.887 -12.951  -6.310
  245   HG21  ILE  38          HG21      ILE  38  -0.176 -15.996  -5.965
  246   HG22  ILE  38          HG22      ILE  38   0.748 -15.062  -7.142
  247   HG23  ILE  38          HG23      ILE  38  -1.016 -15.005  -7.159
  248   HD11  ILE  38          HD11      ILE  38  -2.858 -14.057  -3.875
  249   HD12  ILE  38          HD12      ILE  38  -2.039 -15.317  -4.798
  250   HD13  ILE  38          HD13      ILE  38  -3.356 -14.402  -5.531
  251    H1   FUC  39           H1       FUC  39  10.611  -3.155   5.978
  252    H2   FUC  39           H2       FUC  39  11.728  -4.929   7.252
  253    H3   FUC  39           H3       FUC  39   8.906  -5.915   7.860
  254    H4   FUC  39           H4       FUC  39   9.491  -7.877   6.568
  255    H5   FUC  39           H5       FUC  39   8.477  -5.991   5.350
  256    H61  FUC  39           H61      FUC  39  10.760  -7.235   3.730
  257    H62  FUC  39           H62      FUC  39   9.321  -6.415   3.059
  258    H63  FUC  39           H63      FUC  39   9.135  -7.948   3.968
  259    HO2  FUC  39           HO2      FUC  39  10.816  -4.310   9.302
  260    HO4  FUC  39           HO4      FUC  39  11.511  -7.903   5.435
  261    H1   NAG  40           H1       NAG  40   9.114  -8.098   9.139
  262    H2   NAG  40           H2       NAG  40  11.178  -7.210  11.236
  263    H3   NAG  40           H3       NAG  40   9.062  -9.429  11.402
  264    H4   NAG  40           H4       NAG  40   9.161  -6.738  12.876
  265    H5   NAG  40           H5       NAG  40   7.281  -7.660  10.616
  266    H61  NAG  40           H61      NAG  40   7.573  -4.856  11.712
  267    H62  NAG  40           H62      NAG  40   6.307  -5.518  10.653
  268    H81  NAG  40           H81      NAG  40  12.929 -10.729   9.263
  269    H82  NAG  40           H82      NAG  40  14.359  -9.686   9.523
  270    H83  NAG  40           H83      NAG  40  13.902 -10.900  10.755
  271    HN2  NAG  40           HN2      NAG  40  11.086  -9.569   9.511
  272    HO3  NAG  40           HO3      NAG  40  11.102  -9.516  12.647
  273    HO4  NAG  40           HO4      NAG  40   8.092  -8.471  13.934
  274    HO6  NAG  40           HO6      NAG  40   5.577  -5.375  12.831
  Start of MODEL    4
    1    H1   ASP   1           H1       ASP   1 -13.152   2.153   5.937
    2    HA   ASP   1           HA       ASP   1 -11.712   3.986   6.406
    3    HB2  ASP   1           HB2      ASP   1 -10.777   1.809   8.281
    4    HB3  ASP   1           HB3      ASP   1 -10.848   3.539   8.599
    5    H    VAL   2           H        VAL   2 -10.566   2.447   4.227
    6    HA   VAL   2           HA       VAL   2  -7.730   2.983   4.784
    7    HB   VAL   2           HB       VAL   2  -8.676   0.642   3.129
    8   HG11  VAL   2          HG11      VAL   2  -6.265  -0.051   3.469
    9   HG12  VAL   2          HG12      VAL   2  -5.976   1.586   4.058
   10   HG13  VAL   2          HG13      VAL   2  -6.536   1.329   2.406
   11   HG21  VAL   2          HG21      VAL   2  -7.477  -0.515   5.233
   12   HG22  VAL   2          HG22      VAL   2  -9.213  -0.223   5.149
   13   HG23  VAL   2          HG23      VAL   2  -8.173   0.897   6.028
   14    H    ASN   3           H        ASN   3  -6.565   3.870   3.111
   15    HA   ASN   3           HA       ASN   3  -8.012   4.383   0.602
   16    HB2  ASN   3           HB2      ASN   3  -6.658   6.338   2.423
   17    HB3  ASN   3           HB3      ASN   3  -6.680   6.646   0.689
   18   HD21  ASN   3          HD21      ASN   3  -7.885   8.553   1.514
   19   HD22  ASN   3          HD22      ASN   3  -9.599   8.406   1.676
   20    H    GLU   4           H        GLU   4  -4.853   4.392   2.220
   21    HA   GLU   4           HA       GLU   4  -3.672   3.296  -0.223
   22    HB2  GLU   4           HB2      GLU   4  -2.708   5.728   1.268
   23    HB3  GLU   4           HB3      GLU   4  -1.650   4.794   0.219
   24    HG2  GLU   4           HG2      GLU   4  -2.361   6.454  -1.192
   25    HG3  GLU   4           HG3      GLU   4  -3.510   5.166  -1.552
   26    H    CYS   5           H        CYS   5  -2.534   4.396   2.960
   27    HA   CYS   5           HA       CYS   5  -1.736   1.651   3.585
   28    HB2  CYS   5           HB2      CYS   5   0.252   2.740   2.668
   29    HB3  CYS   5           HB3      CYS   5   0.075   4.043   3.833
   30    H    ILE   6           H        ILE   6  -3.464   1.598   5.060
   31    HA   ILE   6           HA       ILE   6  -3.124   3.327   7.418
   32    HB   ILE   6           HB       ILE   6  -5.669   1.952   6.629
   33   HG12  ILE   6          HG12      ILE   6  -5.067   3.557   4.883
   34   HG13  ILE   6          HG13      ILE   6  -6.445   4.140   5.811
   35   HG21  ILE   6          HG21      ILE   6  -6.716   3.303   8.267
   36   HG22  ILE   6          HG22      ILE   6  -5.270   4.291   8.470
   37   HG23  ILE   6          HG23      ILE   6  -5.279   2.617   9.023
   38   HD11  ILE   6          HD11      ILE   6  -5.314   6.051   5.934
   39   HD12  ILE   6          HD12      ILE   6  -3.793   5.287   5.472
   40   HD13  ILE   6          HD13      ILE   6  -4.331   5.237   7.151
   41    H    SER   7           H        SER   7  -4.707   0.228   6.701
   42    HA   SER   7           HA       SER   7  -3.519  -0.850   9.160
   43    HB2  SER   7           HB2      SER   7  -6.117  -0.739   8.687
   44    HB3  SER   7           HB3      SER   7  -5.790  -2.210   7.770
   45    HG   SER   7           HG       SER   7  -5.059  -1.796  10.482
   46    H    ASN   8           H        ASN   8  -1.706  -0.875   7.285
   47    HA   ASN   8           HA       ASN   8  -0.318  -2.136   5.995
   48    HB2  ASN   8           HB2      ASN   8  -0.223  -3.474   8.047
   49    HB3  ASN   8           HB3      ASN   8  -1.639  -4.382   7.536
   50   HD21  ASN   8          HD21      ASN   8   0.228  -5.955   8.104
   51   HD22  ASN   8          HD22      ASN   8   1.107  -6.530   6.740
   52    HA   PRO   9           HA       PRO   9  -3.562  -2.846   2.789
   53    HB2  PRO   9           HB2      PRO   9  -1.236  -2.126   1.111
   54    HB3  PRO   9           HB3      PRO   9  -2.887  -1.511   1.062
   55    HG2  PRO   9           HG2      PRO   9  -0.888  -0.036   2.038
   56    HG3  PRO   9           HG3      PRO   9  -2.507   0.007   2.754
   57    HD2  PRO   9           HD2      PRO   9  -0.041  -1.366   3.728
   58    HD3  PRO   9           HD3      PRO   9  -1.312  -0.539   4.653
   59    H    CYS  10           H        CYS  10  -0.282  -4.013   3.148
   60    HA   CYS  10           HA       CYS  10  -0.243  -5.925   1.106
   61    HB2  CYS  10           HB2      CYS  10   1.113  -6.262   3.779
   62    HB3  CYS  10           HB3      CYS  10   1.626  -6.895   2.220
   63    H    GLN  11           H        GLN  11  -0.088  -8.361   1.615
   64    HA   GLN  11           HA       GLN  11  -2.173  -9.174   3.511
   65    HB2  GLN  11           HB2      GLN  11  -2.272  -9.338   0.602
   66    HB3  GLN  11           HB3      GLN  11  -2.510 -10.901   1.368
   67    HG2  GLN  11           HG2      GLN  11  -4.099  -8.398   1.876
   68    HG3  GLN  11           HG3      GLN  11  -4.631  -9.823   0.985
   69   HE21  GLN  11          HE21      GLN  11  -6.283  -9.182   2.856
   70   HE22  GLN  11          HE22      GLN  11  -6.126 -10.162   4.270
   71    H    ASN  12           H        ASN  12   0.771  -9.338   3.530
   72    HA   ASN  12           HA       ASN  12   0.953 -12.176   4.120
   73    HB2  ASN  12           HB2      ASN  12   2.275 -10.905   1.824
   74    HB3  ASN  12           HB3      ASN  12   3.355 -11.845   2.845
   75   HD21  ASN  12          HD21      ASN  12   3.136 -12.722   0.426
   76   HD22  ASN  12          HD22      ASN  12   2.142 -14.123   0.328
   77    H    ASP  13           H        ASP  13   1.121  -9.426   5.451
   78    HA   ASP  13           HA       ASP  13   2.148  -8.625   7.323
   79    HB2  ASP  13           HB2      ASP  13   2.728 -11.329   7.426
   80    HB3  ASP  13           HB3      ASP  13   4.317 -10.579   7.525
   81    H    ALA  14           H        ALA  14   2.812  -7.649   4.849
   82    HA   ALA  14           HA       ALA  14   5.704  -7.410   4.710
   83    HB1  ALA  14           HB1      ALA  14   3.470  -7.021   2.898
   84    HB2  ALA  14           HB2      ALA  14   5.164  -7.366   2.548
   85    HB3  ALA  14           HB3      ALA  14   4.640  -5.703   2.817
   86    H    THR  15           H        THR  15   6.552  -5.124   4.265
   87    HA   THR  15           HA       THR  15   5.551  -3.389   6.404
   88    HB   THR  15           HB       THR  15   8.190  -3.380   4.927
   89   HG21  THR  15          HG21      THR  15   7.560  -1.126   5.716
   90   HG22  THR  15          HG22      THR  15   8.986  -1.781   6.519
   91   HG23  THR  15          HG23      THR  15   7.432  -1.773   7.352
   92    H    CYS  16           H        CYS  16   5.337  -1.116   6.069
   93    HA   CYS  16           HA       CYS  16   4.592  -0.458   3.305
   94    HB2  CYS  16           HB2      CYS  16   2.974  -0.273   5.356
   95    HB3  CYS  16           HB3      CYS  16   3.843   1.225   5.671
   96    H    LEU  17           H        LEU  17   5.736   0.979   2.182
   97    HA   LEU  17           HA       LEU  17   7.598   2.731   3.649
   98    HB2  LEU  17           HB2      LEU  17   8.501   0.764   2.182
   99    HB3  LEU  17           HB3      LEU  17   8.122   1.833   0.843
  100    HG   LEU  17           HG       LEU  17   9.553   3.532   2.355
  101   HD11  LEU  17          HD11      LEU  17  11.074   2.598   3.732
  102   HD12  LEU  17          HD12      LEU  17  11.234   1.144   2.747
  103   HD13  LEU  17          HD13      LEU  17   9.866   1.317   3.846
  104   HD21  LEU  17          HD21      LEU  17  10.208   1.657   0.167
  105   HD22  LEU  17          HD22      LEU  17  11.568   2.430   0.981
  106   HD23  LEU  17          HD23      LEU  17  10.315   3.416   0.227
  107    H    ASP  18           H        ASP  18   5.919   4.342   3.655
  108    HA   ASP  18           HA       ASP  18   4.638   5.338   1.386
  109    HB2  ASP  18           HB2      ASP  18   4.448   7.465   2.781
  110    HB3  ASP  18           HB3      ASP  18   3.788   5.999   3.492
  111    H    GLN  19           H        GLN  19   5.307   6.526  -0.284
  112    HA   GLN  19           HA       GLN  19   7.993   7.711  -0.146
  113    HB2  GLN  19           HB2      GLN  19   6.408   6.501  -2.375
  114    HB3  GLN  19           HB3      GLN  19   7.632   7.707  -2.745
  115    HG2  GLN  19           HG2      GLN  19   8.734   5.784  -0.952
  116    HG3  GLN  19           HG3      GLN  19   7.974   4.949  -2.305
  117   HE21  GLN  19          HE21      GLN  19  10.080   4.282  -2.941
  118   HE22  GLN  19          HE22      GLN  19  11.123   5.360  -3.797
  119    H    ILE  20           H        ILE  20   4.793   8.287  -1.580
  120    HA   ILE  20           HA       ILE  20   5.134  11.139  -1.048
  121    HB   ILE  20           HB       ILE  20   4.197  10.120  -3.728
  122   HG12  ILE  20          HG12      ILE  20   6.440  11.530  -4.270
  123   HG13  ILE  20          HG13      ILE  20   6.873  10.857  -2.701
  124   HG21  ILE  20          HG21      ILE  20   3.572  12.471  -2.528
  125   HG22  ILE  20          HG22      ILE  20   3.660  12.232  -4.273
  126   HG23  ILE  20          HG23      ILE  20   5.037  12.912  -3.405
  127   HD11  ILE  20          HD11      ILE  20   6.277   9.438  -5.260
  128   HD12  ILE  20          HD12      ILE  20   6.130   8.610  -3.710
  129   HD13  ILE  20          HD13      ILE  20   7.680   9.295  -4.201
  130    H    GLY  21           H        GLY  21   2.724   9.310  -2.907
  131    HA2  GLY  21           HA2      GLY  21   0.740   9.986  -0.831
  132    HA3  GLY  21           HA3      GLY  21   0.407  10.288  -2.527
  133    H    GLU  22           H        GLU  22   1.943   7.660  -3.076
  134    HA   GLU  22           HA       GLU  22  -0.424   5.987  -2.868
  135    HB2  GLU  22           HB2      GLU  22   0.871   4.431  -4.329
  136    HB3  GLU  22           HB3      GLU  22   0.635   6.029  -5.021
  137    HG2  GLU  22           HG2      GLU  22   2.814   6.216  -5.322
  138    HG3  GLU  22           HG3      GLU  22   3.063   6.090  -3.582
  139    H    PHE  23           H        PHE  23   0.257   3.512  -2.606
  140    HA   PHE  23           HA       PHE  23   1.698   3.360  -0.052
  141    HB2  PHE  23           HB2      PHE  23   0.348   1.393   0.457
  142    HB3  PHE  23           HB3      PHE  23  -0.683   2.772   0.088
  143    HD1  PHE  23           HD1      PHE  23   0.523  -0.476  -1.070
  144    HD2  PHE  23           HD2      PHE  23  -2.035   2.821  -1.893
  145    HE1  PHE  23           HE1      PHE  23  -0.633  -1.810  -2.787
  146    HE2  PHE  23           HE2      PHE  23  -3.199   1.496  -3.613
  147    HZ   PHE  23           HZ       PHE  23  -2.496  -0.824  -4.062
  148    H    GLN  24           H        GLN  24   3.425   2.056   0.149
  149    HA   GLN  24           HA       GLN  24   4.094   0.336  -2.149
  150    HB2  GLN  24           HB2      GLN  24   5.894   1.920  -0.314
  151    HB3  GLN  24           HB3      GLN  24   6.490   0.681  -1.410
  152    HG2  GLN  24           HG2      GLN  24   4.841   2.964  -2.419
  153    HG3  GLN  24           HG3      GLN  24   6.575   3.137  -2.151
  154   HE21  GLN  24          HE21      GLN  24   7.676   0.910  -3.007
  155   HE22  GLN  24          HE22      GLN  24   7.324   0.608  -4.671
  156    H    CYS  25           H        CYS  25   3.788  -1.729  -1.650
  157    HA   CYS  25           HA       CYS  25   4.022  -2.628   1.107
  158    HB2  CYS  25           HB2      CYS  25   2.730  -3.617  -1.350
  159    HB3  CYS  25           HB3      CYS  25   3.424  -4.872  -0.331
  160    H    ILE  26           H        ILE  26   5.838  -3.442   1.893
  161    HA   ILE  26           HA       ILE  26   7.985  -4.207   0.082
  162    HB   ILE  26           HB       ILE  26   8.051  -4.157   3.098
  163   HG12  ILE  26          HG12      ILE  26   8.923  -1.971   1.197
  164   HG13  ILE  26          HG13      ILE  26   7.409  -1.949   2.096
  165   HG21  ILE  26          HG21      ILE  26  10.401  -4.189   2.900
  166   HG22  ILE  26          HG22      ILE  26  10.337  -3.866   1.168
  167   HG23  ILE  26          HG23      ILE  26   9.811  -5.428   1.793
  168   HD11  ILE  26          HD11      ILE  26   9.900  -0.985   2.911
  169   HD12  ILE  26          HD12      ILE  26   9.600  -2.430   3.878
  170   HD13  ILE  26          HD13      ILE  26   8.425  -1.113   3.871
  171    H    CYS  27           H        CYS  27   7.561  -6.198  -0.738
  172    HA   CYS  27           HA       CYS  27   6.575  -8.339   0.913
  173    HB2  CYS  27           HB2      CYS  27   6.985  -7.852  -1.931
  174    HB3  CYS  27           HB3      CYS  27   7.466  -9.478  -1.457
  175    H    MET  28           H        MET  28   7.700 -10.457   0.975
  176    HA   MET  28           HA       MET  28  10.218 -10.225   2.182
  177    HB2  MET  28           HB2      MET  28   8.319 -12.316   1.610
  178    HB3  MET  28           HB3      MET  28   9.948 -12.886   1.281
  179    HG2  MET  28           HG2      MET  28  10.361 -11.724   3.656
  180    HG3  MET  28           HG3      MET  28   8.665 -12.168   3.836
  181    HE1  MET  28           HE1      MET  28  11.611 -12.923   5.079
  182    HE2  MET  28           HE2      MET  28  12.418 -13.702   3.719
  183    HE3  MET  28           HE3      MET  28  11.894 -14.664   5.101
  184    HA   PRO  29           HA       PRO  29  13.125 -10.585  -1.124
  185    HB2  PRO  29           HB2      PRO  29  14.954 -12.350  -0.289
  186    HB3  PRO  29           HB3      PRO  29  14.745 -10.786   0.502
  187    HG2  PRO  29           HG2      PRO  29  13.729 -13.477   1.334
  188    HG3  PRO  29           HG3      PRO  29  14.464 -12.204   2.326
  189    HD2  PRO  29           HD2      PRO  29  11.770 -12.619   2.161
  190    HD3  PRO  29           HD3      PRO  29  12.495 -11.036   2.501
  191    H    GLY  30           H        GLY  30  11.262 -11.655  -2.370
  192    HA2  GLY  30           HA2      GLY  30  11.704 -13.223  -4.304
  193    HA3  GLY  30           HA3      GLY  30  11.989 -14.433  -3.062
  194    H    TYR  31           H        TYR  31   9.471 -11.948  -3.126
  195    HA   TYR  31           HA       TYR  31   7.472 -14.103  -3.059
  196    HB2  TYR  31           HB2      TYR  31   7.660 -11.434  -1.760
  197    HB3  TYR  31           HB3      TYR  31   6.059 -11.995  -2.223
  198    HD1  TYR  31           HD1      TYR  31   8.928 -13.999  -0.965
  199    HD2  TYR  31           HD2      TYR  31   5.038 -12.471  -0.171
  200    HE1  TYR  31           HE1      TYR  31   8.820 -15.355   1.084
  201    HE2  TYR  31           HE2      TYR  31   4.919 -13.822   1.880
  202    HH   TYR  31           HH       TYR  31   6.072 -16.051   2.685
  203    H    GLU  32           H        GLU  32   5.200 -12.937  -3.749
  204    HA   GLU  32           HA       GLU  32   5.563 -11.397  -6.191
  205    HB2  GLU  32           HB2      GLU  32   4.374 -14.168  -6.129
  206    HB3  GLU  32           HB3      GLU  32   4.080 -13.034  -7.441
  207    HG2  GLU  32           HG2      GLU  32   6.781 -12.969  -7.310
  208    HG3  GLU  32           HG3      GLU  32   6.459 -14.632  -6.819
  209    H    GLY  33           H        GLY  33   3.294 -11.021  -7.223
  210    HA2  GLY  33           HA2      GLY  33   0.935 -10.761  -6.838
  211    HA3  GLY  33           HA3      GLY  33   1.258 -10.775  -5.110
  212    H    VAL  34           H        VAL  34  -0.336  -8.828  -6.153
  213    HA   VAL  34           HA       VAL  34   1.284  -6.449  -6.581
  214    HB   VAL  34           HB       VAL  34  -1.723  -6.613  -6.372
  215   HG11  VAL  34          HG11      VAL  34  -1.382  -4.382  -6.310
  216   HG12  VAL  34          HG12      VAL  34  -1.198  -4.578  -8.052
  217   HG13  VAL  34          HG13      VAL  34   0.230  -4.500  -7.019
  218   HG21  VAL  34          HG21      VAL  34   0.033  -6.862  -8.813
  219   HG22  VAL  34          HG22      VAL  34  -1.719  -6.660  -8.842
  220   HG23  VAL  34          HG23      VAL  34  -1.011  -8.110  -8.132
  221    H    TYR  35           H        TYR  35  -1.115  -7.644  -4.247
  222    HA   TYR  35           HA       TYR  35  -0.352  -5.489  -2.408
  223    HB2  TYR  35           HB2      TYR  35  -2.806  -7.059  -2.862
  224    HB3  TYR  35           HB3      TYR  35  -2.415  -6.775  -1.169
  225    HD1  TYR  35           HD1      TYR  35  -1.652  -4.223  -0.710
  226    HD2  TYR  35           HD2      TYR  35  -4.191  -5.522  -3.867
  227    HE1  TYR  35           HE1      TYR  35  -2.606  -1.961  -0.866
  228    HE2  TYR  35           HE2      TYR  35  -5.152  -3.265  -4.033
  229    HH   TYR  35           HH       TYR  35  -5.422  -1.255  -2.418
  230    H    CYS  36           H        CYS  36   1.306  -7.862  -2.951
  231    HA   CYS  36           HA       CYS  36   2.554  -9.406  -1.844
  232    HB2  CYS  36           HB2      CYS  36   1.846  -7.402   0.244
  233    HB3  CYS  36           HB3      CYS  36   2.589  -8.907   0.773
  234    H    GLU  37           H        GLU  37   1.343 -11.237  -2.243
  235    HA   GLU  37           HA       GLU  37   0.263 -12.556   0.025
  236    HB2  GLU  37           HB2      GLU  37  -1.662 -11.135  -0.415
  237    HB3  GLU  37           HB3      GLU  37  -1.692 -11.648  -2.095
  238    HG2  GLU  37           HG2      GLU  37  -2.508 -13.751  -1.576
  239    HG3  GLU  37           HG3      GLU  37  -1.963 -13.658   0.099
  240    H    ILE  38           H        ILE  38   0.394 -12.402  -3.507
  241    HA   ILE  38           HA       ILE  38   0.299 -15.303  -3.713
  242    HB   ILE  38           HB       ILE  38   0.722 -13.326  -5.950
  243   HG12  ILE  38          HG12      ILE  38  -1.344 -12.741  -4.806
  244   HG13  ILE  38          HG13      ILE  38  -1.719 -13.508  -6.345
  245   HG21  ILE  38          HG21      ILE  38   0.468 -15.048  -7.389
  246   HG22  ILE  38          HG22      ILE  38  -0.685 -15.888  -6.353
  247   HG23  ILE  38          HG23      ILE  38   1.042 -15.989  -6.011
  248   HD11  ILE  38          HD11      ILE  38  -2.139 -14.495  -3.578
  249   HD12  ILE  38          HD12      ILE  38  -1.843 -15.670  -4.860
  250   HD13  ILE  38          HD13      ILE  38  -3.208 -14.558  -4.979
  251    H1   FUC  39           H1       FUC  39   9.947  -3.498   6.844
  252    H2   FUC  39           H2       FUC  39  10.840  -5.404   8.103
  253    H3   FUC  39           H3       FUC  39   7.965  -6.428   8.104
  254    H4   FUC  39           H4       FUC  39   8.787  -8.246   6.728
  255    H5   FUC  39           H5       FUC  39   7.977  -6.229   5.568
  256    H61  FUC  39           H61      FUC  39   8.884  -8.038   4.121
  257    H62  FUC  39           H62      FUC  39   9.201  -6.421   3.420
  258    H63  FUC  39           H63      FUC  39  10.515  -7.312   4.238
  259    HO2  FUC  39           HO2      FUC  39   8.401  -4.365   9.197
  260    HO4  FUC  39           HO4      FUC  39  10.974  -8.157   5.966
  261    H1   NAG  40           H1       NAG  40   7.988  -8.751   9.153
  262    H2   NAG  40           H2       NAG  40   9.624  -8.087  11.668
  263    H3   NAG  40           H3       NAG  40   7.563 -10.318  11.220
  264    H4   NAG  40           H4       NAG  40   7.343  -7.799  12.960
  265    H5   NAG  40           H5       NAG  40   5.914  -8.480  10.319
  266    H61  NAG  40           H61      NAG  40   5.087  -6.185  10.395
  267    H62  NAG  40           H62      NAG  40   4.521  -7.140  11.783
  268    H81  NAG  40           H81      NAG  40  12.212 -10.677   9.078
  269    H82  NAG  40           H82      NAG  40  13.319 -10.417  10.458
  270    H83  NAG  40           H83      NAG  40  12.018 -11.639  10.574
  271    HN2  NAG  40           HN2      NAG  40   9.733 -10.547  10.014
  272    HO3  NAG  40           HO3      NAG  40   9.175  -9.495  13.391
  273    HO4  NAG  40           HO4      NAG  40   5.257  -9.552  12.179
  274    HO6  NAG  40           HO6      NAG  40   5.403  -5.635  12.987
  Start of MODEL    5
    1    H1   ASP   1           H1       ASP   1 -12.467   6.592   0.961
    2    HA   ASP   1           HA       ASP   1 -12.916   7.542  -1.140
    3    HB2  ASP   1           HB2      ASP   1 -11.512   9.815   0.160
    4    HB3  ASP   1           HB3      ASP   1 -11.409   9.717  -1.595
    5    H    VAL   2           H        VAL   2  -9.687   7.601   0.285
    6    HA   VAL   2           HA       VAL   2  -8.686   6.237  -2.124
    7    HB   VAL   2           HB       VAL   2  -7.074   8.218  -0.515
    8   HG11  VAL   2          HG11      VAL   2  -6.329   7.491  -3.271
    9   HG12  VAL   2          HG12      VAL   2  -6.165   6.211  -2.070
   10   HG13  VAL   2          HG13      VAL   2  -5.318   7.742  -1.848
   11   HG21  VAL   2          HG21      VAL   2  -7.443   9.856  -2.160
   12   HG22  VAL   2          HG22      VAL   2  -9.038   9.186  -1.819
   13   HG23  VAL   2          HG23      VAL   2  -8.168   8.695  -3.273
   14    H    ASN   3           H        ASN   3  -7.662   4.377  -1.740
   15    HA   ASN   3           HA       ASN   3  -6.992   3.728   1.050
   16    HB2  ASN   3           HB2      ASN   3  -8.696   2.330  -0.270
   17    HB3  ASN   3           HB3      ASN   3  -7.313   1.724  -1.176
   18   HD21  ASN   3          HD21      ASN   3  -7.857  -0.360  -0.376
   19   HD22  ASN   3          HD22      ASN   3  -7.396  -0.833   1.220
   20    H    GLU   4           H        GLU   4  -4.912   3.738   1.556
   21    HA   GLU   4           HA       GLU   4  -2.957   2.919  -0.479
   22    HB2  GLU   4           HB2      GLU   4  -1.459   4.654   0.908
   23    HB3  GLU   4           HB3      GLU   4  -2.376   5.114  -0.518
   24    HG2  GLU   4           HG2      GLU   4  -3.854   6.351   0.659
   25    HG3  GLU   4           HG3      GLU   4  -3.787   5.296   2.069
   26    H    CYS   5           H        CYS   5  -2.546   3.983   2.871
   27    HA   CYS   5           HA       CYS   5  -1.906   1.249   3.674
   28    HB2  CYS   5           HB2      CYS   5   0.104   3.053   3.023
   29    HB3  CYS   5           HB3      CYS   5   0.016   3.141   4.778
   30    H    ILE   6           H        ILE   6  -3.954   1.533   4.772
   31    HA   ILE   6           HA       ILE   6  -3.807   3.270   7.137
   32    HB   ILE   6           HB       ILE   6  -6.281   1.959   6.067
   33   HG12  ILE   6          HG12      ILE   6  -5.304   3.461   4.359
   34   HG13  ILE   6          HG13      ILE   6  -6.837   4.067   4.981
   35   HG21  ILE   6          HG21      ILE   6  -6.944   2.608   8.118
   36   HG22  ILE   6          HG22      ILE   6  -7.091   4.187   7.344
   37   HG23  ILE   6          HG23      ILE   6  -5.647   3.793   8.277
   38   HD11  ILE   6          HD11      ILE   6  -5.276   5.395   6.618
   39   HD12  ILE   6          HD12      ILE   6  -5.591   5.975   4.982
   40   HD13  ILE   6          HD13      ILE   6  -4.087   5.127   5.342
   41    H    SER   7           H        SER   7  -5.382   0.196   6.307
   42    HA   SER   7           HA       SER   7  -4.633  -0.808   8.962
   43    HB2  SER   7           HB2      SER   7  -7.106  -0.648   8.240
   44    HB3  SER   7           HB3      SER   7  -6.750  -2.033   7.207
   45    HG   SER   7           HG       SER   7  -7.160  -3.130   8.954
   46    H    ASN   8           H        ASN   8  -2.558  -0.950   7.377
   47    HA   ASN   8           HA       ASN   8  -1.023  -2.302   6.378
   48    HB2  ASN   8           HB2      ASN   8  -1.290  -3.539   8.479
   49    HB3  ASN   8           HB3      ASN   8  -2.627  -4.445   7.788
   50   HD21  ASN   8          HD21      ASN   8  -0.899  -6.013   8.723
   51   HD22  ASN   8          HD22      ASN   8   0.167  -6.669   7.540
   52    HA   PRO   9           HA       PRO   9  -3.726  -3.198   2.759
   53    HB2  PRO   9           HB2      PRO   9  -1.751  -2.582   0.949
   54    HB3  PRO   9           HB3      PRO   9  -2.900  -1.412   1.602
   55    HG2  PRO   9           HG2      PRO   9  -0.076  -1.957   2.410
   56    HG3  PRO   9           HG3      PRO   9  -0.922  -0.406   2.268
   57    HD2  PRO   9           HD2      PRO   9  -0.483  -1.583   4.651
   58    HD3  PRO   9           HD3      PRO   9  -1.948  -0.633   4.327
   59    H    CYS  10           H        CYS  10  -0.323  -4.088   3.248
   60    HA   CYS  10           HA       CYS  10  -0.195  -6.181   1.408
   61    HB2  CYS  10           HB2      CYS  10   1.268  -6.138   4.049
   62    HB3  CYS  10           HB3      CYS  10   1.772  -6.906   2.548
   63    H    GLN  11           H        GLN  11  -0.235  -8.481   1.738
   64    HA   GLN  11           HA       GLN  11  -2.054  -9.302   3.905
   65    HB2  GLN  11           HB2      GLN  11  -2.170  -9.744   0.995
   66    HB3  GLN  11           HB3      GLN  11  -2.484 -11.171   1.971
   67    HG2  GLN  11           HG2      GLN  11  -3.906  -8.561   2.391
   68    HG3  GLN  11           HG3      GLN  11  -4.491  -9.810   1.293
   69   HE21  GLN  11          HE21      GLN  11  -5.843 -11.238   2.106
   70   HE22  GLN  11          HE22      GLN  11  -6.047 -11.610   3.781
   71    H    ASN  12           H        ASN  12   0.917  -9.357   3.775
   72    HA   ASN  12           HA       ASN  12   1.213 -12.142   4.547
   73    HB2  ASN  12           HB2      ASN  12   2.368 -11.001   2.099
   74    HB3  ASN  12           HB3      ASN  12   3.522 -11.859   3.111
   75   HD21  ASN  12          HD21      ASN  12   3.155 -12.877   0.753
   76   HD22  ASN  12          HD22      ASN  12   2.189 -14.299   0.810
   77    H    ASP  13           H        ASP  13   1.433  -9.245   5.621
   78    HA   ASP  13           HA       ASP  13   2.561  -8.287   7.354
   79    HB2  ASP  13           HB2      ASP  13   2.984 -10.909   7.828
   80    HB3  ASP  13           HB3      ASP  13   4.642 -10.395   7.533
   81    H    ALA  14           H        ALA  14   3.082  -7.141   5.154
   82    HA   ALA  14           HA       ALA  14   5.967  -7.154   4.657
   83    HB1  ALA  14           HB1      ALA  14   4.712  -5.406   2.862
   84    HB2  ALA  14           HB2      ALA  14   3.642  -6.798   3.014
   85    HB3  ALA  14           HB3      ALA  14   5.322  -7.029   2.536
   86    H    THR  15           H        THR  15   6.975  -4.994   4.240
   87    HA   THR  15           HA       THR  15   6.263  -3.190   6.409
   88    HB   THR  15           HB       THR  15   8.651  -3.284   4.557
   89   HG21  THR  15          HG21      THR  15   8.379  -1.553   6.995
   90   HG22  THR  15          HG22      THR  15   8.126  -0.965   5.352
   91   HG23  THR  15          HG23      THR  15   9.702  -1.596   5.830
   92    H    CYS  16           H        CYS  16   5.495  -1.158   6.170
   93    HA   CYS  16           HA       CYS  16   4.783  -0.333   3.443
   94    HB2  CYS  16           HB2      CYS  16   2.907  -0.574   5.001
   95    HB3  CYS  16           HB3      CYS  16   3.664   0.568   6.106
   96    H    LEU  17           H        LEU  17   5.386   1.617   2.613
   97    HA   LEU  17           HA       LEU  17   6.878   3.468   4.319
   98    HB2  LEU  17           HB2      LEU  17   8.167   1.696   2.635
   99    HB3  LEU  17           HB3      LEU  17   8.091   3.166   1.682
  100    HG   LEU  17           HG       LEU  17  10.189   3.008   2.930
  101   HD11  LEU  17          HD11      LEU  17   8.679   5.199   2.612
  102   HD12  LEU  17          HD12      LEU  17  10.272   5.220   3.370
  103   HD13  LEU  17          HD13      LEU  17   8.819   5.188   4.370
  104   HD21  LEU  17          HD21      LEU  17  10.354   2.598   5.144
  105   HD22  LEU  17          HD22      LEU  17   8.775   1.852   4.903
  106   HD23  LEU  17          HD23      LEU  17   8.887   3.496   5.530
  107    H    ASP  18           H        ASP  18   6.575   5.581   3.830
  108    HA   ASP  18           HA       ASP  18   4.707   6.160   1.650
  109    HB2  ASP  18           HB2      ASP  18   4.644   6.942   4.256
  110    HB3  ASP  18           HB3      ASP  18   5.439   8.328   3.515
  111    H    GLN  19           H        GLN  19   5.284   7.281  -0.106
  112    HA   GLN  19           HA       GLN  19   7.967   8.496  -0.134
  113    HB2  GLN  19           HB2      GLN  19   6.398   7.080  -2.273
  114    HB3  GLN  19           HB3      GLN  19   7.720   8.165  -2.679
  115    HG2  GLN  19           HG2      GLN  19   9.319   6.773  -1.805
  116    HG3  GLN  19           HG3      GLN  19   8.189   5.991  -0.702
  117   HE21  GLN  19          HE21      GLN  19   9.910   4.493  -2.187
  118   HE22  GLN  19          HE22      GLN  19   9.040   3.620  -3.398
  119    H    ILE  20           H        ILE  20   5.229   8.798  -2.357
  120    HA   ILE  20           HA       ILE  20   5.327  11.708  -1.949
  121    HB   ILE  20           HB       ILE  20   4.324  10.296  -4.414
  122   HG12  ILE  20          HG12      ILE  20   6.739   9.869  -4.057
  123   HG13  ILE  20          HG13      ILE  20   6.438  10.868  -5.475
  124   HG21  ILE  20          HG21      ILE  20   5.206  13.153  -4.162
  125   HG22  ILE  20          HG22      ILE  20   3.550  12.654  -3.815
  126   HG23  ILE  20          HG23      ILE  20   4.227  12.406  -5.425
  127   HD11  ILE  20          HD11      ILE  20   8.343  11.457  -3.790
  128   HD12  ILE  20          HD12      ILE  20   7.025  12.197  -2.881
  129   HD13  ILE  20          HD13      ILE  20   7.367  12.729  -4.527
  130    H    GLY  21           H        GLY  21   3.000   9.358  -3.259
  131    HA2  GLY  21           HA2      GLY  21   1.030  10.096  -1.269
  132    HA3  GLY  21           HA3      GLY  21   0.658  10.643  -2.896
  133    H    GLU  22           H        GLU  22   2.373   7.662  -2.339
  134    HA   GLU  22           HA       GLU  22  -0.076   6.154  -2.972
  135    HB2  GLU  22           HB2      GLU  22   2.678   5.544  -4.058
  136    HB3  GLU  22           HB3      GLU  22   1.185   4.699  -4.442
  137    HG2  GLU  22           HG2      GLU  22   0.312   6.716  -5.504
  138    HG3  GLU  22           HG3      GLU  22   1.808   7.565  -5.117
  139    H    PHE  23           H        PHE  23   0.450   3.681  -2.657
  140    HA   PHE  23           HA       PHE  23   1.619   3.445   0.021
  141    HB2  PHE  23           HB2      PHE  23   0.217   1.494   0.332
  142    HB3  PHE  23           HB3      PHE  23  -0.771   2.850  -0.202
  143    HD1  PHE  23           HD1      PHE  23  -1.504   2.955  -2.584
  144    HD2  PHE  23           HD2      PHE  23   0.341  -0.490  -0.906
  145    HE1  PHE  23           HE1      PHE  23  -2.377   1.591  -4.440
  146    HE2  PHE  23           HE2      PHE  23  -0.525  -1.864  -2.758
  147    HZ   PHE  23           HZ       PHE  23  -1.886  -0.823  -4.528
  148    H    GLN  24           H        GLN  24   3.481   2.405   0.254
  149    HA   GLN  24           HA       GLN  24   4.387   0.659  -1.933
  150    HB2  GLN  24           HB2      GLN  24   5.668   2.808  -0.913
  151    HB3  GLN  24           HB3      GLN  24   6.321   1.548   0.124
  152    HG2  GLN  24           HG2      GLN  24   6.320   0.856  -2.712
  153    HG3  GLN  24           HG3      GLN  24   7.304   2.264  -2.315
  154   HE21  GLN  24          HE21      GLN  24   9.088   0.907  -2.984
  155   HE22  GLN  24          HE22      GLN  24   9.777  -0.205  -1.857
  156    H    CYS  25           H        CYS  25   4.282  -1.445  -1.556
  157    HA   CYS  25           HA       CYS  25   4.415  -2.390   1.229
  158    HB2  CYS  25           HB2      CYS  25   2.299  -2.905   0.112
  159    HB3  CYS  25           HB3      CYS  25   3.168  -3.705  -1.192
  160    H    ILE  26           H        ILE  26   6.322  -3.207   1.762
  161    HA   ILE  26           HA       ILE  26   8.082  -4.295  -0.286
  162    HB   ILE  26           HB       ILE  26   8.637  -4.027   2.668
  163   HG12  ILE  26          HG12      ILE  26   9.246  -2.080   0.431
  164   HG13  ILE  26          HG13      ILE  26   8.055  -1.837   1.704
  165   HG21  ILE  26          HG21      ILE  26  10.445  -4.347   0.277
  166   HG22  ILE  26          HG22      ILE  26  10.131  -5.547   1.530
  167   HG23  ILE  26          HG23      ILE  26  10.991  -4.059   1.929
  168   HD11  ILE  26          HD11      ILE  26   9.870  -0.605   2.425
  169   HD12  ILE  26          HD12      ILE  26  11.035  -1.813   1.883
  170   HD13  ILE  26          HD13      ILE  26  10.045  -2.120   3.311
  171    H    CYS  27           H        CYS  27   7.426  -6.306  -0.856
  172    HA   CYS  27           HA       CYS  27   6.526  -8.216   1.107
  173    HB2  CYS  27           HB2      CYS  27   5.825  -7.945  -1.415
  174    HB3  CYS  27           HB3      CYS  27   7.221  -8.979  -1.703
  175    H    MET  28           H        MET  28   7.485 -10.438   1.143
  176    HA   MET  28           HA       MET  28  10.148 -10.339   2.001
  177    HB2  MET  28           HB2      MET  28   8.056 -12.310   1.799
  178    HB3  MET  28           HB3      MET  28   9.589 -13.013   1.303
  179    HG2  MET  28           HG2      MET  28  10.379 -11.763   3.534
  180    HG3  MET  28           HG3      MET  28   8.695 -12.076   3.950
  181    HE1  MET  28           HE1      MET  28  12.245 -14.691   3.807
  182    HE2  MET  28           HE2      MET  28  11.714 -13.974   5.327
  183    HE3  MET  28           HE3      MET  28  12.019 -12.945   3.928
  184    HA   PRO  29           HA       PRO  29  12.555 -11.080  -1.626
  185    HB2  PRO  29           HB2      PRO  29  14.427 -12.830  -0.874
  186    HB3  PRO  29           HB3      PRO  29  14.355 -11.205  -0.187
  187    HG2  PRO  29           HG2      PRO  29  13.383 -13.791   0.969
  188    HG3  PRO  29           HG3      PRO  29  14.267 -12.474   1.763
  189    HD2  PRO  29           HD2      PRO  29  11.557 -12.809   1.947
  190    HD3  PRO  29           HD3      PRO  29  12.366 -11.235   2.095
  191    H    GLY  30           H        GLY  30  11.562 -12.035  -3.317
  192    HA2  GLY  30           HA2      GLY  30  11.497 -13.864  -4.831
  193    HA3  GLY  30           HA3      GLY  30  11.685 -14.961  -3.471
  194    H    TYR  31           H        TYR  31   9.391 -12.351  -3.332
  195    HA   TYR  31           HA       TYR  31   7.223 -14.330  -3.359
  196    HB2  TYR  31           HB2      TYR  31   7.657 -11.735  -1.972
  197    HB3  TYR  31           HB3      TYR  31   6.004 -12.140  -2.420
  198    HD1  TYR  31           HD1      TYR  31   8.966 -13.747  -0.796
  199    HD2  TYR  31           HD2      TYR  31   4.737 -13.287  -0.870
  200    HE1  TYR  31           HE1      TYR  31   8.781 -15.168   1.203
  201    HE2  TYR  31           HE2      TYR  31   4.542 -14.705   1.128
  202    HH   TYR  31           HH       TYR  31   6.165 -16.665   2.161
  203    H    GLU  32           H        GLU  32   5.034 -12.966  -3.943
  204    HA   GLU  32           HA       GLU  32   5.465 -11.406  -6.368
  205    HB2  GLU  32           HB2      GLU  32   3.992 -14.036  -6.287
  206    HB3  GLU  32           HB3      GLU  32   3.756 -12.855  -7.567
  207    HG2  GLU  32           HG2      GLU  32   6.490 -13.865  -6.901
  208    HG3  GLU  32           HG3      GLU  32   5.407 -14.788  -7.942
  209    H    GLY  33           H        GLY  33   3.119 -10.913  -7.322
  210    HA2  GLY  33           HA2      GLY  33   0.894 -10.265  -6.888
  211    HA3  GLY  33           HA3      GLY  33   1.178 -10.518  -5.173
  212    H    VAL  34           H        VAL  34  -0.139  -8.278  -6.004
  213    HA   VAL  34           HA       VAL  34   1.772  -6.089  -6.128
  214    HB   VAL  34           HB       VAL  34  -1.240  -5.919  -6.002
  215   HG11  VAL  34          HG11      VAL  34  -0.264  -3.830  -5.437
  216   HG12  VAL  34          HG12      VAL  34  -0.792  -3.707  -7.115
  217   HG13  VAL  34          HG13      VAL  34   0.914  -3.951  -6.744
  218   HG21  VAL  34          HG21      VAL  34  -1.358  -5.978  -8.324
  219   HG22  VAL  34          HG22      VAL  34  -0.194  -7.248  -7.951
  220   HG23  VAL  34          HG23      VAL  34   0.369  -5.677  -8.518
  221    H    TYR  35           H        TYR  35  -0.685  -7.381  -3.936
  222    HA   TYR  35           HA       TYR  35   0.137  -5.452  -1.887
  223    HB2  TYR  35           HB2      TYR  35  -2.307  -7.124  -2.315
  224    HB3  TYR  35           HB3      TYR  35  -1.894  -6.621  -0.679
  225    HD1  TYR  35           HD1      TYR  35  -2.984  -5.491  -3.991
  226    HD2  TYR  35           HD2      TYR  35  -2.041  -4.286  -0.023
  227    HE1  TYR  35           HE1      TYR  35  -4.048  -3.315  -4.406
  228    HE2  TYR  35           HE2      TYR  35  -3.104  -2.106  -0.427
  229    HH   TYR  35           HH       TYR  35  -4.962  -1.237  -2.056
  230    H    CYS  36           H        CYS  36   1.783  -7.741  -2.687
  231    HA   CYS  36           HA       CYS  36   2.966  -9.477  -1.795
  232    HB2  CYS  36           HB2      CYS  36   3.655  -7.580  -0.340
  233    HB3  CYS  36           HB3      CYS  36   2.390  -8.031   0.798
  234    H    GLU  37           H        GLU  37   1.444 -11.110  -2.282
  235    HA   GLU  37           HA       GLU  37   0.476 -12.499   0.045
  236    HB2  GLU  37           HB2      GLU  37  -1.405 -11.017  -0.307
  237    HB3  GLU  37           HB3      GLU  37  -1.473 -11.443  -2.010
  238    HG2  GLU  37           HG2      GLU  37  -2.079 -13.734  -1.412
  239    HG3  GLU  37           HG3      GLU  37  -2.012 -13.302   0.296
  240    H    ILE  38           H        ILE  38   0.453 -12.296  -3.496
  241    HA   ILE  38           HA       ILE  38   0.317 -15.194  -3.718
  242    HB   ILE  38           HB       ILE  38   0.398 -13.026  -5.820
  243   HG12  ILE  38          HG12      ILE  38  -1.917 -13.813  -6.274
  244   HG13  ILE  38          HG13      ILE  38  -1.782 -14.918  -4.909
  245   HG21  ILE  38          HG21      ILE  38  -0.369 -15.196  -7.198
  246   HG22  ILE  38          HG22      ILE  38   0.726 -15.953  -6.039
  247   HG23  ILE  38          HG23      ILE  38   1.309 -14.662  -7.090
  248   HD11  ILE  38          HD11      ILE  38  -2.975 -12.650  -4.608
  249   HD12  ILE  38          HD12      ILE  38  -1.340 -11.995  -4.514
  250   HD13  ILE  38          HD13      ILE  38  -1.868 -13.218  -3.359
  251    H1   FUC  39           H1       FUC  39  10.652  -3.298   6.220
  252    H2   FUC  39           H2       FUC  39  11.707  -5.094   7.516
  253    H3   FUC  39           H3       FUC  39   8.859  -6.087   7.975
  254    H4   FUC  39           H4       FUC  39   9.502  -8.028   6.668
  255    H5   FUC  39           H5       FUC  39   8.547  -6.114   5.446
  256    H61  FUC  39           H61      FUC  39   9.522  -6.499   3.188
  257    H62  FUC  39           H62      FUC  39   9.250  -8.042   4.059
  258    H63  FUC  39           H63      FUC  39  10.900  -7.360   3.937
  259    HO2  FUC  39           HO2      FUC  39   9.427  -3.937   8.814
  260    HO4  FUC  39           HO4      FUC  39  11.774  -7.942   7.167
  261    H1   NAG  40           H1       NAG  40   9.032  -8.324   9.208
  262    H2   NAG  40           H2       NAG  40  10.946  -7.425  11.441
  263    H3   NAG  40           H3       NAG  40   8.874  -9.691  11.444
  264    H4   NAG  40           H4       NAG  40   8.823  -7.021  12.958
  265    H5   NAG  40           H5       NAG  40   7.106  -7.952  10.576
  266    H61  NAG  40           H61      NAG  40   6.345  -5.588  10.533
  267    H62  NAG  40           H62      NAG  40   5.818  -6.502  11.964
  268    H81  NAG  40           H81      NAG  40  12.960 -10.371   8.720
  269    H82  NAG  40           H82      NAG  40  13.486 -10.881  10.352
  270    H83  NAG  40           H83      NAG  40  14.409  -9.632   9.465
  271    HN2  NAG  40           HN2      NAG  40  10.895 -10.084  10.144
  272    HO3  NAG  40           HO3      NAG  40  10.302  -8.547  13.624
  273    HO4  NAG  40           HO4      NAG  40   7.604  -8.389  14.073
  274    HO6  NAG  40           HO6      NAG  40   8.156  -4.856  11.952
  Start of MODEL    6
    1    H1   ASP   1           H1       ASP   1  -5.661  14.461  -0.367
    2    HA   ASP   1           HA       ASP   1  -4.001  13.678   1.791
    3    HB2  ASP   1           HB2      ASP   1  -5.772  13.896   3.584
    4    HB3  ASP   1           HB3      ASP   1  -5.037  15.410   3.066
    5    H    VAL   2           H        VAL   2  -4.029  11.696   0.770
    6    HA   VAL   2           HA       VAL   2  -6.402  10.086   1.267
    7    HB   VAL   2           HB       VAL   2  -5.139  10.098  -1.474
    8   HG11  VAL   2          HG11      VAL   2  -6.516   8.397  -2.018
    9   HG12  VAL   2          HG12      VAL   2  -7.834   8.999  -1.013
   10   HG13  VAL   2          HG13      VAL   2  -6.504   8.103  -0.279
   11   HG21  VAL   2          HG21      VAL   2  -6.301  12.212  -1.094
   12   HG22  VAL   2          HG22      VAL   2  -7.747  11.336  -0.596
   13   HG23  VAL   2          HG23      VAL   2  -7.170  11.213  -2.258
   14    H    ASN   3           H        ASN   3  -5.285   8.863   2.742
   15    HA   ASN   3           HA       ASN   3  -2.773   7.615   1.939
   16    HB2  ASN   3           HB2      ASN   3  -4.242   7.903   4.538
   17    HB3  ASN   3           HB3      ASN   3  -3.008   6.660   4.362
   18   HD21  ASN   3          HD21      ASN   3  -2.786   8.706   6.194
   19   HD22  ASN   3          HD22      ASN   3  -1.482   9.741   5.732
   20    H    GLU   4           H        GLU   4  -2.477   5.424   1.704
   21    HA   GLU   4           HA       GLU   4  -4.947   3.833   1.502
   22    HB2  GLU   4           HB2      GLU   4  -2.329   3.626   0.014
   23    HB3  GLU   4           HB3      GLU   4  -3.576   2.387  -0.056
   24    HG2  GLU   4           HG2      GLU   4  -4.077   5.254  -0.794
   25    HG3  GLU   4           HG3      GLU   4  -3.540   4.038  -1.952
   26    H    CYS   5           H        CYS   5  -1.841   4.059   3.002
   27    HA   CYS   5           HA       CYS   5  -1.892   1.305   3.926
   28    HB2  CYS   5           HB2      CYS   5   0.228   2.490   3.232
   29    HB3  CYS   5           HB3      CYS   5   0.064   3.455   4.691
   30    H    ILE   6           H        ILE   6  -3.763   1.323   5.219
   31    HA   ILE   6           HA       ILE   6  -3.574   2.930   7.675
   32    HB   ILE   6           HB       ILE   6  -6.044   1.583   6.634
   33   HG12  ILE   6          HG12      ILE   6  -5.232   3.271   5.017
   34   HG13  ILE   6          HG13      ILE   6  -6.754   3.745   5.766
   35   HG21  ILE   6          HG21      ILE   6  -6.615   2.020   8.771
   36   HG22  ILE   6          HG22      ILE   6  -6.892   3.644   8.139
   37   HG23  ILE   6          HG23      ILE   6  -5.377   3.262   8.957
   38   HD11  ILE   6          HD11      ILE   6  -4.355   5.200   5.623
   39   HD12  ILE   6          HD12      ILE   6  -4.598   4.775   7.317
   40   HD13  ILE   6          HD13      ILE   6  -5.856   5.645   6.438
   41    H    SER   7           H        SER   7  -5.065  -0.147   6.715
   42    HA   SER   7           HA       SER   7  -4.130  -1.300   9.247
   43    HB2  SER   7           HB2      SER   7  -6.627  -1.234   8.716
   44    HB3  SER   7           HB3      SER   7  -6.292  -2.444   7.478
   45    HG   SER   7           HG       SER   7  -6.626  -3.735   9.129
   46    H    ASN   8           H        ASN   8  -2.111  -1.240   7.607
   47    HA   ASN   8           HA       ASN   8  -0.535  -2.465   6.522
   48    HB2  ASN   8           HB2      ASN   8  -0.809  -3.984   8.413
   49    HB3  ASN   8           HB3      ASN   8  -2.163  -4.768   7.613
   50   HD21  ASN   8          HD21      ASN   8  -0.464  -6.477   8.319
   51   HD22  ASN   8          HD22      ASN   8   0.589  -6.985   7.056
   52    HA   PRO   9           HA       PRO   9  -3.030  -2.758   2.688
   53    HB2  PRO   9           HB2      PRO   9  -0.796  -2.416   1.086
   54    HB3  PRO   9           HB3      PRO   9  -1.830  -1.112   1.676
   55    HG2  PRO   9           HG2      PRO   9   0.787  -2.086   2.731
   56    HG3  PRO   9           HG3      PRO   9   0.174  -0.427   2.602
   57    HD2  PRO   9           HD2      PRO   9   0.206  -1.740   4.942
   58    HD3  PRO   9           HD3      PRO   9  -1.107  -0.619   4.524
   59    H    CYS  10           H        CYS  10   0.210  -4.187   3.107
   60    HA   CYS  10           HA       CYS  10  -0.094  -6.241   1.226
   61    HB2  CYS  10           HB2      CYS  10   1.684  -5.832   3.602
   62    HB3  CYS  10           HB3      CYS  10   1.676  -7.391   2.783
   63    H    GLN  11           H        GLN  11  -0.277  -8.569   1.666
   64    HA   GLN  11           HA       GLN  11  -2.091  -9.127   3.919
   65    HB2  GLN  11           HB2      GLN  11  -2.404  -9.609   1.036
   66    HB3  GLN  11           HB3      GLN  11  -2.789 -10.993   2.046
   67    HG2  GLN  11           HG2      GLN  11  -3.948  -8.266   2.519
   68    HG3  GLN  11           HG3      GLN  11  -4.694  -9.450   1.448
   69   HE21  GLN  11          HE21      GLN  11  -6.446 -10.117   2.489
   70   HE22  GLN  11          HE22      GLN  11  -6.485 -10.724   4.105
   71    H    ASN  12           H        ASN  12   0.740  -9.461   3.959
   72    HA   ASN  12           HA       ASN  12   0.832 -12.311   4.530
   73    HB2  ASN  12           HB2      ASN  12   2.456 -10.962   2.418
   74    HB3  ASN  12           HB3      ASN  12   3.192 -12.260   3.345
   75   HD21  ASN  12          HD21      ASN  12   2.886 -12.500   0.685
   76   HD22  ASN  12          HD22      ASN  12   1.698 -13.695   0.342
   77    H    ASP  13           H        ASP  13   1.070  -9.536   5.866
   78    HA   ASP  13           HA       ASP  13   2.092  -8.746   7.743
   79    HB2  ASP  13           HB2      ASP  13   2.154 -11.251   8.319
   80    HB3  ASP  13           HB3      ASP  13   3.833 -11.207   7.791
   81    H    ALA  14           H        ALA  14   2.914  -7.733   5.440
   82    HA   ALA  14           HA       ALA  14   5.839  -7.773   5.427
   83    HB1  ALA  14           HB1      ALA  14   5.358  -6.328   3.296
   84    HB2  ALA  14           HB2      ALA  14   3.751  -7.041   3.434
   85    HB3  ALA  14           HB3      ALA  14   5.163  -8.081   3.255
   86    H    THR  15           H        THR  15   6.768  -5.517   4.753
   87    HA   THR  15           HA       THR  15   5.936  -3.663   6.836
   88    HB   THR  15           HB       THR  15   8.322  -3.661   4.977
   89   HG21  THR  15          HG21      THR  15   7.501  -1.722   7.095
   90   HG22  THR  15          HG22      THR  15   8.147  -1.414   5.483
   91   HG23  THR  15          HG23      THR  15   9.205  -2.023   6.757
   92    H    CYS  16           H        CYS  16   5.654  -1.385   6.406
   93    HA   CYS  16           HA       CYS  16   4.829  -0.774   3.650
   94    HB2  CYS  16           HB2      CYS  16   2.834  -1.258   5.037
   95    HB3  CYS  16           HB3      CYS  16   3.313   0.022   6.145
   96    H    LEU  17           H        LEU  17   5.588   1.098   2.877
   97    HA   LEU  17           HA       LEU  17   6.823   2.969   4.791
   98    HB2  LEU  17           HB2      LEU  17   7.983   1.613   2.634
   99    HB3  LEU  17           HB3      LEU  17   7.775   3.261   2.074
  100    HG   LEU  17           HG       LEU  17   9.990   2.917   3.051
  101   HD11  LEU  17          HD11      LEU  17   8.498   5.064   3.348
  102   HD12  LEU  17          HD12      LEU  17  10.071   4.928   4.131
  103   HD13  LEU  17          HD13      LEU  17   8.599   4.621   5.052
  104   HD21  LEU  17          HD21      LEU  17   8.380   1.808   5.265
  105   HD22  LEU  17          HD22      LEU  17   9.784   2.773   5.719
  106   HD23  LEU  17          HD23      LEU  17   9.984   1.357   4.688
  107    H    ASP  18           H        ASP  18   6.684   5.214   4.338
  108    HA   ASP  18           HA       ASP  18   4.180   5.957   3.106
  109    HB2  ASP  18           HB2      ASP  18   5.128   6.927   5.273
  110    HB3  ASP  18           HB3      ASP  18   6.233   7.844   4.253
  111    H    GLN  19           H        GLN  19   3.904   6.747   1.122
  112    HA   GLN  19           HA       GLN  19   6.165   7.975  -0.273
  113    HB2  GLN  19           HB2      GLN  19   4.848   5.438  -0.981
  114    HB3  GLN  19           HB3      GLN  19   5.010   6.574  -2.313
  115    HG2  GLN  19           HG2      GLN  19   7.479   6.744  -1.472
  116    HG3  GLN  19           HG3      GLN  19   7.117   5.180  -0.744
  117   HE21  GLN  19          HE21      GLN  19   5.667   3.862  -2.486
  118   HE22  GLN  19          HE22      GLN  19   6.473   3.681  -4.003
  119    H    ILE  20           H        ILE  20   5.466   9.103  -2.282
  120    HA   ILE  20           HA       ILE  20   2.905  10.421  -1.798
  121    HB   ILE  20           HB       ILE  20   5.026  11.225  -3.784
  122   HG12  ILE  20          HG12      ILE  20   5.279  13.022  -1.777
  123   HG13  ILE  20          HG13      ILE  20   4.866  11.584  -0.849
  124   HG21  ILE  20          HG21      ILE  20   3.018  12.297  -4.333
  125   HG22  ILE  20          HG22      ILE  20   3.907  13.484  -3.380
  126   HG23  ILE  20          HG23      ILE  20   2.596  12.564  -2.642
  127   HD11  ILE  20          HD11      ILE  20   6.897  10.735  -1.106
  128   HD12  ILE  20          HD12      ILE  20   7.373  12.316  -1.728
  129   HD13  ILE  20          HD13      ILE  20   6.888  11.039  -2.844
  130    H    GLY  21           H        GLY  21   1.191  10.256  -3.123
  131    HA2  GLY  21           HA2      GLY  21   0.007   9.862  -5.093
  132    HA3  GLY  21           HA3      GLY  21   1.499   9.336  -5.856
  133    H    GLU  22           H        GLU  22   2.381   7.266  -4.499
  134    HA   GLU  22           HA       GLU  22   0.117   5.389  -4.328
  135    HB2  GLU  22           HB2      GLU  22   2.844   4.833  -5.509
  136    HB3  GLU  22           HB3      GLU  22   1.538   3.667  -5.346
  137    HG2  GLU  22           HG2      GLU  22   0.325   5.679  -6.728
  138    HG3  GLU  22           HG3      GLU  22   1.971   5.741  -7.355
  139    H    PHE  23           H        PHE  23   0.636   3.393  -3.097
  140    HA   PHE  23           HA       PHE  23   2.081   4.111  -0.678
  141    HB2  PHE  23           HB2      PHE  23   1.053   2.034   0.242
  142    HB3  PHE  23           HB3      PHE  23  -0.122   3.205  -0.351
  143    HD1  PHE  23           HD1      PHE  23   1.778   0.209  -1.470
  144    HD2  PHE  23           HD2      PHE  23  -1.796   2.498  -1.751
  145    HE1  PHE  23           HE1      PHE  23   0.788  -1.526  -2.911
  146    HE2  PHE  23           HE2      PHE  23  -2.796   0.769  -3.192
  147    HZ   PHE  23           HZ       PHE  23  -1.503  -1.246  -3.774
  148    H    GLN  24           H        GLN  24   3.563   2.615   0.344
  149    HA   GLN  24           HA       GLN  24   4.976   0.897  -1.590
  150    HB2  GLN  24           HB2      GLN  24   6.015   3.188  -0.635
  151    HB3  GLN  24           HB3      GLN  24   6.519   2.092   0.644
  152    HG2  GLN  24           HG2      GLN  24   7.136   0.762  -1.721
  153    HG3  GLN  24           HG3      GLN  24   7.584   2.443  -2.008
  154   HE21  GLN  24          HE21      GLN  24   8.925   3.462  -0.311
  155   HE22  GLN  24          HE22      GLN  24  10.127   2.492   0.463
  156    H    CYS  25           H        CYS  25   5.201  -1.159  -0.999
  157    HA   CYS  25           HA       CYS  25   5.074  -1.833   1.860
  158    HB2  CYS  25           HB2      CYS  25   2.917  -2.243   0.400
  159    HB3  CYS  25           HB3      CYS  25   3.809  -3.662  -0.140
  160    H    ILE  26           H        ILE  26   6.967  -2.705   2.366
  161    HA   ILE  26           HA       ILE  26   8.513  -4.143   0.362
  162    HB   ILE  26           HB       ILE  26   9.284  -3.610   3.229
  163   HG12  ILE  26          HG12      ILE  26   9.971  -1.936   0.805
  164   HG13  ILE  26          HG13      ILE  26   8.718  -1.513   1.968
  165   HG21  ILE  26          HG21      ILE  26  11.336  -4.398   2.722
  166   HG22  ILE  26          HG22      ILE  26  11.287  -3.776   1.072
  167   HG23  ILE  26          HG23      ILE  26  10.452  -5.278   1.474
  168   HD11  ILE  26          HD11      ILE  26  10.385  -1.381   3.732
  169   HD12  ILE  26          HD12      ILE  26  10.788  -0.308   2.392
  170   HD13  ILE  26          HD13      ILE  26  11.645  -1.837   2.585
  171    H    CYS  27           H        CYS  27   7.579  -6.124   0.075
  172    HA   CYS  27           HA       CYS  27   6.901  -7.755   2.386
  173    HB2  CYS  27           HB2      CYS  27   6.038  -9.357   0.731
  174    HB3  CYS  27           HB3      CYS  27   5.373  -7.747   0.477
  175    H    MET  28           H        MET  28   7.467 -10.266   1.729
  176    HA   MET  28           HA       MET  28  10.153 -10.586   2.408
  177    HB2  MET  28           HB2      MET  28   7.897 -12.263   1.943
  178    HB3  MET  28           HB3      MET  28   9.257 -12.929   1.049
  179    HG2  MET  28           HG2      MET  28  10.408 -12.367   3.446
  180    HG3  MET  28           HG3      MET  28   8.771 -12.802   3.930
  181    HE1  MET  28           HE1      MET  28  11.693 -15.124   4.503
  182    HE2  MET  28           HE2      MET  28  11.991 -13.638   3.600
  183    HE3  MET  28           HE3      MET  28  12.239 -15.205   2.827
  184    HA   PRO  29           HA       PRO  29  12.262 -10.534  -1.481
  185    HB2  PRO  29           HB2      PRO  29  14.337 -12.136  -1.057
  186    HB3  PRO  29           HB3      PRO  29  14.122 -10.666  -0.102
  187    HG2  PRO  29           HG2      PRO  29  13.541 -13.504   0.634
  188    HG3  PRO  29           HG3      PRO  29  14.243 -12.211   1.622
  189    HD2  PRO  29           HD2      PRO  29  11.578 -13.002   1.671
  190    HD3  PRO  29           HD3      PRO  29  12.193 -11.444   2.253
  191    H    GLY  30           H        GLY  30  10.884 -11.427  -3.029
  192    HA2  GLY  30           HA2      GLY  30  11.138 -13.089  -4.827
  193    HA3  GLY  30           HA3      GLY  30  11.323 -14.300  -3.568
  194    H    TYR  31           H        TYR  31   8.954 -11.711  -3.464
  195    HA   TYR  31           HA       TYR  31   6.841 -13.739  -3.494
  196    HB2  TYR  31           HB2      TYR  31   7.109 -11.010  -2.315
  197    HB3  TYR  31           HB3      TYR  31   5.500 -11.582  -2.737
  198    HD1  TYR  31           HD1      TYR  31   8.157 -13.843  -1.562
  199    HD2  TYR  31           HD2      TYR  31   4.690 -11.631  -0.469
  200    HE1  TYR  31           HE1      TYR  31   8.046 -15.077   0.561
  201    HE2  TYR  31           HE2      TYR  31   4.570 -12.861   1.657
  202    HH   TYR  31           HH       TYR  31   5.977 -14.134   3.130
  203    H    GLU  32           H        GLU  32   4.649 -12.541  -4.298
  204    HA   GLU  32           HA       GLU  32   5.116 -11.044  -6.744
  205    HB2  GLU  32           HB2      GLU  32   4.325 -13.898  -6.676
  206    HB3  GLU  32           HB3      GLU  32   3.438 -12.872  -7.793
  207    HG2  GLU  32           HG2      GLU  32   5.081 -13.201  -9.238
  208    HG3  GLU  32           HG3      GLU  32   6.087 -12.185  -8.206
  209    H    GLY  33           H        GLY  33   2.738 -11.030  -7.919
  210    HA2  GLY  33           HA2      GLY  33   0.436 -10.629  -7.656
  211    HA3  GLY  33           HA3      GLY  33   0.648 -10.690  -5.912
  212    H    VAL  34           H        VAL  34  -0.816  -8.758  -6.175
  213    HA   VAL  34           HA       VAL  34   0.527  -6.326  -7.042
  214    HB   VAL  34           HB       VAL  34  -2.220  -6.582  -5.817
  215   HG11  VAL  34          HG11      VAL  34  -2.647  -4.428  -6.728
  216   HG12  VAL  34          HG12      VAL  34  -1.130  -4.439  -7.627
  217   HG13  VAL  34          HG13      VAL  34  -1.110  -4.329  -5.868
  218   HG21  VAL  34          HG21      VAL  34  -1.242  -7.184  -8.532
  219   HG22  VAL  34          HG22      VAL  34  -2.707  -6.206  -8.438
  220   HG23  VAL  34          HG23      VAL  34  -2.656  -7.794  -7.672
  221    H    TYR  35           H        TYR  35  -1.021  -7.557  -4.079
  222    HA   TYR  35           HA       TYR  35   0.389  -5.509  -2.530
  223    HB2  TYR  35           HB2      TYR  35  -2.090  -7.089  -2.147
  224    HB3  TYR  35           HB3      TYR  35  -1.150  -6.766  -0.695
  225    HD1  TYR  35           HD1      TYR  35  -0.140  -4.092  -1.062
  226    HD2  TYR  35           HD2      TYR  35  -3.928  -5.688  -2.157
  227    HE1  TYR  35           HE1      TYR  35  -1.121  -1.841  -0.928
  228    HE2  TYR  35           HE2      TYR  35  -4.920  -3.442  -2.028
  229    HH   TYR  35           HH       TYR  35  -3.312  -0.802  -0.608
  230    H    CYS  36           H        CYS  36   1.702  -7.883  -3.689
  231    HA   CYS  36           HA       CYS  36   3.196  -9.504  -3.123
  232    HB2  CYS  36           HB2      CYS  36   3.324  -7.560  -0.865
  233    HB3  CYS  36           HB3      CYS  36   4.162  -9.097  -0.678
  234    H    GLU  37           H        GLU  37   0.405 -10.011  -2.618
  235    HA   GLU  37           HA       GLU  37   0.477 -11.710  -0.230
  236    HB2  GLU  37           HB2      GLU  37  -1.917 -11.713  -0.300
  237    HB3  GLU  37           HB3      GLU  37  -1.376 -10.055  -0.507
  238    HG2  GLU  37           HG2      GLU  37  -2.412  -9.876  -2.453
  239    HG3  GLU  37           HG3      GLU  37  -1.668 -11.355  -3.059
  240    H    ILE  38           H        ILE  38   1.830 -12.402  -2.732
  241    HA   ILE  38           HA       ILE  38   0.458 -14.953  -3.227
  242    HB   ILE  38           HB       ILE  38   1.840 -13.401  -5.411
  243   HG12  ILE  38          HG12      ILE  38  -0.150 -12.169  -4.682
  244   HG13  ILE  38          HG13      ILE  38  -0.401 -12.877  -6.275
  245   HG21  ILE  38          HG21      ILE  38   0.182 -15.102  -6.655
  246   HG22  ILE  38          HG22      ILE  38   0.515 -16.029  -5.193
  247   HG23  ILE  38          HG23      ILE  38   1.844 -15.508  -6.228
  248   HD11  ILE  38          HD11      ILE  38  -1.292 -14.735  -4.323
  249   HD12  ILE  38          HD12      ILE  38  -2.228 -13.875  -5.546
  250   HD13  ILE  38          HD13      ILE  38  -1.982 -13.154  -3.954
  251    H1   FUC  39           H1       FUC  39  10.337  -3.727   6.290
  252    H2   FUC  39           H2       FUC  39  11.556  -5.204   7.806
  253    H3   FUC  39           H3       FUC  39   8.801  -6.058   8.802
  254    H4   FUC  39           H4       FUC  39   9.322  -8.240   7.871
  255    H5   FUC  39           H5       FUC  39   8.192  -6.630   6.399
  256    H61  FUC  39           H61      FUC  39   8.804  -8.833   5.401
  257    H62  FUC  39           H62      FUC  39  10.372  -8.153   4.880
  258    H63  FUC  39           H63      FUC  39   8.846  -7.524   4.183
  259    HO2  FUC  39           HO2      FUC  39   9.419  -3.785   9.085
  260    HO4  FUC  39           HO4      FUC  39  11.723  -6.990   6.926
  261    H1   NAG  40           H1       NAG  40   9.162  -7.985  10.446
  262    H2   NAG  40           H2       NAG  40  11.320  -6.665  12.195
  263    H3   NAG  40           H3       NAG  40   9.303  -8.862  12.912
  264    H4   NAG  40           H4       NAG  40   9.389  -5.939  13.846
  265    H5   NAG  40           H5       NAG  40   7.411  -7.326  11.935
  266    H61  NAG  40           H61      NAG  40   7.665  -4.369  12.550
  267    H62  NAG  40           H62      NAG  40   6.411  -5.188  11.592
  268    H81  NAG  40           H81      NAG  40  12.814  -9.987   9.327
  269    H82  NAG  40           H82      NAG  40  13.269 -10.453  10.993
  270    H83  NAG  40           H83      NAG  40  14.348  -9.398  10.034
  271    HN2  NAG  40           HN2      NAG  40  11.268  -9.549  11.792
  272    HO3  NAG  40           HO3      NAG  40  11.344  -7.490  14.307
  273    HO4  NAG  40           HO4      NAG  40   7.321  -7.871  14.147
  274    HO6  NAG  40           HO6      NAG  40   6.626  -4.901  14.331
  Start of MODEL    7
    1    H1   ASP   1           H1       ASP   1  -8.756  10.301   8.550
    2    HA   ASP   1           HA       ASP   1  -7.068  11.839   7.708
    3    HB2  ASP   1           HB2      ASP   1  -5.842  11.392  10.439
    4    HB3  ASP   1           HB3      ASP   1  -5.125  12.343   9.141
    5    H    VAL   2           H        VAL   2  -6.733  10.223   6.222
    6    HA   VAL   2           HA       VAL   2  -4.615   8.301   6.907
    7    HB   VAL   2           HB       VAL   2  -5.716   6.607   5.471
    8   HG11  VAL   2          HG11      VAL   2  -6.825   5.734   7.229
    9   HG12  VAL   2          HG12      VAL   2  -7.808   7.178   7.463
   10   HG13  VAL   2          HG13      VAL   2  -6.157   7.126   8.081
   11   HG21  VAL   2          HG21      VAL   2  -7.195   8.635   4.485
   12   HG22  VAL   2          HG22      VAL   2  -8.334   7.948   5.645
   13   HG23  VAL   2          HG23      VAL   2  -7.657   6.936   4.368
   14    H    ASN   3           H        ASN   3  -3.246   7.694   5.190
   15    HA   ASN   3           HA       ASN   3  -3.370   9.505   2.869
   16    HB2  ASN   3           HB2      ASN   3  -1.414   9.646   4.567
   17    HB3  ASN   3           HB3      ASN   3  -0.850   8.160   3.809
   18   HD21  ASN   3          HD21      ASN   3   1.004   9.201   3.066
   19   HD22  ASN   3          HD22      ASN   3   0.961  10.291   1.727
   20    H    GLU   4           H        GLU   4  -1.784   6.406   3.662
   21    HA   GLU   4           HA       GLU   4  -3.107   5.128   1.417
   22    HB2  GLU   4           HB2      GLU   4  -0.102   5.398   1.572
   23    HB3  GLU   4           HB3      GLU   4  -0.949   4.324   0.467
   24    HG2  GLU   4           HG2      GLU   4  -1.251   7.319   0.528
   25    HG3  GLU   4           HG3      GLU   4  -0.217   6.424  -0.585
   26    H    CYS   5           H        CYS   5  -0.455   4.696   3.744
   27    HA   CYS   5           HA       CYS   5  -1.202   1.913   4.121
   28    HB2  CYS   5           HB2      CYS   5   1.078   3.583   5.134
   29    HB3  CYS   5           HB3      CYS   5   0.798   1.940   5.691
   30    H    ILE   6           H        ILE   6  -2.926   1.610   5.397
   31    HA   ILE   6           HA       ILE   6  -2.978   3.022   7.980
   32    HB   ILE   6           HB       ILE   6  -5.406   2.080   6.490
   33   HG12  ILE   6          HG12      ILE   6  -4.313   3.867   5.222
   34   HG13  ILE   6          HG13      ILE   6  -5.812   4.444   5.944
   35   HG21  ILE   6          HG21      ILE   6  -4.905   3.330   9.105
   36   HG22  ILE   6          HG22      ILE   6  -6.216   2.270   8.584
   37   HG23  ILE   6          HG23      ILE   6  -6.258   3.989   8.186
   38   HD11  ILE   6          HD11      ILE   6  -4.627   5.631   7.630
   39   HD12  ILE   6          HD12      ILE   6  -3.903   6.034   6.074
   40   HD13  ILE   6          HD13      ILE   6  -3.098   4.894   7.152
   41    H    SER   7           H        SER   7  -4.680   0.263   6.525
   42    HA   SER   7           HA       SER   7  -4.074  -1.272   8.954
   43    HB2  SER   7           HB2      SER   7  -6.514  -0.783   8.230
   44    HB3  SER   7           HB3      SER   7  -6.233  -2.006   6.992
   45    HG   SER   7           HG       SER   7  -6.945  -2.425   9.460
   46    H    ASN   8           H        ASN   8  -2.008  -1.226   7.310
   47    HA   ASN   8           HA       ASN   8  -0.604  -2.428   5.964
   48    HB2  ASN   8           HB2      ASN   8  -0.702  -3.825   7.999
   49    HB3  ASN   8           HB3      ASN   8  -2.039  -4.729   7.301
   50   HD21  ASN   8          HD21      ASN   8  -0.189  -6.287   7.993
   51   HD22  ASN   8          HD22      ASN   8   0.828  -6.783   6.696
   52    HA   PRO   9           HA       PRO   9  -3.656  -2.995   2.541
   53    HB2  PRO   9           HB2      PRO   9  -1.699  -2.428   0.647
   54    HB3  PRO   9           HB3      PRO   9  -2.832  -1.261   1.328
   55    HG2  PRO   9           HG2      PRO   9   0.009  -1.797   2.055
   56    HG3  PRO   9           HG3      PRO   9  -0.867  -0.257   2.002
   57    HD2  PRO   9           HD2      PRO   9  -0.324  -1.494   4.321
   58    HD3  PRO   9           HD3      PRO   9  -1.833  -0.592   4.080
   59    H    CYS  10           H        CYS  10  -0.341  -4.172   2.886
   60    HA   CYS  10           HA       CYS  10  -0.377  -6.144   0.913
   61    HB2  CYS  10           HB2      CYS  10   1.192  -5.672   3.397
   62    HB3  CYS  10           HB3      CYS  10   1.270  -7.280   2.684
   63    H    GLN  11           H        GLN  11  -0.167  -8.580   1.538
   64    HA   GLN  11           HA       GLN  11  -2.239  -9.318   3.481
   65    HB2  GLN  11           HB2      GLN  11  -2.386  -9.572   0.589
   66    HB3  GLN  11           HB3      GLN  11  -2.573 -11.126   1.389
   67    HG2  GLN  11           HG2      GLN  11  -4.132  -8.968   2.593
   68    HG3  GLN  11           HG3      GLN  11  -4.569  -9.340   0.926
   69   HE21  GLN  11          HE21      GLN  11  -5.622 -11.206   0.472
   70   HE22  GLN  11          HE22      GLN  11  -6.148 -12.336   1.669
   71    H    ASN  12           H        ASN  12   0.704  -9.486   3.491
   72    HA   ASN  12           HA       ASN  12   0.880 -12.307   4.168
   73    HB2  ASN  12           HB2      ASN  12   2.362 -11.033   1.924
   74    HB3  ASN  12           HB3      ASN  12   3.231 -12.195   2.915
   75   HD21  ASN  12          HD21      ASN  12   2.914 -12.751   0.347
   76   HD22  ASN  12          HD22      ASN  12   1.771 -14.019   0.134
   77    H    ASP  13           H        ASP  13   1.052  -9.520   5.422
   78    HA   ASP  13           HA       ASP  13   2.101  -8.622   7.228
   79    HB2  ASP  13           HB2      ASP  13   2.910 -11.414   7.293
   80    HB3  ASP  13           HB3      ASP  13   4.164 -10.363   7.942
   81    H    ALA  14           H        ALA  14   2.794  -7.344   5.219
   82    HA   ALA  14           HA       ALA  14   5.713  -7.416   4.922
   83    HB1  ALA  14           HB1      ALA  14   3.596  -7.194   3.049
   84    HB2  ALA  14           HB2      ALA  14   5.332  -7.235   2.747
   85    HB3  ALA  14           HB3      ALA  14   4.520  -5.691   3.012
   86    H    THR  15           H        THR  15   6.642  -5.162   4.411
   87    HA   THR  15           HA       THR  15   5.850  -3.408   6.593
   88    HB   THR  15           HB       THR  15   8.208  -3.258   4.704
   89   HG21  THR  15          HG21      THR  15   7.226  -1.292   6.466
   90   HG22  THR  15          HG22      THR  15   8.743  -1.302   5.567
   91   HG23  THR  15          HG23      THR  15   8.679  -1.977   7.194
   92    H    CYS  16           H        CYS  16   5.246  -1.261   6.358
   93    HA   CYS  16           HA       CYS  16   4.484  -0.461   3.627
   94    HB2  CYS  16           HB2      CYS  16   2.829  -0.832   5.845
   95    HB3  CYS  16           HB3      CYS  16   3.011   0.914   5.718
   96    H    LEU  17           H        LEU  17   5.422   1.314   2.867
   97    HA   LEU  17           HA       LEU  17   6.618   3.197   4.795
   98    HB2  LEU  17           HB2      LEU  17   7.636   2.028   2.266
   99    HB3  LEU  17           HB3      LEU  17   8.020   3.713   2.566
  100    HG   LEU  17           HG       LEU  17   9.844   2.370   3.347
  101   HD11  LEU  17          HD11      LEU  17   8.630   2.912   5.970
  102   HD12  LEU  17          HD12      LEU  17   8.630   4.265   4.839
  103   HD13  LEU  17          HD13      LEU  17  10.149   3.482   5.277
  104   HD21  LEU  17          HD21      LEU  17   8.036   0.951   5.271
  105   HD22  LEU  17          HD22      LEU  17   9.671   0.529   4.764
  106   HD23  LEU  17          HD23      LEU  17   8.321   0.322   3.649
  107    H    ASP  18           H        ASP  18   6.616   5.433   4.226
  108    HA   ASP  18           HA       ASP  18   4.488   6.142   2.314
  109    HB2  ASP  18           HB2      ASP  18   5.032   7.014   5.079
  110    HB3  ASP  18           HB3      ASP  18   4.632   8.311   3.957
  111    H    GLN  19           H        GLN  19   5.812   6.490   0.547
  112    HA   GLN  19           HA       GLN  19   7.685   8.752   0.796
  113    HB2  GLN  19           HB2      GLN  19   7.943   6.143  -0.606
  114    HB3  GLN  19           HB3      GLN  19   8.628   7.556  -1.399
  115    HG2  GLN  19           HG2      GLN  19  10.428   6.833  -0.204
  116    HG3  GLN  19           HG3      GLN  19   9.717   7.964   0.947
  117   HE21  GLN  19          HE21      GLN  19   8.652   7.168   2.764
  118   HE22  GLN  19          HE22      GLN  19   8.859   5.541   3.308
  119    H    ILE  20           H        ILE  20   5.800   6.971  -1.634
  120    HA   ILE  20           HA       ILE  20   5.380   9.468  -3.098
  121    HB   ILE  20           HB       ILE  20   4.630   6.675  -3.960
  122   HG12  ILE  20          HG12      ILE  20   6.924   7.978  -5.260
  123   HG13  ILE  20          HG13      ILE  20   7.199   7.554  -3.573
  124   HG21  ILE  20          HG21      ILE  20   4.812   7.846  -6.244
  125   HG22  ILE  20          HG22      ILE  20   4.689   9.343  -5.320
  126   HG23  ILE  20          HG23      ILE  20   3.387   8.156  -5.252
  127   HD11  ILE  20          HD11      ILE  20   6.078   5.273  -4.509
  128   HD12  ILE  20          HD12      ILE  20   7.813   5.580  -4.419
  129   HD13  ILE  20          HD13      ILE  20   6.948   5.845  -5.933
  130    H    GLY  21           H        GLY  21   3.211   9.921  -3.965
  131    HA2  GLY  21           HA2      GLY  21   1.266  10.155  -2.032
  132    HA3  GLY  21           HA3      GLY  21   0.935  10.185  -3.757
  133    H    GLU  22           H        GLU  22   1.968   7.379  -4.004
  134    HA   GLU  22           HA       GLU  22  -0.541   6.076  -3.309
  135    HB2  GLU  22           HB2      GLU  22   0.286   4.226  -4.707
  136    HB3  GLU  22           HB3      GLU  22   0.314   5.759  -5.566
  137    HG2  GLU  22           HG2      GLU  22   2.820   5.638  -4.457
  138    HG3  GLU  22           HG3      GLU  22   2.489   3.959  -4.878
  139    H    PHE  23           H        PHE  23  -0.016   3.540  -2.864
  140    HA   PHE  23           HA       PHE  23   1.290   3.579  -0.268
  141    HB2  PHE  23           HB2      PHE  23   0.267   1.383   0.062
  142    HB3  PHE  23           HB3      PHE  23  -0.932   2.562  -0.460
  143    HD1  PHE  23           HD1      PHE  23   1.096  -0.317  -1.511
  144    HD2  PHE  23           HD2      PHE  23  -2.085   2.323  -2.511
  145    HE1  PHE  23           HE1      PHE  23   0.450  -1.806  -3.364
  146    HE2  PHE  23           HE2      PHE  23  -2.740   0.841  -4.366
  147    HZ   PHE  23           HZ       PHE  23  -1.471  -1.227  -4.794
  148    H    GLN  24           H        GLN  24   3.207   2.687   0.179
  149    HA   GLN  24           HA       GLN  24   4.498   1.090  -1.935
  150    HB2  GLN  24           HB2      GLN  24   5.571   3.271  -1.599
  151    HB3  GLN  24           HB3      GLN  24   5.785   2.910   0.109
  152    HG2  GLN  24           HG2      GLN  24   7.484   1.429  -0.271
  153    HG3  GLN  24           HG3      GLN  24   6.927   1.038  -1.898
  154   HE21  GLN  24          HE21      GLN  24   8.420   1.604  -3.301
  155   HE22  GLN  24          HE22      GLN  24   9.316   3.083  -3.298
  156    H    CYS  25           H        CYS  25   3.825  -0.908  -1.154
  157    HA   CYS  25           HA       CYS  25   4.556  -1.637   1.580
  158    HB2  CYS  25           HB2      CYS  25   2.316  -2.218   0.310
  159    HB3  CYS  25           HB3      CYS  25   3.273  -3.549  -0.330
  160    H    ILE  26           H        ILE  26   6.280  -2.842   2.069
  161    HA   ILE  26           HA       ILE  26   8.023  -3.708  -0.095
  162    HB   ILE  26           HB       ILE  26   8.560  -3.918   2.864
  163   HG12  ILE  26          HG12      ILE  26   9.212  -1.634   0.988
  164   HG13  ILE  26          HG13      ILE  26   8.024  -1.587   2.287
  165   HG21  ILE  26          HG21      ILE  26   9.921  -5.037   0.835
  166   HG22  ILE  26          HG22      ILE  26  10.676  -4.493   2.334
  167   HG23  ILE  26          HG23      ILE  26  10.714  -3.463   0.902
  168   HD11  ILE  26          HD11      ILE  26  10.103  -0.484   2.912
  169   HD12  ILE  26          HD12      ILE  26  10.985  -1.986   2.638
  170   HD13  ILE  26          HD13      ILE  26   9.787  -1.890   3.928
  171    H    CYS  27           H        CYS  27   8.009  -5.712  -0.845
  172    HA   CYS  27           HA       CYS  27   6.598  -7.796   0.602
  173    HB2  CYS  27           HB2      CYS  27   7.035  -7.195  -2.121
  174    HB3  CYS  27           HB3      CYS  27   7.847  -8.728  -1.820
  175    H    MET  28           H        MET  28   7.642 -10.062   0.431
  176    HA   MET  28           HA       MET  28  10.074  -9.976   1.934
  177    HB2  MET  28           HB2      MET  28   8.015 -11.908   1.329
  178    HB3  MET  28           HB3      MET  28   9.604 -12.629   1.124
  179    HG2  MET  28           HG2      MET  28   9.947 -11.369   3.480
  180    HG3  MET  28           HG3      MET  28   8.225 -11.738   3.560
  181    HE1  MET  28           HE1      MET  28  11.639 -12.674   4.054
  182    HE2  MET  28           HE2      MET  28  11.646 -14.385   4.484
  183    HE3  MET  28           HE3      MET  28  10.827 -13.218   5.522
  184    HA   PRO  29           HA       PRO  29  13.074 -10.715  -1.218
  185    HB2  PRO  29           HB2      PRO  29  14.688 -12.615  -0.238
  186    HB3  PRO  29           HB3      PRO  29  14.601 -11.005   0.483
  187    HG2  PRO  29           HG2      PRO  29  13.292 -13.549   1.369
  188    HG3  PRO  29           HG3      PRO  29  14.109 -12.314   2.344
  189    HD2  PRO  29           HD2      PRO  29  11.398 -12.467   2.084
  190    HD3  PRO  29           HD3      PRO  29  12.263 -10.946   2.382
  191    H    GLY  30           H        GLY  30  11.077 -11.699  -2.421
  192    HA2  GLY  30           HA2      GLY  30  11.426 -13.335  -4.319
  193    HA3  GLY  30           HA3      GLY  30  11.649 -14.528  -3.049
  194    H    TYR  31           H        TYR  31   9.275 -11.904  -3.228
  195    HA   TYR  31           HA       TYR  31   7.157 -13.940  -3.063
  196    HB2  TYR  31           HB2      TYR  31   7.516 -11.265  -1.841
  197    HB3  TYR  31           HB3      TYR  31   5.884 -11.663  -2.364
  198    HD1  TYR  31           HD1      TYR  31   8.483 -13.908  -0.928
  199    HD2  TYR  31           HD2      TYR  31   4.718 -12.006  -0.369
  200    HE1  TYR  31           HE1      TYR  31   8.144 -15.199   1.137
  201    HE2  TYR  31           HE2      TYR  31   4.370 -13.292   1.698
  202    HH   TYR  31           HH       TYR  31   6.316 -15.954   2.558
  203    H    GLU  32           H        GLU  32   4.957 -12.645  -3.804
  204    HA   GLU  32           HA       GLU  32   5.426 -11.290  -6.339
  205    HB2  GLU  32           HB2      GLU  32   5.008 -14.030  -6.310
  206    HB3  GLU  32           HB3      GLU  32   3.413 -13.378  -6.652
  207    HG2  GLU  32           HG2      GLU  32   4.712 -13.900  -8.677
  208    HG3  GLU  32           HG3      GLU  32   4.241 -12.205  -8.571
  209    H    GLY  33           H        GLY  33   2.812 -11.459  -7.322
  210    HA2  GLY  33           HA2      GLY  33   0.676 -10.636  -7.033
  211    HA3  GLY  33           HA3      GLY  33   0.905 -10.778  -5.297
  212    H    VAL  34           H        VAL  34  -0.478  -8.657  -6.128
  213    HA   VAL  34           HA       VAL  34   1.315  -6.390  -6.457
  214    HB   VAL  34           HB       VAL  34  -1.689  -6.340  -6.167
  215   HG11  VAL  34          HG11      VAL  34  -0.176  -4.243  -5.880
  216   HG12  VAL  34          HG12      VAL  34  -1.621  -4.146  -6.886
  217   HG13  VAL  34          HG13      VAL  34  -0.035  -4.330  -7.635
  218   HG21  VAL  34          HG21      VAL  34   0.031  -7.058  -8.455
  219   HG22  VAL  34          HG22      VAL  34  -1.288  -5.936  -8.796
  220   HG23  VAL  34          HG23      VAL  34  -1.634  -7.518  -8.096
  221    H    TYR  35           H        TYR  35  -0.831  -7.788  -4.041
  222    HA   TYR  35           HA       TYR  35   0.057  -5.734  -2.125
  223    HB2  TYR  35           HB2      TYR  35  -2.507  -7.206  -2.472
  224    HB3  TYR  35           HB3      TYR  35  -2.007  -6.834  -0.826
  225    HD1  TYR  35           HD1      TYR  35  -0.732  -4.185  -1.205
  226    HD2  TYR  35           HD2      TYR  35  -4.312  -5.781  -2.859
  227    HE1  TYR  35           HE1      TYR  35  -1.625  -1.908  -1.455
  228    HE2  TYR  35           HE2      TYR  35  -5.214  -3.509  -3.114
  229    HH   TYR  35           HH       TYR  35  -4.037  -0.880  -1.579
  230    H    CYS  36           H        CYS  36   1.565  -8.109  -2.883
  231    HA   CYS  36           HA       CYS  36   2.719  -9.847  -1.962
  232    HB2  CYS  36           HB2      CYS  36   2.170  -8.195   0.508
  233    HB3  CYS  36           HB3      CYS  36   3.274  -9.564   0.474
  234    H    GLU  37           H        GLU  37   0.963 -11.303  -2.531
  235    HA   GLU  37           HA       GLU  37   0.041 -12.759  -0.214
  236    HB2  GLU  37           HB2      GLU  37  -1.725 -11.045  -0.563
  237    HB3  GLU  37           HB3      GLU  37  -1.976 -11.667  -2.186
  238    HG2  GLU  37           HG2      GLU  37  -3.607 -12.420  -0.413
  239    HG3  GLU  37           HG3      GLU  37  -2.872 -13.685  -1.392
  240    H    ILE  38           H        ILE  38   1.781 -13.137  -2.578
  241    HA   ILE  38           HA       ILE  38   0.621 -15.669  -3.462
  242    HB   ILE  38           HB       ILE  38   1.840 -13.734  -5.430
  243   HG12  ILE  38          HG12      ILE  38  -0.353 -12.938  -4.560
  244   HG13  ILE  38          HG13      ILE  38  -0.393 -13.333  -6.276
  245   HG21  ILE  38          HG21      ILE  38   0.551 -15.440  -6.969
  246   HG22  ILE  38          HG22      ILE  38   0.776 -16.508  -5.584
  247   HG23  ILE  38          HG23      ILE  38   2.176 -15.788  -6.378
  248   HD11  ILE  38          HD11      ILE  38  -1.994 -14.833  -5.967
  249   HD12  ILE  38          HD12      ILE  38  -2.141 -14.212  -4.323
  250   HD13  ILE  38          HD13      ILE  38  -1.112 -15.606  -4.650
  251    H1   FUC  39           H1       FUC  39  10.267  -3.382   6.290
  252    H2   FUC  39           H2       FUC  39  11.435  -5.317   7.254
  253    H3   FUC  39           H3       FUC  39   8.644  -6.472   7.686
  254    H4   FUC  39           H4       FUC  39   9.268  -8.164   6.063
  255    H5   FUC  39           H5       FUC  39   8.201  -6.117   5.204
  256    H61  FUC  39           H61      FUC  39   8.878  -7.787   3.501
  257    H62  FUC  39           H62      FUC  39  10.498  -7.028   3.396
  258    H63  FUC  39           H63      FUC  39   9.049  -6.120   2.868
  259    HO2  FUC  39           HO2      FUC  39   9.187  -4.455   8.813
  260    HO4  FUC  39           HO4      FUC  39  11.560  -8.077   6.458
  261    H1   NAG  40           H1       NAG  40   8.938  -8.851   8.552
  262    H2   NAG  40           H2       NAG  40  10.983  -8.277  10.774
  263    H3   NAG  40           H3       NAG  40   8.949 -10.563  10.545
  264    H4   NAG  40           H4       NAG  40   8.954  -8.173  12.470
  265    H5   NAG  40           H5       NAG  40   7.100  -8.755  10.081
  266    H61  NAG  40           H61      NAG  40   7.223  -6.073  11.371
  267    H62  NAG  40           H62      NAG  40   5.866  -6.923  10.596
  268    H81  NAG  40           H81      NAG  40  13.501 -10.646   8.191
  269    H82  NAG  40           H82      NAG  40  14.319 -11.188   9.686
  270    H83  NAG  40           H83      NAG  40  12.885 -12.069   9.081
  271    HN2  NAG  40           HN2      NAG  40  11.030 -10.174   8.596
  272    HO3  NAG  40           HO3      NAG  40   9.820 -11.252  12.368
  273    HO4  NAG  40           HO4      NAG  40   7.967 -10.197  13.121
  274    HO6  NAG  40           HO6      NAG  40   5.324  -7.725  12.491
  Start of MODEL    8
    1    H1   ASP   1           H1       ASP   1 -12.880   1.159  -2.069
    2    HA   ASP   1           HA       ASP   1 -10.468   0.657  -2.591
    3    HB2  ASP   1           HB2      ASP   1 -11.389   0.830  -5.140
    4    HB3  ASP   1           HB3      ASP   1 -10.663   2.423  -4.952
    5    H    VAL   2           H        VAL   2 -10.073   1.900  -0.821
    6    HA   VAL   2           HA       VAL   2  -9.707   4.756  -1.306
    7    HB   VAL   2           HB       VAL   2 -10.720   5.292   0.928
    8   HG11  VAL   2          HG11      VAL   2 -13.046   5.250   0.104
    9   HG12  VAL   2          HG12      VAL   2 -12.543   4.172  -1.197
   10   HG13  VAL   2          HG13      VAL   2 -11.904   5.813  -1.115
   11   HG21  VAL   2          HG21      VAL   2 -10.930   3.375   2.156
   12   HG22  VAL   2          HG22      VAL   2 -11.388   2.399   0.760
   13   HG23  VAL   2          HG23      VAL   2 -12.562   3.488   1.497
   14    H    ASN   3           H        ASN   3  -8.459   5.799   0.474
   15    HA   ASN   3           HA       ASN   3  -6.592   5.921   1.767
   16    HB2  ASN   3           HB2      ASN   3  -7.528   3.192   2.680
   17    HB3  ASN   3           HB3      ASN   3  -6.268   4.138   3.467
   18   HD21  ASN   3          HD21      ASN   3  -8.591   3.253   4.738
   19   HD22  ASN   3          HD22      ASN   3  -9.533   4.632   5.179
   20    H    GLU   4           H        GLU   4  -4.454   4.764   2.271
   21    HA   GLU   4           HA       GLU   4  -3.670   3.142  -0.060
   22    HB2  GLU   4           HB2      GLU   4  -2.625   5.656   0.907
   23    HB3  GLU   4           HB3      GLU   4  -1.368   4.426   0.907
   24    HG2  GLU   4           HG2      GLU   4  -1.218   5.444  -1.186
   25    HG3  GLU   4           HG3      GLU   4  -2.068   3.928  -1.481
   26    H    CYS   5           H        CYS   5  -1.919   4.082   2.869
   27    HA   CYS   5           HA       CYS   5  -1.721   1.233   3.584
   28    HB2  CYS   5           HB2      CYS   5   0.399   2.065   2.644
   29    HB3  CYS   5           HB3      CYS   5   0.435   3.313   3.880
   30    H    ILE   6           H        ILE   6  -3.566   1.662   4.965
   31    HA   ILE   6           HA       ILE   6  -2.979   3.304   7.321
   32    HB   ILE   6           HB       ILE   6  -5.609   2.033   6.644
   33   HG12  ILE   6          HG12      ILE   6  -4.916   3.526   4.809
   34   HG13  ILE   6          HG13      ILE   6  -6.295   4.176   5.690
   35   HG21  ILE   6          HG21      ILE   6  -5.422   4.539   8.183
   36   HG22  ILE   6          HG22      ILE   6  -4.818   3.086   8.979
   37   HG23  ILE   6          HG23      ILE   6  -6.483   3.148   8.402
   38   HD11  ILE   6          HD11      ILE   6  -4.484   5.472   7.027
   39   HD12  ILE   6          HD12      ILE   6  -4.972   6.031   5.427
   40   HD13  ILE   6          HD13      ILE   6  -3.473   5.124   5.624
   41    H    SER   7           H        SER   7  -4.711   0.258   6.736
   42    HA   SER   7           HA       SER   7  -3.597  -0.767   9.250
   43    HB2  SER   7           HB2      SER   7  -6.062  -0.679   9.132
   44    HB3  SER   7           HB3      SER   7  -6.024  -1.721   7.710
   45    HG   SER   7           HG       SER   7  -6.380  -2.740   9.853
   46    H    ASN   8           H        ASN   8  -1.715  -0.923   7.471
   47    HA   ASN   8           HA       ASN   8  -0.294  -2.288   6.337
   48    HB2  ASN   8           HB2      ASN   8  -0.457  -3.647   8.359
   49    HB3  ASN   8           HB3      ASN   8  -1.901  -4.434   7.737
   50   HD21  ASN   8          HD21      ASN   8  -0.209  -6.155   8.429
   51   HD22  ASN   8          HD22      ASN   8   0.715  -6.795   7.125
   52    HA   PRO   9           HA       PRO   9  -3.152  -2.835   2.801
   53    HB2  PRO   9           HB2      PRO   9  -1.186  -2.439   0.928
   54    HB3  PRO   9           HB3      PRO   9  -2.130  -1.140   1.663
   55    HG2  PRO   9           HG2      PRO   9   0.616  -2.110   2.340
   56    HG3  PRO   9           HG3      PRO   9   0.003  -0.448   2.256
   57    HD2  PRO   9           HD2      PRO   9   0.347  -1.727   4.600
   58    HD3  PRO   9           HD3      PRO   9  -0.976  -0.571   4.347
   59    H    CYS  10           H        CYS  10   0.089  -4.213   3.212
   60    HA   CYS  10           HA       CYS  10  -0.106  -6.243   1.303
   61    HB2  CYS  10           HB2      CYS  10   1.522  -5.892   3.794
   62    HB3  CYS  10           HB3      CYS  10   1.567  -7.426   2.931
   63    H    GLN  11           H        GLN  11  -0.251  -8.602   1.752
   64    HA   GLN  11           HA       GLN  11  -2.418  -9.124   3.678
   65    HB2  GLN  11           HB2      GLN  11  -2.131  -9.731   0.881
   66    HB3  GLN  11           HB3      GLN  11  -2.307 -11.222   1.795
   67    HG2  GLN  11           HG2      GLN  11  -4.172  -8.953   2.301
   68    HG3  GLN  11           HG3      GLN  11  -4.398  -9.976   0.882
   69   HE21  GLN  11          HE21      GLN  11  -6.397 -10.651   1.766
   70   HE22  GLN  11          HE22      GLN  11  -6.458 -11.834   3.024
   71    H    ASN  12           H        ASN  12   0.723 -10.128   2.564
   72    HA   ASN  12           HA       ASN  12   0.675 -12.550   4.168
   73    HB2  ASN  12           HB2      ASN  12   2.518 -11.382   2.138
   74    HB3  ASN  12           HB3      ASN  12   3.180 -12.530   3.293
   75   HD21  ASN  12          HD21      ASN  12   3.276 -13.174   0.734
   76   HD22  ASN  12          HD22      ASN  12   2.143 -14.417   0.373
   77    H    ASP  13           H        ASP  13   0.846  -9.545   5.132
   78    HA   ASP  13           HA       ASP  13   1.605  -8.567   7.047
   79    HB2  ASP  13           HB2      ASP  13   1.480 -10.989   7.922
   80    HB3  ASP  13           HB3      ASP  13   3.222 -11.035   7.663
   81    H    ALA  14           H        ALA  14   2.732  -7.473   5.158
   82    HA   ALA  14           HA       ALA  14   5.639  -7.823   5.306
   83    HB1  ALA  14           HB1      ALA  14   3.887  -7.525   3.137
   84    HB2  ALA  14           HB2      ALA  14   5.649  -7.580   3.102
   85    HB3  ALA  14           HB3      ALA  14   4.819  -6.029   3.229
   86    H    THR  15           H        THR  15   6.658  -5.505   4.569
   87    HA   THR  15           HA       THR  15   5.905  -3.712   6.753
   88    HB   THR  15           HB       THR  15   8.362  -3.728   4.986
   89   HG21  THR  15          HG21      THR  15   7.763  -2.115   7.453
   90   HG22  THR  15          HG22      THR  15   8.013  -1.501   5.818
   91   HG23  THR  15          HG23      THR  15   9.347  -2.255   6.690
   92    H    CYS  16           H        CYS  16   5.965  -1.363   6.354
   93    HA   CYS  16           HA       CYS  16   5.167  -0.644   3.616
   94    HB2  CYS  16           HB2      CYS  16   3.219  -0.921   5.263
   95    HB3  CYS  16           HB3      CYS  16   3.832   0.529   6.048
   96    H    LEU  17           H        LEU  17   5.964   1.251   2.858
   97    HA   LEU  17           HA       LEU  17   7.453   2.948   4.750
   98    HB2  LEU  17           HB2      LEU  17   8.694   1.374   2.982
   99    HB3  LEU  17           HB3      LEU  17   8.396   2.754   1.944
  100    HG   LEU  17           HG       LEU  17   9.565   3.426   4.558
  101   HD11  LEU  17          HD11      LEU  17  10.844   1.474   4.332
  102   HD12  LEU  17          HD12      LEU  17  11.861   2.761   3.684
  103   HD13  LEU  17          HD13      LEU  17  11.003   1.678   2.587
  104   HD21  LEU  17          HD21      LEU  17  10.381   5.182   3.417
  105   HD22  LEU  17          HD22      LEU  17   9.193   4.712   2.201
  106   HD23  LEU  17          HD23      LEU  17  10.870   4.192   2.041
  107    H    ASP  18           H        ASP  18   4.827   2.892   2.850
  108    HA   ASP  18           HA       ASP  18   3.506   4.460   1.875
  109    HB2  ASP  18           HB2      ASP  18   3.805   5.634   3.996
  110    HB3  ASP  18           HB3      ASP  18   5.305   6.344   3.412
  111    H    GLN  19           H        GLN  19   3.445   6.200   0.250
  112    HA   GLN  19           HA       GLN  19   5.963   6.732  -1.118
  113    HB2  GLN  19           HB2      GLN  19   4.121   4.734  -1.989
  114    HB3  GLN  19           HB3      GLN  19   4.084   6.055  -3.147
  115    HG2  GLN  19           HG2      GLN  19   6.724   5.034  -2.244
  116    HG3  GLN  19           HG3      GLN  19   5.783   4.068  -3.380
  117   HE21  GLN  19          HE21      GLN  19   7.656   6.915  -2.913
  118   HE22  GLN  19          HE22      GLN  19   7.678   7.435  -4.561
  119    H    ILE  20           H        ILE  20   5.275   8.031  -3.279
  120    HA   ILE  20           HA       ILE  20   3.813  10.328  -2.271
  121    HB   ILE  20           HB       ILE  20   4.578  11.356  -4.463
  122   HG12  ILE  20          HG12      ILE  20   6.639   9.208  -4.602
  123   HG13  ILE  20          HG13      ILE  20   5.061   8.888  -5.316
  124   HG21  ILE  20          HG21      ILE  20   7.103  11.168  -3.554
  125   HG22  ILE  20          HG22      ILE  20   6.217  10.580  -2.148
  126   HG23  ILE  20          HG23      ILE  20   5.864  12.178  -2.806
  127   HD11  ILE  20          HD11      ILE  20   7.244  10.517  -6.288
  128   HD12  ILE  20          HD12      ILE  20   5.711  11.387  -6.278
  129   HD13  ILE  20          HD13      ILE  20   5.852   9.858  -7.146
  130    H    GLY  21           H        GLY  21   1.663   9.632  -2.354
  131    HA2  GLY  21           HA2      GLY  21  -0.338   9.997  -3.600
  132    HA3  GLY  21           HA3      GLY  21   0.541   9.602  -5.068
  133    H    GLU  22           H        GLU  22   1.770   7.225  -3.783
  134    HA   GLU  22           HA       GLU  22  -0.604   5.488  -3.637
  135    HB2  GLU  22           HB2      GLU  22   1.980   4.708  -4.984
  136    HB3  GLU  22           HB3      GLU  22   0.453   3.836  -5.002
  137    HG2  GLU  22           HG2      GLU  22  -0.288   6.219  -6.064
  138    HG3  GLU  22           HG3      GLU  22   1.369   6.078  -6.649
  139    H    PHE  23           H        PHE  23   0.142   3.198  -2.861
  140    HA   PHE  23           HA       PHE  23   1.529   3.631  -0.346
  141    HB2  PHE  23           HB2      PHE  23   0.731   1.347   0.207
  142    HB3  PHE  23           HB3      PHE  23  -0.572   2.448  -0.228
  143    HD1  PHE  23           HD1      PHE  23   1.586  -0.249  -1.556
  144    HD2  PHE  23           HD2      PHE  23  -2.041   1.935  -1.953
  145    HE1  PHE  23           HE1      PHE  23   0.819  -1.843  -3.271
  146    HE2  PHE  23           HE2      PHE  23  -2.819   0.347  -3.667
  147    HZ   PHE  23           HZ       PHE  23  -1.386  -1.546  -4.327
  148    H    GLN  24           H        GLN  24   3.315   2.432   0.353
  149    HA   GLN  24           HA       GLN  24   4.772   1.001  -1.770
  150    HB2  GLN  24           HB2      GLN  24   5.776   3.205  -1.342
  151    HB3  GLN  24           HB3      GLN  24   5.945   2.797   0.360
  152    HG2  GLN  24           HG2      GLN  24   7.597   1.192  -0.076
  153    HG3  GLN  24           HG3      GLN  24   7.226   1.160  -1.799
  154   HE21  GLN  24          HE21      GLN  24   7.751   3.872   0.410
  155   HE22  GLN  24          HE22      GLN  24   9.084   4.550  -0.456
  156    H    CYS  25           H        CYS  25   3.849  -0.950  -0.909
  157    HA   CYS  25           HA       CYS  25   4.702  -1.727   1.772
  158    HB2  CYS  25           HB2      CYS  25   2.356  -2.158   0.635
  159    HB3  CYS  25           HB3      CYS  25   3.184  -3.559  -0.038
  160    H    ILE  26           H        ILE  26   6.394  -3.002   2.156
  161    HA   ILE  26           HA       ILE  26   7.883  -4.063  -0.117
  162    HB   ILE  26           HB       ILE  26   8.708  -4.100   2.782
  163   HG12  ILE  26          HG12      ILE  26   9.418  -2.023   0.703
  164   HG13  ILE  26          HG13      ILE  26   8.201  -1.787   1.953
  165   HG21  ILE  26          HG21      ILE  26   9.949  -5.623   1.370
  166   HG22  ILE  26          HG22      ILE  26  10.973  -4.263   1.831
  167   HG23  ILE  26          HG23      ILE  26  10.270  -4.328   0.215
  168   HD11  ILE  26          HD11      ILE  26   9.821  -1.857   3.667
  169   HD12  ILE  26          HD12      ILE  26  10.465  -0.802   2.409
  170   HD13  ILE  26          HD13      ILE  26  11.063  -2.454   2.566
  171    H    CYS  27           H        CYS  27   7.520  -6.077  -0.756
  172    HA   CYS  27           HA       CYS  27   6.281  -7.995   1.031
  173    HB2  CYS  27           HB2      CYS  27   5.723  -7.645  -1.465
  174    HB3  CYS  27           HB3      CYS  27   7.191  -8.563  -1.781
  175    H    MET  28           H        MET  28   7.141 -10.235   1.148
  176    HA   MET  28           HA       MET  28   9.646 -10.346   2.291
  177    HB2  MET  28           HB2      MET  28   7.646 -12.274   1.399
  178    HB3  MET  28           HB3      MET  28   9.283 -12.907   1.288
  179    HG2  MET  28           HG2      MET  28   9.442 -11.901   3.730
  180    HG3  MET  28           HG3      MET  28   7.696 -12.138   3.669
  181    HE1  MET  28           HE1      MET  28  10.686 -14.908   5.005
  182    HE2  MET  28           HE2      MET  28  10.859 -13.227   4.498
  183    HE3  MET  28           HE3      MET  28  11.214 -14.532   3.365
  184    HA   PRO  29           HA       PRO  29  12.596 -10.685  -0.974
  185    HB2  PRO  29           HB2      PRO  29  14.354 -12.504  -0.120
  186    HB3  PRO  29           HB3      PRO  29  14.142 -10.965   0.719
  187    HG2  PRO  29           HG2      PRO  29  13.049 -13.665   1.412
  188    HG3  PRO  29           HG3      PRO  29  13.763 -12.441   2.478
  189    HD2  PRO  29           HD2      PRO  29  11.065 -12.807   2.170
  190    HD3  PRO  29           HD3      PRO  29  11.804 -11.262   2.636
  191    H    GLY  30           H        GLY  30  11.602 -11.452  -2.810
  192    HA2  GLY  30           HA2      GLY  30  11.795 -13.048  -4.565
  193    HA3  GLY  30           HA3      GLY  30  12.015 -14.306  -3.358
  194    H    TYR  31           H        TYR  31   9.486 -11.863  -3.272
  195    HA   TYR  31           HA       TYR  31   7.509 -14.020  -3.580
  196    HB2  TYR  31           HB2      TYR  31   7.632 -11.577  -1.897
  197    HB3  TYR  31           HB3      TYR  31   6.051 -12.022  -2.528
  198    HD1  TYR  31           HD1      TYR  31   8.954 -13.893  -1.084
  199    HD2  TYR  31           HD2      TYR  31   4.765 -13.152  -0.990
  200    HE1  TYR  31           HE1      TYR  31   8.708 -15.545   0.721
  201    HE2  TYR  31           HE2      TYR  31   4.508 -14.802   0.815
  202    HH   TYR  31           HH       TYR  31   6.616 -15.775   2.734
  203    H    GLU  32           H        GLU  32   5.253 -12.775  -4.183
  204    HA   GLU  32           HA       GLU  32   5.676 -10.903  -6.364
  205    HB2  GLU  32           HB2      GLU  32   4.271 -12.376  -7.894
  206    HB3  GLU  32           HB3      GLU  32   5.933 -12.881  -7.623
  207    HG2  GLU  32           HG2      GLU  32   4.884 -14.331  -5.729
  208    HG3  GLU  32           HG3      GLU  32   3.396 -14.103  -6.648
  209    H    GLY  33           H        GLY  33   3.432 -10.437  -7.431
  210    HA2  GLY  33           HA2      GLY  33   1.038 -10.347  -7.070
  211    HA3  GLY  33           HA3      GLY  33   1.348 -10.479  -5.345
  212    H    VAL  34           H        VAL  34  -0.304  -8.534  -6.021
  213    HA   VAL  34           HA       VAL  34   1.174  -6.062  -6.433
  214    HB   VAL  34           HB       VAL  34  -1.787  -6.405  -5.949
  215   HG11  VAL  34          HG11      VAL  34  -2.031  -4.196  -6.310
  216   HG12  VAL  34          HG12      VAL  34  -0.750  -4.145  -7.522
  217   HG13  VAL  34          HG13      VAL  34  -0.341  -4.127  -5.807
  218   HG21  VAL  34          HG21      VAL  34  -0.457  -7.431  -8.086
  219   HG22  VAL  34          HG22      VAL  34  -0.856  -5.815  -8.669
  220   HG23  VAL  34          HG23      VAL  34  -2.136  -6.894  -8.115
  221    H    TYR  35           H        TYR  35  -0.970  -7.477  -3.968
  222    HA   TYR  35           HA       TYR  35   0.023  -5.487  -2.048
  223    HB2  TYR  35           HB2      TYR  35  -2.538  -6.947  -2.366
  224    HB3  TYR  35           HB3      TYR  35  -1.995  -6.680  -0.713
  225    HD1  TYR  35           HD1      TYR  35  -0.759  -4.035  -0.856
  226    HD2  TYR  35           HD2      TYR  35  -4.302  -5.481  -2.716
  227    HE1  TYR  35           HE1      TYR  35  -1.647  -1.743  -0.935
  228    HE2  TYR  35           HE2      TYR  35  -5.198  -3.194  -2.802
  229    HH   TYR  35           HH       TYR  35  -4.284  -0.857  -2.808
  230    H    CYS  36           H        CYS  36   1.609  -7.753  -2.831
  231    HA   CYS  36           HA       CYS  36   2.803  -9.500  -1.972
  232    HB2  CYS  36           HB2      CYS  36   3.468  -7.583  -0.495
  233    HB3  CYS  36           HB3      CYS  36   2.264  -8.130   0.666
  234    H    GLU  37           H        GLU  37   1.502 -11.263  -2.351
  235    HA   GLU  37           HA       GLU  37   0.528 -12.655  -0.081
  236    HB2  GLU  37           HB2      GLU  37  -1.366 -11.165  -0.260
  237    HB3  GLU  37           HB3      GLU  37  -1.526 -11.505  -1.977
  238    HG2  GLU  37           HG2      GLU  37  -3.204 -12.648  -0.568
  239    HG3  GLU  37           HG3      GLU  37  -2.222 -13.749  -1.534
  240    H    ILE  38           H        ILE  38   0.470 -12.307  -3.594
  241    HA   ILE  38           HA       ILE  38   0.167 -15.178  -3.962
  242    HB   ILE  38           HB       ILE  38   0.652 -13.136  -6.123
  243   HG12  ILE  38          HG12      ILE  38  -1.282 -12.424  -4.779
  244   HG13  ILE  38          HG13      ILE  38  -1.782 -12.969  -6.377
  245   HG21  ILE  38          HG21      ILE  38   0.740 -15.767  -6.365
  246   HG22  ILE  38          HG22      ILE  38   0.032 -14.744  -7.616
  247   HG23  ILE  38          HG23      ILE  38  -1.011 -15.574  -6.460
  248   HD11  ILE  38          HD11      ILE  38  -1.892 -14.689  -3.915
  249   HD12  ILE  38          HD12      ILE  38  -2.593 -15.026  -5.498
  250   HD13  ILE  38          HD13      ILE  38  -3.241 -13.719  -4.507
  251    H1   FUC  39           H1       FUC  39  10.338  -3.970   6.678
  252    H2   FUC  39           H2       FUC  39  11.309  -6.008   7.659
  253    H3   FUC  39           H3       FUC  39   8.419  -6.934   7.962
  254    H4   FUC  39           H4       FUC  39   8.969  -8.652   6.343
  255    H5   FUC  39           H5       FUC  39   8.108  -6.516   5.471
  256    H61  FUC  39           H61      FUC  39   8.718  -8.213   3.769
  257    H62  FUC  39           H62      FUC  39   9.051  -6.557   3.171
  258    H63  FUC  39           H63      FUC  39  10.397  -7.588   3.745
  259    HO2  FUC  39           HO2      FUC  39   9.080  -4.986   9.145
  260    HO4  FUC  39           HO4      FUC  39  11.521  -7.351   6.187
  261    H1   NAG  40           H1       NAG  40   8.451  -9.306   8.812
  262    H2   NAG  40           H2       NAG  40  10.490  -9.007  11.094
  263    H3   NAG  40           H3       NAG  40   8.232 -11.059  10.757
  264    H4   NAG  40           H4       NAG  40   8.445  -8.732  12.748
  265    H5   NAG  40           H5       NAG  40   6.595  -9.053  10.307
  266    H61  NAG  40           H61      NAG  40   6.230  -7.539  12.625
  267    H62  NAG  40           H62      NAG  40   6.885  -6.380  11.446
  268    H81  NAG  40           H81      NAG  40  13.552 -12.056   9.673
  269    H82  NAG  40           H82      NAG  40  12.181 -13.120  10.107
  270    H83  NAG  40           H83      NAG  40  12.163 -12.226   8.558
  271    HN2  NAG  40           HN2      NAG  40  10.238 -11.078   9.014
  272    HO3  NAG  40           HO3      NAG  40  10.206 -10.560  12.719
  273    HO4  NAG  40           HO4      NAG  40   7.229 -10.691  13.283
  274    HO6  NAG  40           HO6      NAG  40   4.735  -6.400  11.005
  Start of MODEL    9
    1    H1   ASP   1           H1       ASP   1  -5.508  12.007   3.615
    2    HA   ASP   1           HA       ASP   1  -5.947  13.354   1.821
    3    HB2  ASP   1           HB2      ASP   1  -3.790  14.475   2.303
    4    HB3  ASP   1           HB3      ASP   1  -2.965  13.278   1.311
    5    H    VAL   2           H        VAL   2  -3.204  11.348   0.735
    6    HA   VAL   2           HA       VAL   2  -5.013   9.860  -1.013
    7    HB   VAL   2           HB       VAL   2  -3.316  10.088  -2.890
    8   HG11  VAL   2          HG11      VAL   2  -5.311  11.151  -3.332
    9   HG12  VAL   2          HG12      VAL   2  -4.175  12.499  -3.410
   10   HG13  VAL   2          HG13      VAL   2  -5.152  12.251  -1.961
   11   HG21  VAL   2          HG21      VAL   2  -2.497  12.715  -1.840
   12   HG22  VAL   2          HG22      VAL   2  -1.592  11.538  -2.793
   13   HG23  VAL   2          HG23      VAL   2  -1.766  11.316  -1.052
   14    H    ASN   3           H        ASN   3  -4.665   7.980   0.110
   15    HA   ASN   3           HA       ASN   3  -2.427   6.428  -0.564
   16    HB2  ASN   3           HB2      ASN   3  -2.198   8.002   1.909
   17    HB3  ASN   3           HB3      ASN   3  -1.875   6.282   2.117
   18   HD21  ASN   3          HD21      ASN   3  -0.043   8.493   2.339
   19   HD22  ASN   3          HD22      ASN   3   1.200   8.225   1.171
   20    H    GLU   4           H        GLU   4  -2.775   4.283  -0.136
   21    HA   GLU   4           HA       GLU   4  -5.282   3.656   1.272
   22    HB2  GLU   4           HB2      GLU   4  -3.840   2.127  -0.902
   23    HB3  GLU   4           HB3      GLU   4  -5.300   1.577  -0.088
   24    HG2  GLU   4           HG2      GLU   4  -5.527   4.259  -1.216
   25    HG3  GLU   4           HG3      GLU   4  -5.211   3.004  -2.414
   26    H    CYS   5           H        CYS   5  -2.702   4.018   2.568
   27    HA   CYS   5           HA       CYS   5  -2.232   1.281   3.545
   28    HB2  CYS   5           HB2      CYS   5  -0.248   2.227   2.501
   29    HB3  CYS   5           HB3      CYS   5  -0.361   3.640   3.539
   30    H    ILE   6           H        ILE   6  -3.955   1.420   5.049
   31    HA   ILE   6           HA       ILE   6  -3.506   3.296   7.268
   32    HB   ILE   6           HB       ILE   6  -6.051   1.806   6.733
   33   HG12  ILE   6          HG12      ILE   6  -5.591   3.228   4.803
   34   HG13  ILE   6          HG13      ILE   6  -6.918   3.897   5.749
   35   HG21  ILE   6          HG21      ILE   6  -5.271   3.023   8.990
   36   HG22  ILE   6          HG22      ILE   6  -6.953   2.937   8.466
   37   HG23  ILE   6          HG23      ILE   6  -6.003   4.389   8.149
   38   HD11  ILE   6          HD11      ILE   6  -4.419   4.980   6.648
   39   HD12  ILE   6          HD12      ILE   6  -5.835   5.808   6.000
   40   HD13  ILE   6          HD13      ILE   6  -4.596   5.194   4.906
   41    H    SER   7           H        SER   7  -5.016   0.108   6.852
   42    HA   SER   7           HA       SER   7  -3.725  -0.737   9.349
   43    HB2  SER   7           HB2      SER   7  -6.202  -0.793   9.347
   44    HB3  SER   7           HB3      SER   7  -6.158  -1.916   7.988
   45    HG   SER   7           HG       SER   7  -6.064  -3.388   9.482
   46    H    ASN   8           H        ASN   8  -1.949  -0.841   7.451
   47    HA   ASN   8           HA       ASN   8  -0.506  -2.162   6.292
   48    HB2  ASN   8           HB2      ASN   8  -0.467  -3.439   8.376
   49    HB3  ASN   8           HB3      ASN   8  -1.883  -4.345   7.866
   50   HD21  ASN   8          HD21      ASN   8  -0.028  -5.910   8.534
   51   HD22  ASN   8          HD22      ASN   8   0.862  -6.544   7.204
   52    HA   PRO   9           HA       PRO   9  -3.602  -3.030   3.003
   53    HB2  PRO   9           HB2      PRO   9  -1.833  -2.444   0.981
   54    HB3  PRO   9           HB3      PRO   9  -2.880  -1.257   1.762
   55    HG2  PRO   9           HG2      PRO   9   0.007  -1.855   2.252
   56    HG3  PRO   9           HG3      PRO   9  -0.821  -0.288   2.199
   57    HD2  PRO   9           HD2      PRO   9  -0.145  -1.466   4.522
   58    HD3  PRO   9           HD3      PRO   9  -1.626  -0.500   4.357
   59    H    CYS  10           H        CYS  10  -0.282  -4.116   3.398
   60    HA   CYS  10           HA       CYS  10  -0.292  -6.135   1.443
   61    HB2  CYS  10           HB2      CYS  10   1.261  -6.261   4.027
   62    HB3  CYS  10           HB3      CYS  10   1.685  -6.963   2.470
   63    H    GLN  11           H        GLN  11  -0.211  -8.500   1.897
   64    HA   GLN  11           HA       GLN  11  -2.298  -9.212   3.851
   65    HB2  GLN  11           HB2      GLN  11  -1.986  -9.804   1.049
   66    HB3  GLN  11           HB3      GLN  11  -2.040 -11.297   1.977
   67    HG2  GLN  11           HG2      GLN  11  -4.086  -9.093   2.128
   68    HG3  GLN  11           HG3      GLN  11  -4.248 -10.567   1.174
   69   HE21  GLN  11          HE21      GLN  11  -5.815 -11.664   2.152
   70   HE22  GLN  11          HE22      GLN  11  -5.846 -12.088   3.826
   71    H    ASN  12           H        ASN  12   0.878 -10.002   2.624
   72    HA   ASN  12           HA       ASN  12   1.070 -12.357   4.318
   73    HB2  ASN  12           HB2      ASN  12   2.583 -11.252   2.044
   74    HB3  ASN  12           HB3      ASN  12   3.559 -12.067   3.259
   75   HD21  ASN  12          HD21      ASN  12   3.583 -13.137   0.883
   76   HD22  ASN  12          HD22      ASN  12   2.645 -14.579   0.825
   77    H    ASP  13           H        ASP  13   1.073  -9.341   5.180
   78    HA   ASP  13           HA       ASP  13   1.865  -8.253   7.022
   79    HB2  ASP  13           HB2      ASP  13   2.184 -10.794   7.789
   80    HB3  ASP  13           HB3      ASP  13   3.884 -10.346   7.671
   81    H    ALA  14           H        ALA  14   2.761  -7.335   4.791
   82    HA   ALA  14           HA       ALA  14   5.675  -7.329   4.757
   83    HB1  ALA  14           HB1      ALA  14   3.595  -6.957   2.815
   84    HB2  ALA  14           HB2      ALA  14   5.319  -7.221   2.568
   85    HB3  ALA  14           HB3      ALA  14   4.701  -5.585   2.791
   86    H    THR  15           H        THR  15   6.603  -5.042   4.164
   87    HA   THR  15           HA       THR  15   5.860  -3.297   6.373
   88    HB   THR  15           HB       THR  15   8.166  -3.144   4.420
   89   HG21  THR  15          HG21      THR  15   9.188  -1.579   5.965
   90   HG22  THR  15          HG22      THR  15   7.738  -1.606   6.969
   91   HG23  THR  15          HG23      THR  15   7.667  -0.943   5.336
   92    H    CYS  16           H        CYS  16   5.054  -1.252   6.168
   93    HA   CYS  16           HA       CYS  16   4.451  -0.332   3.434
   94    HB2  CYS  16           HB2      CYS  16   2.493  -1.222   4.884
   95    HB3  CYS  16           HB3      CYS  16   2.670   0.286   5.774
   96    H    LEU  17           H        LEU  17   5.751   1.342   3.060
   97    HA   LEU  17           HA       LEU  17   6.320   3.230   5.229
   98    HB2  LEU  17           HB2      LEU  17   7.649   2.630   2.605
   99    HB3  LEU  17           HB3      LEU  17   7.981   4.124   3.462
  100    HG   LEU  17           HG       LEU  17   8.460   1.339   4.525
  101   HD11  LEU  17          HD11      LEU  17  10.622   1.516   3.910
  102   HD12  LEU  17          HD12      LEU  17  10.664   3.262   4.158
  103   HD13  LEU  17          HD13      LEU  17   9.958   2.597   2.684
  104   HD21  LEU  17          HD21      LEU  17   7.897   2.753   6.356
  105   HD22  LEU  17          HD22      LEU  17   8.907   4.059   5.736
  106   HD23  LEU  17          HD23      LEU  17   9.652   2.581   6.346
  107    H    ASP  18           H        ASP  18   6.174   5.511   4.857
  108    HA   ASP  18           HA       ASP  18   4.217   6.224   2.771
  109    HB2  ASP  18           HB2      ASP  18   3.825   6.378   5.490
  110    HB3  ASP  18           HB3      ASP  18   4.337   8.015   5.092
  111    H    GLN  19           H        GLN  19   5.779   6.856   1.278
  112    HA   GLN  19           HA       GLN  19   7.146   9.371   1.950
  113    HB2  GLN  19           HB2      GLN  19   8.266   6.919   0.645
  114    HB3  GLN  19           HB3      GLN  19   8.911   8.499   0.223
  115    HG2  GLN  19           HG2      GLN  19   9.946   8.761   2.206
  116    HG3  GLN  19           HG3      GLN  19   8.676   7.929   3.103
  117   HE21  GLN  19          HE21      GLN  19  10.959   7.253   3.999
  118   HE22  GLN  19          HE22      GLN  19  11.533   5.740   3.394
  119    H    ILE  20           H        ILE  20   5.995   7.271  -0.657
  120    HA   ILE  20           HA       ILE  20   5.778   9.586  -2.432
  121    HB   ILE  20           HB       ILE  20   5.249   6.704  -3.141
  122   HG12  ILE  20          HG12      ILE  20   7.826   8.214  -3.600
  123   HG13  ILE  20          HG13      ILE  20   7.579   7.133  -2.232
  124   HG21  ILE  20          HG21      ILE  20   4.364   7.914  -4.867
  125   HG22  ILE  20          HG22      ILE  20   6.033   7.767  -5.418
  126   HG23  ILE  20          HG23      ILE  20   5.486   9.257  -4.649
  127   HD11  ILE  20          HD11      ILE  20   8.474   6.484  -4.803
  128   HD12  ILE  20          HD12      ILE  20   6.856   5.796  -4.653
  129   HD13  ILE  20          HD13      ILE  20   8.102   5.384  -3.475
  130    H    GLY  21           H        GLY  21   3.802   9.841  -3.727
  131    HA2  GLY  21           HA2      GLY  21   1.518  10.145  -2.208
  132    HA3  GLY  21           HA3      GLY  21   1.523  10.036  -3.961
  133    H    GLU  22           H        GLU  22   2.673   7.273  -3.787
  134    HA   GLU  22           HA       GLU  22   0.124   5.911  -3.299
  135    HB2  GLU  22           HB2      GLU  22   1.223   4.037  -4.600
  136    HB3  GLU  22           HB3      GLU  22   0.913   5.515  -5.502
  137    HG2  GLU  22           HG2      GLU  22   3.213   6.159  -5.358
  138    HG3  GLU  22           HG3      GLU  22   3.568   4.814  -4.276
  139    H    PHE  23           H        PHE  23   0.552   3.462  -2.691
  140    HA   PHE  23           HA       PHE  23   1.951   3.553  -0.146
  141    HB2  PHE  23           HB2      PHE  23   0.819   1.449   0.339
  142    HB3  PHE  23           HB3      PHE  23  -0.335   2.652  -0.227
  143    HD1  PHE  23           HD1      PHE  23   1.403  -0.457  -1.025
  144    HD2  PHE  23           HD2      PHE  23  -1.435   2.420  -2.349
  145    HE1  PHE  23           HE1      PHE  23   0.635  -2.024  -2.764
  146    HE2  PHE  23           HE2      PHE  23  -2.211   0.861  -4.092
  147    HZ   PHE  23           HZ       PHE  23  -1.176  -1.364  -4.300
  148    H    GLN  24           H        GLN  24   3.562   2.100   0.482
  149    HA   GLN  24           HA       GLN  24   4.866   0.656  -1.732
  150    HB2  GLN  24           HB2      GLN  24   5.892   2.746  -0.082
  151    HB3  GLN  24           HB3      GLN  24   6.770   1.270   0.296
  152    HG2  GLN  24           HG2      GLN  24   8.057   2.026  -1.403
  153    HG3  GLN  24           HG3      GLN  24   6.886   1.099  -2.340
  154   HE21  GLN  24          HE21      GLN  24   6.542   2.159  -4.158
  155   HE22  GLN  24          HE22      GLN  24   6.207   3.847  -4.301
  156    H    CYS  25           H        CYS  25   4.203  -1.394  -1.343
  157    HA   CYS  25           HA       CYS  25   4.414  -2.464   1.373
  158    HB2  CYS  25           HB2      CYS  25   2.319  -2.891   0.189
  159    HB3  CYS  25           HB3      CYS  25   3.199  -3.652  -1.130
  160    H    ILE  26           H        ILE  26   6.340  -3.259   1.900
  161    HA   ILE  26           HA       ILE  26   8.081  -4.385  -0.145
  162    HB   ILE  26           HB       ILE  26   8.680  -4.167   2.800
  163   HG12  ILE  26          HG12      ILE  26   9.287  -2.116   0.659
  164   HG13  ILE  26          HG13      ILE  26   8.001  -1.957   1.851
  165   HG21  ILE  26          HG21      ILE  26  10.408  -5.394   2.030
  166   HG22  ILE  26          HG22      ILE  26  11.020  -3.819   1.527
  167   HG23  ILE  26          HG23      ILE  26  10.190  -4.856   0.365
  168   HD11  ILE  26          HD11      ILE  26  10.928  -2.202   2.501
  169   HD12  ILE  26          HD12      ILE  26   9.613  -1.908   3.639
  170   HD13  ILE  26          HD13      ILE  26  10.022  -0.689   2.432
  171    H    CYS  27           H        CYS  27   7.456  -6.401  -0.702
  172    HA   CYS  27           HA       CYS  27   6.513  -8.285   1.270
  173    HB2  CYS  27           HB2      CYS  27   5.921  -8.005  -1.324
  174    HB3  CYS  27           HB3      CYS  27   7.223  -9.179  -1.477
  175    H    MET  28           H        MET  28   7.470 -10.597   1.083
  176    HA   MET  28           HA       MET  28  10.023 -10.584   2.184
  177    HB2  MET  28           HB2      MET  28   8.069 -12.567   1.375
  178    HB3  MET  28           HB3      MET  28   9.705 -13.126   1.060
  179    HG2  MET  28           HG2      MET  28  10.077 -12.229   3.526
  180    HG3  MET  28           HG3      MET  28   8.350 -12.562   3.630
  181    HE1  MET  28           HE1      MET  28  11.959 -14.933   3.153
  182    HE2  MET  28           HE2      MET  28  11.425 -15.028   4.833
  183    HE3  MET  28           HE3      MET  28  11.609 -13.457   4.054
  184    HA   PRO  29           HA       PRO  29  12.859 -10.661  -1.195
  185    HB2  PRO  29           HB2      PRO  29  14.669 -12.525  -0.559
  186    HB3  PRO  29           HB3      PRO  29  14.497 -11.040   0.381
  187    HG2  PRO  29           HG2      PRO  29  13.443 -13.782   0.965
  188    HG3  PRO  29           HG3      PRO  29  14.219 -12.625   2.064
  189    HD2  PRO  29           HD2      PRO  29  11.515 -12.970   1.907
  190    HD3  PRO  29           HD3      PRO  29  12.278 -11.439   2.379
  191    H    GLY  30           H        GLY  30  11.565 -11.340  -2.937
  192    HA2  GLY  30           HA2      GLY  30  11.693 -12.760  -4.855
  193    HA3  GLY  30           HA3      GLY  30  12.115 -14.097  -3.797
  194    H    TYR  31           H        TYR  31   9.437 -11.761  -3.644
  195    HA   TYR  31           HA       TYR  31   7.582 -14.050  -3.703
  196    HB2  TYR  31           HB2      TYR  31   7.701 -11.616  -2.025
  197    HB3  TYR  31           HB3      TYR  31   6.100 -12.091  -2.573
  198    HD1  TYR  31           HD1      TYR  31   9.127 -13.865  -1.267
  199    HD2  TYR  31           HD2      TYR  31   4.917 -13.308  -1.022
  200    HE1  TYR  31           HE1      TYR  31   9.017 -15.539   0.530
  201    HE2  TYR  31           HE2      TYR  31   4.795 -14.980   0.777
  202    HH   TYR  31           HH       TYR  31   7.592 -16.198   2.348
  203    H    GLU  32           H        GLU  32   5.215 -12.918  -4.135
  204    HA   GLU  32           HA       GLU  32   5.437 -11.151  -6.452
  205    HB2  GLU  32           HB2      GLU  32   4.893 -13.971  -6.608
  206    HB3  GLU  32           HB3      GLU  32   3.487 -13.072  -7.154
  207    HG2  GLU  32           HG2      GLU  32   4.469 -12.849  -9.120
  208    HG3  GLU  32           HG3      GLU  32   5.674 -11.818  -8.350
  209    H    GLY  33           H        GLY  33   2.822 -11.216  -7.300
  210    HA2  GLY  33           HA2      GLY  33   0.600 -10.813  -6.634
  211    HA3  GLY  33           HA3      GLY  33   1.131 -10.783  -4.959
  212    H    VAL  34           H        VAL  34  -0.604  -8.881  -5.790
  213    HA   VAL  34           HA       VAL  34   0.898  -6.493  -6.501
  214    HB   VAL  34           HB       VAL  34  -2.045  -6.699  -5.860
  215   HG11  VAL  34          HG11      VAL  34  -2.022  -4.663  -7.445
  216   HG12  VAL  34          HG12      VAL  34  -0.297  -4.597  -7.085
  217   HG13  VAL  34          HG13      VAL  34  -1.475  -4.446  -5.783
  218   HG21  VAL  34          HG21      VAL  34  -0.604  -7.038  -8.484
  219   HG22  VAL  34          HG22      VAL  34  -2.334  -6.724  -8.350
  220   HG23  VAL  34          HG23      VAL  34  -1.651  -8.200  -7.670
  221    H    TYR  35           H        TYR  35  -1.023  -7.733  -3.792
  222    HA   TYR  35           HA       TYR  35  -0.013  -5.523  -2.131
  223    HB2  TYR  35           HB2      TYR  35  -2.553  -7.043  -2.186
  224    HB3  TYR  35           HB3      TYR  35  -1.927  -6.656  -0.587
  225    HD1  TYR  35           HD1      TYR  35  -0.749  -4.011  -0.969
  226    HD2  TYR  35           HD2      TYR  35  -4.356  -5.626  -2.547
  227    HE1  TYR  35           HE1      TYR  35  -1.677  -1.742  -1.156
  228    HE2  TYR  35           HE2      TYR  35  -5.292  -3.361  -2.739
  229    HH   TYR  35           HH       TYR  35  -3.881  -0.655  -1.260
  230    H    CYS  36           H        CYS  36   1.605  -7.793  -2.783
  231    HA   CYS  36           HA       CYS  36   2.960  -9.350  -1.818
  232    HB2  CYS  36           HB2      CYS  36   3.567  -7.437  -0.410
  233    HB3  CYS  36           HB3      CYS  36   2.242  -7.812   0.686
  234    H    GLU  37           H        GLU  37   1.675 -11.156  -2.241
  235    HA   GLU  37           HA       GLU  37   0.875 -12.652   0.021
  236    HB2  GLU  37           HB2      GLU  37  -1.078 -11.234   0.020
  237    HB3  GLU  37           HB3      GLU  37  -1.334 -11.509  -1.696
  238    HG2  GLU  37           HG2      GLU  37  -2.906 -12.792  -0.383
  239    HG3  GLU  37           HG3      GLU  37  -1.806 -13.865  -1.248
  240    H    ILE  38           H        ILE  38   0.559 -12.180  -3.466
  241    HA   ILE  38           HA       ILE  38   0.364 -15.047  -3.921
  242    HB   ILE  38           HB       ILE  38   0.571 -12.884  -6.010
  243   HG12  ILE  38          HG12      ILE  38  -1.318 -12.427  -4.480
  244   HG13  ILE  38          HG13      ILE  38  -1.865 -12.863  -6.095
  245   HG21  ILE  38          HG21      ILE  38  -0.846 -15.499  -6.300
  246   HG22  ILE  38          HG22      ILE  38   0.904 -15.408  -6.496
  247   HG23  ILE  38          HG23      ILE  38  -0.151 -14.458  -7.543
  248   HD11  ILE  38          HD11      ILE  38  -1.633 -15.144  -4.299
  249   HD12  ILE  38          HD12      ILE  38  -2.959 -14.654  -5.354
  250   HD13  ILE  38          HD13      ILE  38  -2.786 -13.925  -3.757
  251    H1   FUC  39           H1       FUC  39  10.204  -3.358   5.477
  252    H2   FUC  39           H2       FUC  39  11.592  -4.624   7.016
  253    H3   FUC  39           H3       FUC  39   8.968  -5.557   8.263
  254    H4   FUC  39           H4       FUC  39   9.570  -7.769   7.479
  255    H5   FUC  39           H5       FUC  39   8.252  -6.357   5.951
  256    H61  FUC  39           H61      FUC  39   8.906  -8.591   5.080
  257    H62  FUC  39           H62      FUC  39   8.849  -7.377   3.767
  258    H63  FUC  39           H63      FUC  39  10.423  -7.894   4.434
  259    HO2  FUC  39           HO2      FUC  39   9.447  -3.229   8.310
  260    HO4  FUC  39           HO4      FUC  39  11.434  -8.004   6.131
  261    H1   NAG  40           H1       NAG  40   9.637  -7.424   9.947
  262    H2   NAG  40           H2       NAG  40  11.682  -5.761  11.526
  263    H3   NAG  40           H3       NAG  40  10.006  -8.164  12.438
  264    H4   NAG  40           H4       NAG  40   9.757  -5.215  13.251
  265    H5   NAG  40           H5       NAG  40   7.888  -6.925  11.500
  266    H61  NAG  40           H61      NAG  40   7.429  -4.127  11.218
  267    H62  NAG  40           H62      NAG  40   7.466  -4.484  12.959
  268    H81  NAG  40           H81      NAG  40  13.862  -9.356  10.210
  269    H82  NAG  40           H82      NAG  40  15.099  -8.860  11.402
  270    H83  NAG  40           H83      NAG  40  14.967  -7.999   9.839
  271    HN2  NAG  40           HN2      NAG  40  11.857  -8.461  10.410
  272    HO3  NAG  40           HO3      NAG  40  12.137  -7.615  13.405
  273    HO4  NAG  40           HO4      NAG  40   8.402  -7.598  13.938
  274    HO6  NAG  40           HO6      NAG  40   5.745  -5.522  10.955
  Start of MODEL   10
    1    H1   ASP   1           H1       ASP   1 -12.780   7.454  -1.333
    2    HA   ASP   1           HA       ASP   1 -13.110   5.252   0.581
    3    HB2  ASP   1           HB2      ASP   1 -12.826   3.671  -1.401
    4    HB3  ASP   1           HB3      ASP   1 -14.385   4.477  -1.258
    5    H    VAL   2           H        VAL   2 -11.175   5.654   1.590
    6    HA   VAL   2           HA       VAL   2  -8.745   6.033   0.088
    7    HB   VAL   2           HB       VAL   2  -7.630   5.990   2.301
    8   HG11  VAL   2          HG11      VAL   2  -8.137   8.153   1.860
    9   HG12  VAL   2          HG12      VAL   2  -9.208   7.933   3.244
   10   HG13  VAL   2          HG13      VAL   2  -9.850   7.815   1.606
   11   HG21  VAL   2          HG21      VAL   2  -9.209   4.368   3.341
   12   HG22  VAL   2          HG22      VAL   2 -10.404   5.663   3.436
   13   HG23  VAL   2          HG23      VAL   2  -8.890   5.791   4.333
   14    H    ASN   3           H        ASN   3  -7.091   4.591  -0.216
   15    HA   ASN   3           HA       ASN   3  -7.061   2.008   1.027
   16    HB2  ASN   3           HB2      ASN   3  -8.746   2.097  -1.079
   17    HB3  ASN   3           HB3      ASN   3  -7.242   1.735  -1.919
   18   HD21  ASN   3          HD21      ASN   3  -9.291  -0.046  -1.963
   19   HD22  ASN   3          HD22      ASN   3  -8.886  -1.439  -1.023
   20    H    GLU   4           H        GLU   4  -5.004   3.041   1.554
   21    HA   GLU   4           HA       GLU   4  -3.025   2.599  -0.576
   22    HB2  GLU   4           HB2      GLU   4  -3.197   4.898   1.362
   23    HB3  GLU   4           HB3      GLU   4  -1.698   4.475   0.547
   24    HG2  GLU   4           HG2      GLU   4  -2.906   4.739  -1.626
   25    HG3  GLU   4           HG3      GLU   4  -4.273   5.374  -0.713
   26    H    CYS   5           H        CYS   5  -2.577   3.602   2.783
   27    HA   CYS   5           HA       CYS   5  -1.694   0.948   3.550
   28    HB2  CYS   5           HB2      CYS   5   0.192   2.747   2.589
   29    HB3  CYS   5           HB3      CYS   5   0.327   2.892   4.337
   30    H    ILE   6           H        ILE   6  -3.621   1.297   4.862
   31    HA   ILE   6           HA       ILE   6  -3.235   3.143   7.106
   32    HB   ILE   6           HB       ILE   6  -5.734   1.615   6.460
   33   HG12  ILE   6          HG12      ILE   6  -5.096   3.071   4.563
   34   HG13  ILE   6          HG13      ILE   6  -6.572   3.614   5.354
   35   HG21  ILE   6          HG21      ILE   6  -6.137   2.338   8.560
   36   HG22  ILE   6          HG22      ILE   6  -6.541   3.837   7.724
   37   HG23  ILE   6          HG23      ILE   6  -4.949   3.637   8.455
   38   HD11  ILE   6          HD11      ILE   6  -5.154   5.490   4.801
   39   HD12  ILE   6          HD12      ILE   6  -3.826   4.785   5.722
   40   HD13  ILE   6          HD13      ILE   6  -5.288   5.319   6.552
   41    H    SER   7           H        SER   7  -4.725  -0.058   6.717
   42    HA   SER   7           HA       SER   7  -3.488  -0.847   9.262
   43    HB2  SER   7           HB2      SER   7  -6.080  -0.786   8.923
   44    HB3  SER   7           HB3      SER   7  -5.820  -2.298   8.054
   45    HG   SER   7           HG       SER   7  -5.001  -3.210   9.899
   46    H    ASN   8           H        ASN   8  -1.724  -1.072   7.358
   47    HA   ASN   8           HA       ASN   8  -0.333  -2.476   6.235
   48    HB2  ASN   8           HB2      ASN   8  -0.309  -3.674   8.366
   49    HB3  ASN   8           HB3      ASN   8  -1.758  -4.556   7.905
   50   HD21  ASN   8          HD21      ASN   8   0.051  -6.152   8.614
   51   HD22  ASN   8          HD22      ASN   8   0.911  -6.863   7.303
   52    HA   PRO   9           HA       PRO   9  -3.461  -3.422   3.009
   53    HB2  PRO   9           HB2      PRO   9  -1.753  -2.895   0.937
   54    HB3  PRO   9           HB3      PRO   9  -2.732  -1.663   1.740
   55    HG2  PRO   9           HG2      PRO   9   0.148  -2.360   2.148
   56    HG3  PRO   9           HG3      PRO   9  -0.619  -0.762   2.072
   57    HD2  PRO   9           HD2      PRO   9   0.072  -1.907   4.411
   58    HD3  PRO   9           HD3      PRO   9  -1.366  -0.878   4.257
   59    H    CYS  10           H        CYS  10  -0.048  -4.389   3.105
   60    HA   CYS  10           HA       CYS  10  -0.182  -6.535   1.326
   61    HB2  CYS  10           HB2      CYS  10   1.612  -5.846   3.622
   62    HB3  CYS  10           HB3      CYS  10   1.756  -7.427   2.859
   63    H    GLN  11           H        GLN  11  -0.880  -8.586   1.462
   64    HA   GLN  11           HA       GLN  11  -2.301  -9.353   3.899
   65    HB2  GLN  11           HB2      GLN  11  -2.466 -10.133   1.024
   66    HB3  GLN  11           HB3      GLN  11  -3.022 -11.274   2.237
   67    HG2  GLN  11           HG2      GLN  11  -3.990  -8.440   2.175
   68    HG3  GLN  11           HG3      GLN  11  -4.736  -9.702   1.196
   69   HE21  GLN  11          HE21      GLN  11  -6.506  -8.753   2.698
   70   HE22  GLN  11          HE22      GLN  11  -6.785  -9.646   4.151
   71    H    ASN  12           H        ASN  12   0.585  -9.491   3.861
   72    HA   ASN  12           HA       ASN  12   0.850 -12.299   4.561
   73    HB2  ASN  12           HB2      ASN  12   2.308 -10.991   2.309
   74    HB3  ASN  12           HB3      ASN  12   3.146 -12.207   3.263
   75   HD21  ASN  12          HD21      ASN  12   2.644 -12.526   0.597
   76   HD22  ASN  12          HD22      ASN  12   1.526 -13.818   0.396
   77    H    ASP  13           H        ASP  13   1.084  -9.372   5.667
   78    HA   ASP  13           HA       ASP  13   2.152  -8.442   7.449
   79    HB2  ASP  13           HB2      ASP  13   2.378 -11.084   7.977
   80    HB3  ASP  13           HB3      ASP  13   4.080 -10.662   7.823
   81    H    ALA  14           H        ALA  14   2.909  -7.472   5.179
   82    HA   ALA  14           HA       ALA  14   5.821  -7.630   4.966
   83    HB1  ALA  14           HB1      ALA  14   3.746  -7.420   3.082
   84    HB2  ALA  14           HB2      ALA  14   5.485  -7.426   2.784
   85    HB3  ALA  14           HB3      ALA  14   4.635  -5.898   3.021
   86    H    THR  15           H        THR  15   6.702  -5.331   4.156
   87    HA   THR  15           HA       THR  15   6.085  -3.497   6.355
   88    HB   THR  15           HB       THR  15   8.445  -3.612   4.467
   89   HG21  THR  15          HG21      THR  15   8.056  -1.843   6.869
   90   HG22  THR  15          HG22      THR  15   8.058  -1.312   5.187
   91   HG23  THR  15          HG23      THR  15   9.523  -1.986   5.901
   92    H    CYS  16           H        CYS  16   5.968  -1.196   5.944
   93    HA   CYS  16           HA       CYS  16   5.108  -0.517   3.214
   94    HB2  CYS  16           HB2      CYS  16   3.115  -0.816   4.610
   95    HB3  CYS  16           HB3      CYS  16   3.753   0.330   5.783
   96    H    LEU  17           H        LEU  17   5.709   1.471   2.461
   97    HA   LEU  17           HA       LEU  17   7.173   3.232   4.307
   98    HB2  LEU  17           HB2      LEU  17   8.221   1.774   2.063
   99    HB3  LEU  17           HB3      LEU  17   8.346   3.495   1.753
  100    HG   LEU  17           HG       LEU  17  10.393   2.765   2.752
  101   HD11  LEU  17          HD11      LEU  17   9.171   3.984   5.147
  102   HD12  LEU  17          HD12      LEU  17   9.000   4.874   3.634
  103   HD13  LEU  17          HD13      LEU  17  10.604   4.456   4.234
  104   HD21  LEU  17          HD21      LEU  17   8.571   1.283   4.542
  105   HD22  LEU  17          HD22      LEU  17  10.030   1.943   5.279
  106   HD23  LEU  17          HD23      LEU  17  10.156   0.838   3.910
  107    H    ASP  18           H        ASP  18   5.369   4.600   4.416
  108    HA   ASP  18           HA       ASP  18   4.131   5.662   2.067
  109    HB2  ASP  18           HB2      ASP  18   2.972   5.443   4.263
  110    HB3  ASP  18           HB3      ASP  18   4.008   6.718   4.899
  111    H    GLN  19           H        GLN  19   5.888   6.499   0.866
  112    HA   GLN  19           HA       GLN  19   7.101   8.939   1.979
  113    HB2  GLN  19           HB2      GLN  19   8.211   6.719   0.537
  114    HB3  GLN  19           HB3      GLN  19   8.435   8.189  -0.402
  115    HG2  GLN  19           HG2      GLN  19  10.339   8.171   0.862
  116    HG3  GLN  19           HG3      GLN  19   9.281   9.170   1.857
  117   HE21  GLN  19          HE21      GLN  19   8.291   8.217   3.701
  118   HE22  GLN  19          HE22      GLN  19   9.012   6.853   4.478
  119    H    ILE  20           H        ILE  20   5.330   7.580  -0.712
  120    HA   ILE  20           HA       ILE  20   5.030  10.284  -1.836
  121    HB   ILE  20           HB       ILE  20   4.600   7.754  -3.405
  122   HG12  ILE  20          HG12      ILE  20   7.008   8.825  -4.278
  123   HG13  ILE  20          HG13      ILE  20   7.121   8.935  -2.524
  124   HG21  ILE  20          HG21      ILE  20   4.837  10.664  -4.029
  125   HG22  ILE  20          HG22      ILE  20   3.636   9.492  -4.573
  126   HG23  ILE  20          HG23      ILE  20   5.264   9.465  -5.251
  127   HD11  ILE  20          HD11      ILE  20   6.263   6.435  -2.697
  128   HD12  ILE  20          HD12      ILE  20   7.971   6.859  -2.818
  129   HD13  ILE  20          HD13      ILE  20   7.032   6.557  -4.280
  130    H    GLY  21           H        GLY  21   2.929  10.648  -2.966
  131    HA2  GLY  21           HA2      GLY  21   0.756  10.402  -1.322
  132    HA3  GLY  21           HA3      GLY  21   0.628  10.596  -3.063
  133    H    GLU  22           H        GLU  22   1.991   7.998  -3.527
  134    HA   GLU  22           HA       GLU  22  -0.378   6.331  -3.220
  135    HB2  GLU  22           HB2      GLU  22   2.141   6.089  -4.851
  136    HB3  GLU  22           HB3      GLU  22   1.020   4.745  -4.680
  137    HG2  GLU  22           HG2      GLU  22   0.164   7.446  -5.667
  138    HG3  GLU  22           HG3      GLU  22   0.772   6.186  -6.740
  139    H    PHE  23           H        PHE  23   0.047   3.948  -2.752
  140    HA   PHE  23           HA       PHE  23   1.565   3.804  -0.277
  141    HB2  PHE  23           HB2      PHE  23   0.400   1.715   0.118
  142    HB3  PHE  23           HB3      PHE  23  -0.755   2.961  -0.343
  143    HD1  PHE  23           HD1      PHE  23  -1.807   2.923  -2.545
  144    HD2  PHE  23           HD2      PHE  23   0.794  -0.185  -1.257
  145    HE1  PHE  23           HE1      PHE  23  -2.660   1.471  -4.344
  146    HE2  PHE  23           HE2      PHE  23  -0.051  -1.645  -3.052
  147    HZ   PHE  23           HZ       PHE  23  -1.781  -0.816  -4.598
  148    H    GLN  24           H        GLN  24   3.333   2.548   0.068
  149    HA   GLN  24           HA       GLN  24   4.322   0.962  -2.207
  150    HB2  GLN  24           HB2      GLN  24   5.462   3.275  -1.580
  151    HB3  GLN  24           HB3      GLN  24   6.266   2.282  -0.372
  152    HG2  GLN  24           HG2      GLN  24   6.882   0.735  -2.299
  153    HG3  GLN  24           HG3      GLN  24   6.386   2.055  -3.358
  154   HE21  GLN  24          HE21      GLN  24   8.910   0.711  -1.642
  155   HE22  GLN  24          HE22      GLN  24  10.006   2.045  -1.692
  156    H    CYS  25           H        CYS  25   3.543  -0.948  -1.273
  157    HA   CYS  25           HA       CYS  25   4.504  -1.697   1.370
  158    HB2  CYS  25           HB2      CYS  25   2.148  -2.187   0.262
  159    HB3  CYS  25           HB3      CYS  25   2.996  -3.590  -0.379
  160    H    ILE  26           H        ILE  26   6.252  -2.900   1.722
  161    HA   ILE  26           HA       ILE  26   7.725  -3.939  -0.561
  162    HB   ILE  26           HB       ILE  26   8.554  -3.983   2.339
  163   HG12  ILE  26          HG12      ILE  26   9.137  -1.892   0.230
  164   HG13  ILE  26          HG13      ILE  26   8.070  -1.677   1.614
  165   HG21  ILE  26          HG21      ILE  26  10.826  -3.800   0.903
  166   HG22  ILE  26          HG22      ILE  26   9.818  -4.716  -0.218
  167   HG23  ILE  26          HG23      ILE  26  10.107  -5.327   1.411
  168   HD11  ILE  26          HD11      ILE  26  10.275  -0.652   1.935
  169   HD12  ILE  26          HD12      ILE  26  11.020  -2.244   1.783
  170   HD13  ILE  26          HD13      ILE  26   9.931  -1.904   3.129
  171    H    CYS  27           H        CYS  27   7.408  -5.951  -1.226
  172    HA   CYS  27           HA       CYS  27   6.025  -7.894   0.321
  173    HB2  CYS  27           HB2      CYS  27   7.627  -8.394  -2.186
  174    HB3  CYS  27           HB3      CYS  27   6.264  -9.321  -1.575
  175    H    MET  28           H        MET  28   7.069 -10.235   0.269
  176    HA   MET  28           HA       MET  28   9.241 -10.144   2.111
  177    HB2  MET  28           HB2      MET  28   7.410 -12.148   1.048
  178    HB3  MET  28           HB3      MET  28   9.034 -12.780   1.272
  179    HG2  MET  28           HG2      MET  28   8.616 -11.414   3.601
  180    HG3  MET  28           HG3      MET  28   7.011 -12.047   3.240
  181    HE1  MET  28           HE1      MET  28   9.253 -12.843   5.762
  182    HE2  MET  28           HE2      MET  28  10.476 -12.631   4.510
  183    HE3  MET  28           HE3      MET  28  10.279 -14.199   5.293
  184    HA   PRO  29           HA       PRO  29  12.748 -10.694  -0.503
  185    HB2  PRO  29           HB2      PRO  29  14.216 -12.609   0.676
  186    HB3  PRO  29           HB3      PRO  29  13.995 -11.015   1.402
  187    HG2  PRO  29           HG2      PRO  29  12.586 -13.586   2.019
  188    HG3  PRO  29           HG3      PRO  29  13.230 -12.368   3.137
  189    HD2  PRO  29           HD2      PRO  29  10.600 -12.519   2.472
  190    HD3  PRO  29           HD3      PRO  29  11.403 -10.991   2.886
  191    H    GLY  30           H        GLY  30  10.892 -11.733  -1.966
  192    HA2  GLY  30           HA2      GLY  30  11.583 -13.256  -3.875
  193    HA3  GLY  30           HA3      GLY  30  11.711 -14.490  -2.631
  194    H    TYR  31           H        TYR  31   9.227 -11.989  -3.009
  195    HA   TYR  31           HA       TYR  31   7.242 -14.145  -3.298
  196    HB2  TYR  31           HB2      TYR  31   7.279 -11.657  -1.691
  197    HB3  TYR  31           HB3      TYR  31   5.747 -12.065  -2.452
  198    HD1  TYR  31           HD1      TYR  31   8.346 -14.302  -0.992
  199    HD2  TYR  31           HD2      TYR  31   4.376 -12.795  -0.717
  200    HE1  TYR  31           HE1      TYR  31   7.874 -15.891   0.824
  201    HE2  TYR  31           HE2      TYR  31   3.894 -14.381   1.101
  202    HH   TYR  31           HH       TYR  31   5.710 -17.018   1.770
  203    H    GLU  32           H        GLU  32   5.057 -12.892  -4.119
  204    HA   GLU  32           HA       GLU  32   5.673 -11.119  -6.336
  205    HB2  GLU  32           HB2      GLU  32   4.335 -12.670  -7.889
  206    HB3  GLU  32           HB3      GLU  32   6.000 -13.108  -7.529
  207    HG2  GLU  32           HG2      GLU  32   3.810 -14.226  -5.850
  208    HG3  GLU  32           HG3      GLU  32   4.098 -14.894  -7.455
  209    H    GLY  33           H        GLY  33   3.425 -10.918  -7.668
  210    HA2  GLY  33           HA2      GLY  33   1.048 -10.737  -7.479
  211    HA3  GLY  33           HA3      GLY  33   1.218 -10.780  -5.731
  212    H    VAL  34           H        VAL  34  -0.356  -8.898  -6.260
  213    HA   VAL  34           HA       VAL  34   1.013  -6.428  -6.956
  214    HB   VAL  34           HB       VAL  34  -1.864  -6.762  -6.110
  215   HG11  VAL  34          HG11      VAL  34  -1.830  -4.668  -7.792
  216   HG12  VAL  34          HG12      VAL  34  -0.211  -4.530  -7.106
  217   HG13  VAL  34          HG13      VAL  34  -1.620  -4.517  -6.047
  218   HG21  VAL  34          HG21      VAL  34  -0.535  -7.177  -8.752
  219   HG22  VAL  34          HG22      VAL  34  -2.173  -6.526  -8.693
  220   HG23  VAL  34          HG23      VAL  34  -1.825  -8.102  -7.985
  221    H    TYR  35           H        TYR  35  -0.948  -7.631  -4.232
  222    HA   TYR  35           HA       TYR  35   0.212  -5.554  -2.523
  223    HB2  TYR  35           HB2      TYR  35  -2.279  -7.169  -2.469
  224    HB3  TYR  35           HB3      TYR  35  -1.569  -6.772  -0.908
  225    HD1  TYR  35           HD1      TYR  35  -0.676  -4.132  -0.976
  226    HD2  TYR  35           HD2      TYR  35  -4.003  -5.771  -3.059
  227    HE1  TYR  35           HE1      TYR  35  -1.704  -1.901  -1.077
  228    HE2  TYR  35           HE2      TYR  35  -5.040  -3.545  -3.167
  229    HH   TYR  35           HH       TYR  35  -3.333  -0.676  -2.311
  230    H    CYS  36           H        CYS  36   1.730  -7.907  -3.415
  231    HA   CYS  36           HA       CYS  36   3.136  -9.500  -2.594
  232    HB2  CYS  36           HB2      CYS  36   2.823  -8.156   0.087
  233    HB3  CYS  36           HB3      CYS  36   4.229  -9.008  -0.546
  234    H    GLU  37           H        GLU  37   0.268  -9.993  -2.515
  235    HA   GLU  37           HA       GLU  37  -0.034 -11.676  -0.141
  236    HB2  GLU  37           HB2      GLU  37  -2.380 -11.726  -0.636
  237    HB3  GLU  37           HB3      GLU  37  -1.835 -10.062  -0.772
  238    HG2  GLU  37           HG2      GLU  37  -2.117 -10.001  -3.040
  239    HG3  GLU  37           HG3      GLU  37  -1.912 -11.741  -3.225
  240    H    ILE  38           H        ILE  38   1.668 -12.301  -2.547
  241    HA   ILE  38           HA       ILE  38   0.463 -14.922  -3.138
  242    HB   ILE  38           HB       ILE  38   2.164 -13.395  -5.101
  243   HG12  ILE  38          HG12      ILE  38   0.045 -12.183  -4.661
  244   HG13  ILE  38          HG13      ILE  38   0.130 -12.819  -6.301
  245   HG21  ILE  38          HG21      ILE  38   0.736 -15.111  -6.571
  246   HG22  ILE  38          HG22      ILE  38   0.795 -16.014  -5.058
  247   HG23  ILE  38          HG23      ILE  38   2.292 -15.526  -5.852
  248   HD11  ILE  38          HD11      ILE  38  -1.671 -13.528  -4.080
  249   HD12  ILE  38          HD12      ILE  38  -1.132 -14.851  -5.114
  250   HD13  ILE  38          HD13      ILE  38  -1.970 -13.467  -5.817
  251    H1   FUC  39           H1       FUC  39  10.520  -3.828   6.001
  252    H2   FUC  39           H2       FUC  39  11.470  -5.825   7.078
  253    H3   FUC  39           H3       FUC  39   8.576  -6.547   7.715
  254    H4   FUC  39           H4       FUC  39   8.885  -8.431   6.221
  255    H5   FUC  39           H5       FUC  39   8.062  -6.336   5.221
  256    H61  FUC  39           H61      FUC  39   8.804  -6.638   2.869
  257    H62  FUC  39           H62      FUC  39  10.133  -7.697   3.427
  258    H63  FUC  39           H63      FUC  39   8.429  -8.208   3.645
  259    HO2  FUC  39           HO2      FUC  39  10.881  -3.983   8.374
  260    HO4  FUC  39           HO4      FUC  39  11.182  -8.636   6.518
  261    H1   NAG  40           H1       NAG  40   8.568  -8.838   8.777
  262    H2   NAG  40           H2       NAG  40  10.812  -8.445  10.841
  263    H3   NAG  40           H3       NAG  40   8.438 -10.390  10.894
  264    H4   NAG  40           H4       NAG  40   8.939  -7.906  12.626
  265    H5   NAG  40           H5       NAG  40   6.866  -8.346  10.392
  266    H61  NAG  40           H61      NAG  40   7.548  -5.720  11.719
  267    H62  NAG  40           H62      NAG  40   6.335  -6.816  12.417
  268    H81  NAG  40           H81      NAG  40  11.947 -11.721   7.986
  269    H82  NAG  40           H82      NAG  40  13.508 -10.845   8.002
  270    H83  NAG  40           H83      NAG  40  13.053 -11.888   9.382
  271    HN2  NAG  40           HN2      NAG  40  10.246 -10.963   9.411
  272    HO3  NAG  40           HO3      NAG  40  10.446  -9.722  12.804
  273    HO4  NAG  40           HO4      NAG  40   6.688  -9.637  12.374
  274    HO6  NAG  40           HO6      NAG  40   5.505  -5.209  10.869
  Start of MODEL   11
    1    H1   ASP   1           H1       ASP   1  -1.948  14.680  -0.533
    2    HA   ASP   1           HA       ASP   1  -0.249  12.948   0.338
    3    HB2  ASP   1           HB2      ASP   1   0.444  14.452   2.181
    4    HB3  ASP   1           HB3      ASP   1  -1.156  14.284   2.898
    5    H    VAL   2           H        VAL   2  -1.441  11.244  -0.185
    6    HA   VAL   2           HA       VAL   2  -4.190  11.050   0.828
    7    HB   VAL   2           HB       VAL   2  -4.411   9.197  -0.858
    8   HG11  VAL   2          HG11      VAL   2  -5.135  10.677  -2.397
    9   HG12  VAL   2          HG12      VAL   2  -3.594  11.532  -2.456
   10   HG13  VAL   2          HG13      VAL   2  -4.734  11.858  -1.151
   11   HG21  VAL   2          HG21      VAL   2  -2.730   8.552  -2.217
   12   HG22  VAL   2          HG22      VAL   2  -1.713   9.194  -0.928
   13   HG23  VAL   2          HG23      VAL   2  -2.068  10.181  -2.347
   14    H    ASN   3           H        ASN   3  -4.809   9.493   2.214
   15    HA   ASN   3           HA       ASN   3  -2.777   7.905   3.488
   16    HB2  ASN   3           HB2      ASN   3  -5.128   9.017   4.344
   17    HB3  ASN   3           HB3      ASN   3  -5.579   7.325   4.169
   18   HD21  ASN   3          HD21      ASN   3  -5.806   7.956   6.590
   19   HD22  ASN   3          HD22      ASN   3  -4.452   7.532   7.577
   20    H    GLU   4           H        GLU   4  -2.054   6.166   2.430
   21    HA   GLU   4           HA       GLU   4  -4.024   4.398   1.139
   22    HB2  GLU   4           HB2      GLU   4  -1.048   4.447   0.642
   23    HB3  GLU   4           HB3      GLU   4  -2.277   3.618  -0.304
   24    HG2  GLU   4           HG2      GLU   4  -2.463   6.569  -0.018
   25    HG3  GLU   4           HG3      GLU   4  -1.234   5.898  -1.089
   26    H    CYS   5           H        CYS   5  -1.368   4.563   3.413
   27    HA   CYS   5           HA       CYS   5  -1.626   1.699   3.975
   28    HB2  CYS   5           HB2      CYS   5   0.614   3.224   3.713
   29    HB3  CYS   5           HB3      CYS   5   0.386   3.253   5.458
   30    H    ILE   6           H        ILE   6  -3.429   1.511   5.227
   31    HA   ILE   6           HA       ILE   6  -3.527   3.106   7.694
   32    HB   ILE   6           HB       ILE   6  -5.804   1.559   6.502
   33   HG12  ILE   6          HG12      ILE   6  -5.078   3.292   4.920
   34   HG13  ILE   6          HG13      ILE   6  -6.642   3.689   5.625
   35   HG21  ILE   6          HG21      ILE   6  -6.182   3.906   8.261
   36   HG22  ILE   6          HG22      ILE   6  -5.585   2.423   9.007
   37   HG23  ILE   6          HG23      ILE   6  -7.121   2.418   8.137
   38   HD11  ILE   6          HD11      ILE   6  -5.136   5.021   7.332
   39   HD12  ILE   6          HD12      ILE   6  -5.614   5.708   5.779
   40   HD13  ILE   6          HD13      ILE   6  -4.009   5.003   5.975
   41    H    SER   7           H        SER   7  -4.772  -0.069   6.703
   42    HA   SER   7           HA       SER   7  -3.708  -1.170   9.211
   43    HB2  SER   7           HB2      SER   7  -6.255  -1.089   8.825
   44    HB3  SER   7           HB3      SER   7  -5.983  -2.377   7.652
   45    HG   SER   7           HG       SER   7  -6.332  -3.454   9.498
   46    H    ASN   8           H        ASN   8  -1.850  -1.109   7.375
   47    HA   ASN   8           HA       ASN   8  -0.389  -2.324   6.126
   48    HB2  ASN   8           HB2      ASN   8  -0.400  -3.755   8.117
   49    HB3  ASN   8           HB3      ASN   8  -1.784  -4.637   7.487
   50   HD21  ASN   8          HD21      ASN   8   0.081  -6.221   8.089
   51   HD22  ASN   8          HD22      ASN   8   1.023  -6.733   6.743
   52    HA   PRO   9           HA       PRO   9  -3.441  -2.793   2.695
   53    HB2  PRO   9           HB2      PRO   9  -0.902  -2.294   1.247
   54    HB3  PRO   9           HB3      PRO   9  -2.493  -1.578   0.998
   55    HG2  PRO   9           HG2      PRO   9  -0.532  -0.208   2.176
   56    HG3  PRO   9           HG3      PRO   9  -2.215  -0.053   2.703
   57    HD2  PRO   9           HD2      PRO   9   0.047  -1.504   3.988
   58    HD3  PRO   9           HD3      PRO   9  -1.316  -0.646   4.735
   59    H    CYS  10           H        CYS  10  -0.173  -4.126   3.001
   60    HA   CYS  10           HA       CYS  10  -0.372  -6.134   1.070
   61    HB2  CYS  10           HB2      CYS  10   1.297  -5.750   3.522
   62    HB3  CYS  10           HB3      CYS  10   1.329  -7.309   2.706
   63    H    GLN  11           H        GLN  11  -0.281  -8.549   1.684
   64    HA   GLN  11           HA       GLN  11  -2.332  -9.150   3.705
   65    HB2  GLN  11           HB2      GLN  11  -2.384  -9.642   0.820
   66    HB3  GLN  11           HB3      GLN  11  -2.719 -11.078   1.775
   67    HG2  GLN  11           HG2      GLN  11  -4.140  -8.536   2.405
   68    HG3  GLN  11           HG3      GLN  11  -4.648  -9.499   1.018
   69   HE21  GLN  11          HE21      GLN  11  -4.561  -9.246   4.446
   70   HE22  GLN  11          HE22      GLN  11  -5.519 -10.640   4.794
   71    H    ASN  12           H        ASN  12   0.589  -9.347   3.811
   72    HA   ASN  12           HA       ASN  12   0.738 -12.161   4.557
   73    HB2  ASN  12           HB2      ASN  12   2.439 -10.834   2.487
   74    HB3  ASN  12           HB3      ASN  12   3.143 -12.092   3.493
   75   HD21  ASN  12          HD21      ASN  12   3.058 -12.479   0.872
   76   HD22  ASN  12          HD22      ASN  12   1.888 -13.677   0.475
   77    H    ASP  13           H        ASP  13   0.832  -9.293   5.751
   78    HA   ASP  13           HA       ASP  13   1.742  -8.370   7.626
   79    HB2  ASP  13           HB2      ASP  13   1.846 -10.909   8.270
   80    HB3  ASP  13           HB3      ASP  13   3.574 -10.720   7.988
   81    H    ALA  14           H        ALA  14   2.689  -7.556   5.262
   82    HA   ALA  14           HA       ALA  14   5.593  -7.632   5.282
   83    HB1  ALA  14           HB1      ALA  14   3.495  -6.982   3.360
   84    HB2  ALA  14           HB2      ALA  14   5.111  -7.637   3.099
   85    HB3  ALA  14           HB3      ALA  14   4.885  -5.898   3.289
   86    H    THR  15           H        THR  15   6.650  -5.418   4.732
   87    HA   THR  15           HA       THR  15   5.962  -3.622   6.916
   88    HB   THR  15           HB       THR  15   8.319  -3.643   5.020
   89   HG21  THR  15          HG21      THR  15   7.722  -1.900   7.384
   90   HG22  THR  15          HG22      THR  15   8.190  -1.424   5.751
   91   HG23  THR  15          HG23      THR  15   9.365  -2.197   6.815
   92    H    CYS  16           H        CYS  16   6.009  -1.263   6.548
   93    HA   CYS  16           HA       CYS  16   5.143  -0.473   3.859
   94    HB2  CYS  16           HB2      CYS  16   3.107  -0.830   5.166
   95    HB3  CYS  16           HB3      CYS  16   3.712   0.236   6.429
   96    H    LEU  17           H        LEU  17   5.342   1.808   3.426
   97    HA   LEU  17           HA       LEU  17   7.011   3.302   5.314
   98    HB2  LEU  17           HB2      LEU  17   8.290   2.066   3.394
   99    HB3  LEU  17           HB3      LEU  17   7.675   3.373   2.398
  100    HG   LEU  17           HG       LEU  17   9.895   3.938   3.092
  101   HD11  LEU  17          HD11      LEU  17   9.519   6.080   3.847
  102   HD12  LEU  17          HD12      LEU  17   8.238   5.582   4.951
  103   HD13  LEU  17          HD13      LEU  17   7.930   5.643   3.217
  104   HD21  LEU  17          HD21      LEU  17  10.531   2.818   4.951
  105   HD22  LEU  17          HD22      LEU  17   8.943   2.945   5.707
  106   HD23  LEU  17          HD23      LEU  17  10.047   4.319   5.739
  107    H    ASP  18           H        ASP  18   5.232   3.416   2.253
  108    HA   ASP  18           HA       ASP  18   3.936   5.016   1.287
  109    HB2  ASP  18           HB2      ASP  18   2.575   4.635   3.289
  110    HB3  ASP  18           HB3      ASP  18   3.521   5.830   4.171
  111    H    GLN  19           H        GLN  19   5.174   6.344   0.096
  112    HA   GLN  19           HA       GLN  19   6.170   8.780   1.398
  113    HB2  GLN  19           HB2      GLN  19   7.681   6.832  -0.269
  114    HB3  GLN  19           HB3      GLN  19   8.038   8.540  -0.484
  115    HG2  GLN  19           HG2      GLN  19   7.997   8.128   2.278
  116    HG3  GLN  19           HG3      GLN  19   8.857   6.746   1.602
  117   HE21  GLN  19          HE21      GLN  19   9.296   9.698   2.858
  118   HE22  GLN  19          HE22      GLN  19  10.763  10.159   2.071
  119    H    ILE  20           H        ILE  20   5.412   7.203  -1.678
  120    HA   ILE  20           HA       ILE  20   4.897   9.801  -2.910
  121    HB   ILE  20           HB       ILE  20   4.491   7.262  -4.417
  122   HG12  ILE  20          HG12      ILE  20   6.561   6.776  -3.249
  123   HG13  ILE  20          HG13      ILE  20   6.926   7.158  -4.928
  124   HG21  ILE  20          HG21      ILE  20   5.917   8.877  -6.013
  125   HG22  ILE  20          HG22      ILE  20   5.177  10.081  -4.957
  126   HG23  ILE  20          HG23      ILE  20   4.161   8.962  -5.867
  127   HD11  ILE  20          HD11      ILE  20   7.376   8.847  -2.495
  128   HD12  ILE  20          HD12      ILE  20   7.416   9.511  -4.127
  129   HD13  ILE  20          HD13      ILE  20   8.558   8.252  -3.660
  130    H    GLY  21           H        GLY  21   2.918   9.735  -4.490
  131    HA2  GLY  21           HA2      GLY  21   0.585   9.816  -3.054
  132    HA3  GLY  21           HA3      GLY  21   0.643   9.568  -4.792
  133    H    GLU  22           H        GLU  22   2.120   7.002  -4.415
  134    HA   GLU  22           HA       GLU  22  -0.236   5.359  -3.873
  135    HB2  GLU  22           HB2      GLU  22   2.366   4.808  -5.293
  136    HB3  GLU  22           HB3      GLU  22   1.212   3.538  -4.910
  137    HG2  GLU  22           HG2      GLU  22   0.502   5.973  -6.519
  138    HG3  GLU  22           HG3      GLU  22   1.090   4.474  -7.236
  139    H    PHE  23           H        PHE  23   0.337   3.117  -2.920
  140    HA   PHE  23           HA       PHE  23   1.702   3.618  -0.399
  141    HB2  PHE  23           HB2      PHE  23   0.646   1.567   0.377
  142    HB3  PHE  23           HB3      PHE  23  -0.551   2.628  -0.360
  143    HD1  PHE  23           HD1      PHE  23  -1.514   2.090  -2.534
  144    HD2  PHE  23           HD2      PHE  23   1.207  -0.536  -0.589
  145    HE1  PHE  23           HE1      PHE  23  -2.211   0.266  -4.035
  146    HE2  PHE  23           HE2      PHE  23   0.519  -2.368  -2.085
  147    HZ   PHE  23           HZ       PHE  23  -1.193  -1.966  -3.811
  148    H    GLN  24           H        GLN  24   3.590   2.727   0.190
  149    HA   GLN  24           HA       GLN  24   4.845   0.852  -1.701
  150    HB2  GLN  24           HB2      GLN  24   5.767   3.300  -0.655
  151    HB3  GLN  24           HB3      GLN  24   6.720   2.050   0.131
  152    HG2  GLN  24           HG2      GLN  24   6.418   2.514  -2.825
  153    HG3  GLN  24           HG3      GLN  24   7.858   2.778  -1.843
  154   HE21  GLN  24          HE21      GLN  24   8.110   0.573  -0.384
  155   HE22  GLN  24          HE22      GLN  24   8.298  -0.827  -1.378
  156    H    CYS  25           H        CYS  25   4.147  -1.070  -0.815
  157    HA   CYS  25           HA       CYS  25   4.852  -1.590   1.989
  158    HB2  CYS  25           HB2      CYS  25   2.502  -2.006   1.327
  159    HB3  CYS  25           HB3      CYS  25   3.060  -3.184   0.145
  160    H    ILE  26           H        ILE  26   6.650  -2.682   2.380
  161    HA   ILE  26           HA       ILE  26   7.959  -4.146   0.231
  162    HB   ILE  26           HB       ILE  26   8.964  -3.740   3.045
  163   HG12  ILE  26          HG12      ILE  26   9.572  -2.040   0.619
  164   HG13  ILE  26          HG13      ILE  26   8.433  -1.580   1.879
  165   HG21  ILE  26          HG21      ILE  26  11.152  -3.858   1.500
  166   HG22  ILE  26          HG22      ILE  26  10.066  -4.873   0.552
  167   HG23  ILE  26          HG23      ILE  26  10.407  -5.278   2.233
  168   HD11  ILE  26          HD11      ILE  26  10.986  -2.322   2.996
  169   HD12  ILE  26          HD12      ILE  26  10.064  -0.829   3.176
  170   HD13  ILE  26          HD13      ILE  26  11.147  -1.035   1.799
  171    H    CYS  27           H        CYS  27   7.874  -6.284   0.011
  172    HA   CYS  27           HA       CYS  27   6.883  -7.877   2.283
  173    HB2  CYS  27           HB2      CYS  27   6.053  -9.487   0.607
  174    HB3  CYS  27           HB3      CYS  27   5.337  -7.893   0.400
  175    H    MET  28           H        MET  28   7.487 -10.372   1.627
  176    HA   MET  28           HA       MET  28  10.169 -10.662   2.299
  177    HB2  MET  28           HB2      MET  28   7.951 -12.391   1.651
  178    HB3  MET  28           HB3      MET  28   9.438 -13.017   0.951
  179    HG2  MET  28           HG2      MET  28  10.231 -12.343   3.474
  180    HG3  MET  28           HG3      MET  28   8.575 -12.885   3.736
  181    HE1  MET  28           HE1      MET  28  11.748 -13.610   4.174
  182    HE2  MET  28           HE2      MET  28  12.335 -14.452   2.740
  183    HE3  MET  28           HE3      MET  28  11.901 -15.366   4.185
  184    HA   PRO  29           HA       PRO  29  12.332 -10.444  -1.548
  185    HB2  PRO  29           HB2      PRO  29  14.451 -11.989  -1.115
  186    HB3  PRO  29           HB3      PRO  29  14.181 -10.531  -0.156
  187    HG2  PRO  29           HG2      PRO  29  13.666 -13.390   0.556
  188    HG3  PRO  29           HG3      PRO  29  14.336 -12.089   1.556
  189    HD2  PRO  29           HD2      PRO  29  11.698 -12.930   1.613
  190    HD3  PRO  29           HD3      PRO  29  12.267 -11.342   2.163
  191    H    GLY  30           H        GLY  30  11.037 -11.347  -3.146
  192    HA2  GLY  30           HA2      GLY  30  11.383 -12.984  -4.953
  193    HA3  GLY  30           HA3      GLY  30  11.549 -14.205  -3.701
  194    H    TYR  31           H        TYR  31   9.118 -11.752  -3.352
  195    HA   TYR  31           HA       TYR  31   7.067 -13.809  -3.654
  196    HB2  TYR  31           HB2      TYR  31   7.215 -11.170  -2.266
  197    HB3  TYR  31           HB3      TYR  31   5.638 -11.776  -2.752
  198    HD1  TYR  31           HD1      TYR  31   8.525 -13.784  -1.562
  199    HD2  TYR  31           HD2      TYR  31   4.659 -12.251  -0.662
  200    HE1  TYR  31           HE1      TYR  31   8.445 -15.187   0.455
  201    HE2  TYR  31           HE2      TYR  31   4.570 -13.651   1.358
  202    HH   TYR  31           HH       TYR  31   5.669 -15.840   2.133
  203    H    GLU  32           H        GLU  32   4.866 -12.694  -4.433
  204    HA   GLU  32           HA       GLU  32   5.293 -10.938  -6.708
  205    HB2  GLU  32           HB2      GLU  32   4.464 -13.812  -6.956
  206    HB3  GLU  32           HB3      GLU  32   3.920 -12.624  -8.133
  207    HG2  GLU  32           HG2      GLU  32   6.665 -12.205  -7.888
  208    HG3  GLU  32           HG3      GLU  32   6.459 -13.955  -7.904
  209    H    GLY  33           H        GLY  33   2.983 -10.895  -7.953
  210    HA2  GLY  33           HA2      GLY  33   0.607 -10.842  -7.661
  211    HA3  GLY  33           HA3      GLY  33   0.858 -10.803  -5.922
  212    H    VAL  34           H        VAL  34  -0.829  -9.032  -6.407
  213    HA   VAL  34           HA       VAL  34   0.351  -6.524  -7.293
  214    HB   VAL  34           HB       VAL  34  -2.443  -7.005  -6.254
  215   HG11  VAL  34          HG11      VAL  34  -2.931  -4.866  -6.781
  216   HG12  VAL  34          HG12      VAL  34  -1.862  -4.855  -8.182
  217   HG13  VAL  34          HG13      VAL  34  -1.196  -4.637  -6.564
  218   HG21  VAL  34          HG21      VAL  34  -2.057  -6.637  -9.139
  219   HG22  VAL  34          HG22      VAL  34  -3.124  -7.737  -8.266
  220   HG23  VAL  34          HG23      VAL  34  -1.428  -8.155  -8.498
  221    H    TYR  35           H        TYR  35  -0.685  -8.116  -4.360
  222    HA   TYR  35           HA       TYR  35   0.275  -5.798  -2.812
  223    HB2  TYR  35           HB2      TYR  35  -2.149  -7.480  -2.503
  224    HB3  TYR  35           HB3      TYR  35  -1.306  -7.052  -1.020
  225    HD1  TYR  35           HD1      TYR  35  -0.749  -4.516  -0.722
  226    HD2  TYR  35           HD2      TYR  35  -3.703  -6.006  -3.396
  227    HE1  TYR  35           HE1      TYR  35  -1.842  -2.313  -0.733
  228    HE2  TYR  35           HE2      TYR  35  -4.804  -3.808  -3.416
  229    HH   TYR  35           HH       TYR  35  -3.339  -1.004  -2.054
  230    H    CYS  36           H        CYS  36   1.711  -8.189  -3.832
  231    HA   CYS  36           HA       CYS  36   3.222  -9.743  -3.136
  232    HB2  CYS  36           HB2      CYS  36   3.229  -7.700  -0.955
  233    HB3  CYS  36           HB3      CYS  36   4.141  -9.187  -0.724
  234    H    GLU  37           H        GLU  37   0.433 -10.308  -2.677
  235    HA   GLU  37           HA       GLU  37   0.441 -11.805  -0.165
  236    HB2  GLU  37           HB2      GLU  37  -1.930 -11.993  -0.418
  237    HB3  GLU  37           HB3      GLU  37  -1.494 -10.329  -0.774
  238    HG2  GLU  37           HG2      GLU  37  -1.422 -11.777  -3.206
  239    HG3  GLU  37           HG3      GLU  37  -2.927 -12.177  -2.378
  240    H    ILE  38           H        ILE  38   2.069 -12.650  -2.422
  241    HA   ILE  38           HA       ILE  38   0.892 -15.317  -2.806
  242    HB   ILE  38           HB       ILE  38   2.458 -13.891  -4.953
  243   HG12  ILE  38          HG12      ILE  38   0.299 -12.754  -4.548
  244   HG13  ILE  38          HG13      ILE  38   0.345 -13.547  -6.119
  245   HG21  ILE  38          HG21      ILE  38   1.611 -15.699  -6.379
  246   HG22  ILE  38          HG22      ILE  38   0.818 -16.421  -4.978
  247   HG23  ILE  38          HG23      ILE  38   2.577 -16.315  -5.038
  248   HD11  ILE  38          HD11      ILE  38  -0.818 -14.988  -3.787
  249   HD12  ILE  38          HD12      ILE  38  -1.182 -15.145  -5.505
  250   HD13  ILE  38          HD13      ILE  38  -1.758 -13.740  -4.606
  251    H1   FUC  39           H1       FUC  39  10.364  -3.916   6.384
  252    H2   FUC  39           H2       FUC  39  11.458  -5.733   7.604
  253    H3   FUC  39           H3       FUC  39   8.638  -6.558   8.432
  254    H4   FUC  39           H4       FUC  39   9.008  -8.557   7.109
  255    H5   FUC  39           H5       FUC  39   8.020  -6.616   5.957
  256    H61  FUC  39           H61      FUC  39   8.434  -8.617   4.556
  257    H62  FUC  39           H62      FUC  39  10.092  -8.035   4.207
  258    H63  FUC  39           H63      FUC  39   8.677  -7.114   3.612
  259    HO2  FUC  39           HO2      FUC  39  10.731  -5.042   9.702
  260    HO4  FUC  39           HO4      FUC  39  11.327  -8.593   7.328
  261    H1   NAG  40           H1       NAG  40   8.914  -8.882   9.569
  262    H2   NAG  40           H2       NAG  40  11.009  -8.019  11.648
  263    H3   NAG  40           H3       NAG  40   8.965 -10.306  11.779
  264    H4   NAG  40           H4       NAG  40   9.022  -7.673  13.355
  265    H5   NAG  40           H5       NAG  40   7.113  -8.567  11.109
  266    H61  NAG  40           H61      NAG  40   7.015  -5.769  11.560
  267    H62  NAG  40           H62      NAG  40   6.895  -6.548  13.155
  268    H81  NAG  40           H81      NAG  40  13.649 -11.289  10.439
  269    H82  NAG  40           H82      NAG  40  12.769 -11.116   8.892
  270    H83  NAG  40           H83      NAG  40  14.237 -10.143   9.199
  271    HN2  NAG  40           HN2      NAG  40  10.875 -10.664  10.339
  272    HO3  NAG  40           HO3      NAG  40  10.640  -9.195  13.798
  273    HO4  NAG  40           HO4      NAG  40   6.924  -9.579  13.133
  274    HO6  NAG  40           HO6      NAG  40   5.360  -7.504  10.958
  Start of MODEL   12
    1    H1   ASP   1           H1       ASP   1 -10.811   9.546  -0.367
    2    HA   ASP   1           HA       ASP   1 -12.505   7.956   0.884
    3    HB2  ASP   1           HB2      ASP   1 -12.237   5.648   0.060
    4    HB3  ASP   1           HB3      ASP   1 -12.965   6.694  -1.157
    5    H    VAL   2           H        VAL   2  -9.252   8.056  -0.391
    6    HA   VAL   2           HA       VAL   2  -7.214   7.763   0.578
    7    HB   VAL   2           HB       VAL   2  -8.663   7.821   3.226
    8   HG11  VAL   2          HG11      VAL   2  -6.644   8.189   4.223
    9   HG12  VAL   2          HG12      VAL   2  -5.947   8.947   2.792
   10   HG13  VAL   2          HG13      VAL   2  -6.117   7.192   2.866
   11   HG21  VAL   2          HG21      VAL   2  -8.119   9.955   1.260
   12   HG22  VAL   2          HG22      VAL   2  -7.739  10.332   2.940
   13   HG23  VAL   2          HG23      VAL   2  -9.373   9.839   2.495
   14    H    ASN   3           H        ASN   3  -7.120   5.628  -0.303
   15    HA   ASN   3           HA       ASN   3  -7.263   3.544   1.769
   16    HB2  ASN   3           HB2      ASN   3  -9.085   3.518  -0.110
   17    HB3  ASN   3           HB3      ASN   3  -7.784   2.881  -1.110
   18   HD21  ASN   3          HD21      ASN   3 -10.225   1.585  -0.307
   19   HD22  ASN   3          HD22      ASN   3  -9.769   0.169   0.570
   20    H    GLU   4           H        GLU   4  -4.953   4.856   1.440
   21    HA   GLU   4           HA       GLU   4  -3.287   3.425  -0.467
   22    HB2  GLU   4           HB2      GLU   4  -2.681   5.653   1.479
   23    HB3  GLU   4           HB3      GLU   4  -1.479   4.921   0.425
   24    HG2  GLU   4           HG2      GLU   4  -2.106   6.167  -1.295
   25    HG3  GLU   4           HG3      GLU   4  -3.803   5.748  -1.066
   26    H    CYS   5           H        CYS   5  -2.652   4.282   2.915
   27    HA   CYS   5           HA       CYS   5  -2.125   1.478   3.535
   28    HB2  CYS   5           HB2      CYS   5  -0.001   2.757   2.784
   29    HB3  CYS   5           HB3      CYS   5  -0.119   3.543   4.351
   30    H    ILE   6           H        ILE   6  -3.643   1.233   5.072
   31    HA   ILE   6           HA       ILE   6  -3.580   3.102   7.344
   32    HB   ILE   6           HB       ILE   6  -6.002   1.555   6.485
   33   HG12  ILE   6          HG12      ILE   6  -5.369   3.154   4.721
   34   HG13  ILE   6          HG13      ILE   6  -6.864   3.630   5.522
   35   HG21  ILE   6          HG21      ILE   6  -5.487   2.636   8.882
   36   HG22  ILE   6          HG22      ILE   6  -7.108   2.526   8.197
   37   HG23  ILE   6          HG23      ILE   6  -6.198   4.031   8.070
   38   HD11  ILE   6          HD11      ILE   6  -5.573   5.586   5.209
   39   HD12  ILE   6          HD12      ILE   6  -4.130   4.820   5.873
   40   HD13  ILE   6          HD13      ILE   6  -5.496   5.190   6.925
   41    H    SER   7           H        SER   7  -4.938  -0.106   6.645
   42    HA   SER   7           HA       SER   7  -3.791  -1.049   9.180
   43    HB2  SER   7           HB2      SER   7  -6.361  -1.056   8.725
   44    HB3  SER   7           HB3      SER   7  -6.005  -2.477   7.742
   45    HG   SER   7           HG       SER   7  -5.152  -2.214  10.429
   46    H    ASN   8           H        ASN   8  -1.932  -1.057   7.352
   47    HA   ASN   8           HA       ASN   8  -0.433  -2.316   6.194
   48    HB2  ASN   8           HB2      ASN   8  -0.452  -3.660   8.237
   49    HB3  ASN   8           HB3      ASN   8  -1.834  -4.571   7.643
   50   HD21  ASN   8          HD21      ASN   8   0.021  -6.127   8.329
   51   HD22  ASN   8          HD22      ASN   8   0.970  -6.704   7.014
   52    HA   PRO   9           HA       PRO   9  -3.337  -3.123   2.737
   53    HB2  PRO   9           HB2      PRO   9  -1.455  -2.563   0.815
   54    HB3  PRO   9           HB3      PRO   9  -2.504  -1.353   1.561
   55    HG2  PRO   9           HG2      PRO   9   0.336  -2.048   2.184
   56    HG3  PRO   9           HG3      PRO   9  -0.437  -0.454   2.104
   57    HD2  PRO   9           HD2      PRO   9   0.079  -1.670   4.448
   58    HD3  PRO   9           HD3      PRO   9  -1.359  -0.655   4.216
   59    H    CYS  10           H        CYS  10   0.039  -4.170   3.038
   60    HA   CYS  10           HA       CYS  10  -0.009  -6.240   1.169
   61    HB2  CYS  10           HB2      CYS  10   1.637  -5.649   3.592
   62    HB3  CYS  10           HB3      CYS  10   1.784  -7.232   2.837
   63    H    GLN  11           H        GLN  11  -0.467  -8.420   1.286
   64    HA   GLN  11           HA       GLN  11  -2.165  -9.209   3.553
   65    HB2  GLN  11           HB2      GLN  11  -2.291  -9.652   0.651
   66    HB3  GLN  11           HB3      GLN  11  -2.628 -11.084   1.613
   67    HG2  GLN  11           HG2      GLN  11  -4.003  -8.463   2.098
   68    HG3  GLN  11           HG3      GLN  11  -4.602  -9.651   0.941
   69   HE21  GLN  11          HE21      GLN  11  -3.998  -8.974   4.307
   70   HE22  GLN  11          HE22      GLN  11  -4.997 -10.232   4.944
   71    H    ASN  12           H        ASN  12   0.769  -9.375   3.544
   72    HA   ASN  12           HA       ASN  12   0.953 -12.197   4.235
   73    HB2  ASN  12           HB2      ASN  12   2.388 -10.923   1.982
   74    HB3  ASN  12           HB3      ASN  12   3.348 -11.980   3.010
   75   HD21  ASN  12          HD21      ASN  12   3.057 -12.659   0.472
   76   HD22  ASN  12          HD22      ASN  12   2.007 -14.014   0.319
   77    H    ASP  13           H        ASP  13   1.161  -9.325   5.425
   78    HA   ASP  13           HA       ASP  13   2.168  -8.449   7.270
   79    HB2  ASP  13           HB2      ASP  13   2.399 -11.091   7.730
   80    HB3  ASP  13           HB3      ASP  13   4.105 -10.676   7.597
   81    H    ALA  14           H        ALA  14   2.967  -7.281   5.172
   82    HA   ALA  14           HA       ALA  14   5.899  -7.373   5.086
   83    HB1  ALA  14           HB1      ALA  14   3.916  -7.265   3.047
   84    HB2  ALA  14           HB2      ALA  14   5.667  -7.381   2.882
   85    HB3  ALA  14           HB3      ALA  14   4.892  -5.799   2.969
   86    H    THR  15           H        THR  15   6.760  -5.088   4.321
   87    HA   THR  15           HA       THR  15   5.923  -3.226   6.395
   88    HB   THR  15           HB       THR  15   8.277  -3.240   4.500
   89   HG21  THR  15          HG21      THR  15   7.552  -1.222   6.601
   90   HG22  THR  15          HG22      THR  15   7.876  -0.943   4.890
   91   HG23  THR  15          HG23      THR  15   9.185  -1.429   5.966
   92    H    CYS  16           H        CYS  16   5.717  -0.909   5.877
   93    HA   CYS  16           HA       CYS  16   4.841  -0.341   3.144
   94    HB2  CYS  16           HB2      CYS  16   2.807  -0.988   4.334
   95    HB3  CYS  16           HB3      CYS  16   3.157   0.182   5.602
   96    H    LEU  17           H        LEU  17   6.951   0.769   3.286
   97    HA   LEU  17           HA       LEU  17   7.424   2.923   5.030
   98    HB2  LEU  17           HB2      LEU  17   8.688   1.732   2.734
   99    HB3  LEU  17           HB3      LEU  17   8.738   3.479   2.602
  100    HG   LEU  17           HG       LEU  17   9.612   2.129   5.132
  101   HD11  LEU  17          HD11      LEU  17  11.678   2.829   3.143
  102   HD12  LEU  17          HD12      LEU  17  10.744   1.368   2.825
  103   HD13  LEU  17          HD13      LEU  17  11.639   1.531   4.336
  104   HD21  LEU  17          HD21      LEU  17  11.177   4.201   4.976
  105   HD22  LEU  17          HD22      LEU  17   9.498   4.409   5.473
  106   HD23  LEU  17          HD23      LEU  17   9.983   4.788   3.820
  107    H    ASP  18           H        ASP  18   5.503   4.141   5.118
  108    HA   ASP  18           HA       ASP  18   4.387   5.350   2.776
  109    HB2  ASP  18           HB2      ASP  18   3.530   4.925   5.388
  110    HB3  ASP  18           HB3      ASP  18   3.709   6.674   5.281
  111    H    GLN  19           H        GLN  19   5.214   7.015   1.722
  112    HA   GLN  19           HA       GLN  19   6.338   9.261   3.179
  113    HB2  GLN  19           HB2      GLN  19   7.922   7.628   1.200
  114    HB3  GLN  19           HB3      GLN  19   8.351   9.277   1.633
  115    HG2  GLN  19           HG2      GLN  19   8.109   8.143   4.082
  116    HG3  GLN  19           HG3      GLN  19   8.693   6.782   3.126
  117   HE21  GLN  19          HE21      GLN  19   9.508   9.655   4.715
  118   HE22  GLN  19          HE22      GLN  19  11.163   9.743   4.227
  119    H    ILE  20           H        ILE  20   5.735   7.852  -0.013
  120    HA   ILE  20           HA       ILE  20   5.243  10.495  -1.137
  121    HB   ILE  20           HB       ILE  20   5.028   7.852  -2.571
  122   HG12  ILE  20          HG12      ILE  20   7.256   8.028  -1.558
  123   HG13  ILE  20          HG13      ILE  20   7.347   8.198  -3.309
  124   HG21  ILE  20          HG21      ILE  20   4.054   9.481  -3.909
  125   HG22  ILE  20          HG22      ILE  20   5.715   9.425  -4.498
  126   HG23  ILE  20          HG23      ILE  20   5.207  10.719  -3.413
  127   HD11  ILE  20          HD11      ILE  20   8.690   9.916  -2.747
  128   HD12  ILE  20          HD12      ILE  20   7.920  10.152  -1.179
  129   HD13  ILE  20          HD13      ILE  20   7.153  10.774  -2.640
  130    H    GLY  21           H        GLY  21   3.282  10.850  -2.458
  131    HA2  GLY  21           HA2      GLY  21   0.941  10.608  -1.044
  132    HA3  GLY  21           HA3      GLY  21   1.006  10.838  -2.784
  133    H    GLU  22           H        GLU  22   2.418   8.222  -3.104
  134    HA   GLU  22           HA       GLU  22   0.011   6.567  -3.061
  135    HB2  GLU  22           HB2      GLU  22   2.644   5.869  -4.350
  136    HB3  GLU  22           HB3      GLU  22   1.055   5.209  -4.705
  137    HG2  GLU  22           HG2      GLU  22   1.818   8.074  -5.196
  138    HG3  GLU  22           HG3      GLU  22   1.950   6.799  -6.407
  139    H    PHE  23           H        PHE  23   0.328   4.205  -2.579
  140    HA   PHE  23           HA       PHE  23   1.745   3.968  -0.054
  141    HB2  PHE  23           HB2      PHE  23   0.500   1.901   0.247
  142    HB3  PHE  23           HB3      PHE  23  -0.592   3.203  -0.212
  143    HD1  PHE  23           HD1      PHE  23   1.081   0.145  -1.356
  144    HD2  PHE  23           HD2      PHE  23  -1.789   3.151  -2.262
  145    HE1  PHE  23           HE1      PHE  23   0.238  -1.230  -3.218
  146    HE2  PHE  23           HE2      PHE  23  -2.641   1.783  -4.126
  147    HZ   PHE  23           HZ       PHE  23  -1.627  -0.411  -4.605
  148    H    GLN  24           H        GLN  24   3.584   2.876   0.244
  149    HA   GLN  24           HA       GLN  24   4.568   1.209  -1.979
  150    HB2  GLN  24           HB2      GLN  24   6.245   2.815  -0.046
  151    HB3  GLN  24           HB3      GLN  24   6.827   1.892  -1.425
  152    HG2  GLN  24           HG2      GLN  24   5.239   3.467  -2.772
  153    HG3  GLN  24           HG3      GLN  24   5.402   4.504  -1.357
  154   HE21  GLN  24          HE21      GLN  24   7.361   2.627  -3.636
  155   HE22  GLN  24          HE22      GLN  24   8.666   3.756  -3.713
  156    H    CYS  25           H        CYS  25   3.926  -0.767  -1.205
  157    HA   CYS  25           HA       CYS  25   4.689  -1.539   1.506
  158    HB2  CYS  25           HB2      CYS  25   2.427  -2.065   0.180
  159    HB3  CYS  25           HB3      CYS  25   3.362  -3.463  -0.336
  160    H    ILE  26           H        ILE  26   6.419  -2.748   1.946
  161    HA   ILE  26           HA       ILE  26   8.071  -3.676  -0.264
  162    HB   ILE  26           HB       ILE  26   8.710  -3.864   2.676
  163   HG12  ILE  26          HG12      ILE  26   9.324  -1.606   0.754
  164   HG13  ILE  26          HG13      ILE  26   8.195  -1.528   2.104
  165   HG21  ILE  26          HG21      ILE  26  10.037  -5.214   1.046
  166   HG22  ILE  26          HG22      ILE  26  10.983  -4.050   1.972
  167   HG23  ILE  26          HG23      ILE  26  10.550  -3.701   0.298
  168   HD11  ILE  26          HD11      ILE  26  10.761  -2.399   3.029
  169   HD12  ILE  26          HD12      ILE  26   9.827  -0.974   3.486
  170   HD13  ILE  26          HD13      ILE  26  10.920  -0.906   2.103
  171    H    CYS  27           H        CYS  27   8.022  -5.692  -0.976
  172    HA   CYS  27           HA       CYS  27   6.547  -7.718   0.459
  173    HB2  CYS  27           HB2      CYS  27   7.570  -7.339  -2.268
  174    HB3  CYS  27           HB3      CYS  27   7.651  -9.001  -1.699
  175    H    MET  28           H        MET  28   7.580 -10.017   0.355
  176    HA   MET  28           HA       MET  28   9.936  -9.912   2.005
  177    HB2  MET  28           HB2      MET  28   7.839 -11.821   1.406
  178    HB3  MET  28           HB3      MET  28   9.420 -12.590   1.356
  179    HG2  MET  28           HG2      MET  28   9.642 -11.173   3.637
  180    HG3  MET  28           HG3      MET  28   7.911 -11.503   3.630
  181    HE1  MET  28           HE1      MET  28  11.252 -14.157   4.850
  182    HE2  MET  28           HE2      MET  28  10.432 -12.928   5.813
  183    HE3  MET  28           HE3      MET  28  11.282 -12.470   4.337
  184    HA   PRO  29           HA       PRO  29  13.038 -10.917  -0.968
  185    HB2  PRO  29           HB2      PRO  29  14.463 -12.927   0.106
  186    HB3  PRO  29           HB3      PRO  29  14.493 -11.291   0.770
  187    HG2  PRO  29           HG2      PRO  29  12.944 -13.680   1.699
  188    HG3  PRO  29           HG3      PRO  29  13.840 -12.486   2.658
  189    HD2  PRO  29           HD2      PRO  29  11.144 -12.403   2.349
  190    HD3  PRO  29           HD3      PRO  29  12.132 -10.945   2.564
  191    H    GLY  30           H        GLY  30  11.335 -11.691  -2.479
  192    HA2  GLY  30           HA2      GLY  30  11.407 -13.316  -4.274
  193    HA3  GLY  30           HA3      GLY  30  11.761 -14.549  -3.072
  194    H    TYR  31           H        TYR  31   9.238 -12.065  -3.535
  195    HA   TYR  31           HA       TYR  31   7.238 -14.168  -3.028
  196    HB2  TYR  31           HB2      TYR  31   7.516 -11.413  -1.991
  197    HB3  TYR  31           HB3      TYR  31   5.888 -11.889  -2.456
  198    HD1  TYR  31           HD1      TYR  31   8.583 -13.959  -0.936
  199    HD2  TYR  31           HD2      TYR  31   4.765 -12.153  -0.425
  200    HE1  TYR  31           HE1      TYR  31   8.322 -15.132   1.209
  201    HE2  TYR  31           HE2      TYR  31   4.493 -13.321   1.721
  202    HH   TYR  31           HH       TYR  31   6.303 -14.320   3.516
  203    H    GLU  32           H        GLU  32   4.955 -13.024  -3.778
  204    HA   GLU  32           HA       GLU  32   5.309 -11.904  -6.456
  205    HB2  GLU  32           HB2      GLU  32   3.708 -14.402  -5.869
  206    HB3  GLU  32           HB3      GLU  32   3.696 -13.535  -7.399
  207    HG2  GLU  32           HG2      GLU  32   6.239 -14.598  -6.230
  208    HG3  GLU  32           HG3      GLU  32   5.168 -15.614  -7.193
  209    H    GLY  33           H        GLY  33   2.853 -11.723  -7.391
  210    HA2  GLY  33           HA2      GLY  33   0.722 -10.851  -7.103
  211    HA3  GLY  33           HA3      GLY  33   0.936 -10.986  -5.365
  212    H    VAL  34           H        VAL  34  -0.317  -8.799  -6.178
  213    HA   VAL  34           HA       VAL  34   1.595  -6.640  -6.555
  214    HB   VAL  34           HB       VAL  34  -1.395  -6.420  -6.215
  215   HG11  VAL  34          HG11      VAL  34   0.764  -4.544  -7.114
  216   HG12  VAL  34          HG12      VAL  34  -0.489  -4.297  -5.898
  217   HG13  VAL  34          HG13      VAL  34  -0.913  -4.313  -7.610
  218   HG21  VAL  34          HG21      VAL  34  -1.215  -6.113  -8.796
  219   HG22  VAL  34          HG22      VAL  34  -1.266  -7.737  -8.109
  220   HG23  VAL  34          HG23      VAL  34   0.274  -7.042  -8.614
  221    H    TYR  35           H        TYR  35  -0.879  -7.597  -4.184
  222    HA   TYR  35           HA       TYR  35   0.236  -5.680  -2.272
  223    HB2  TYR  35           HB2      TYR  35  -2.385  -7.009  -2.626
  224    HB3  TYR  35           HB3      TYR  35  -1.869  -6.766  -0.962
  225    HD1  TYR  35           HD1      TYR  35  -0.451  -4.178  -1.170
  226    HD2  TYR  35           HD2      TYR  35  -4.103  -5.466  -2.934
  227    HE1  TYR  35           HE1      TYR  35  -1.215  -1.843  -1.281
  228    HE2  TYR  35           HE2      TYR  35  -4.875  -3.135  -3.051
  229    HH   TYR  35           HH       TYR  35  -3.593  -0.773  -3.155
  230    H    CYS  36           H        CYS  36   1.577  -8.204  -3.041
  231    HA   CYS  36           HA       CYS  36   2.656  -9.973  -2.102
  232    HB2  CYS  36           HB2      CYS  36   2.918  -7.763  -0.394
  233    HB3  CYS  36           HB3      CYS  36   2.578  -9.128   0.661
  234    H    GLU  37           H        GLU  37   1.289 -11.675  -2.312
  235    HA   GLU  37           HA       GLU  37   0.172 -12.791   0.048
  236    HB2  GLU  37           HB2      GLU  37  -1.623 -11.230  -0.315
  237    HB3  GLU  37           HB3      GLU  37  -1.735 -11.672  -2.012
  238    HG2  GLU  37           HG2      GLU  37  -3.547 -12.624  -0.664
  239    HG3  GLU  37           HG3      GLU  37  -2.557 -13.863  -1.431
  240    H    ILE  38           H        ILE  38   0.270 -12.770  -3.480
  241    HA   ILE  38           HA       ILE  38  -0.212 -15.636  -3.604
  242    HB   ILE  38           HB       ILE  38   0.490 -13.818  -5.903
  243   HG12  ILE  38          HG12      ILE  38  -1.472 -12.922  -4.708
  244   HG13  ILE  38          HG13      ILE  38  -1.910 -13.549  -6.293
  245   HG21  ILE  38          HG21      ILE  38   0.387 -16.501  -5.858
  246   HG22  ILE  38          HG22      ILE  38  -0.028 -15.535  -7.274
  247   HG23  ILE  38          HG23      ILE  38  -1.302 -16.140  -6.215
  248   HD11  ILE  38          HD11      ILE  38  -2.889 -15.488  -5.344
  249   HD12  ILE  38          HD12      ILE  38  -3.498 -14.096  -4.446
  250   HD13  ILE  38          HD13      ILE  38  -2.236 -15.112  -3.749
  251    H1   FUC  39           H1       FUC  39  10.305  -3.210   5.744
  252    H2   FUC  39           H2       FUC  39  11.572  -4.576   7.337
  253    H3   FUC  39           H3       FUC  39   8.844  -5.313   8.484
  254    H4   FUC  39           H4       FUC  39   9.315  -7.564   7.736
  255    H5   FUC  39           H5       FUC  39   8.158  -6.073   6.150
  256    H61  FUC  39           H61      FUC  39   8.777  -7.130   3.989
  257    H62  FUC  39           H62      FUC  39  10.279  -7.764   4.730
  258    H63  FUC  39           H63      FUC  39   8.684  -8.345   5.302
  259    HO2  FUC  39           HO2      FUC  39  10.869  -3.397   9.215
  260    HO4  FUC  39           HO4      FUC  39  11.636  -7.399   7.838
  261    H1   NAG  40           H1       NAG  40   9.222  -7.055  10.298
  262    H2   NAG  40           H2       NAG  40  11.473  -5.624  11.827
  263    H3   NAG  40           H3       NAG  40   9.426  -7.673  12.845
  264    H4   NAG  40           H4       NAG  40   9.629  -4.673  13.460
  265    H5   NAG  40           H5       NAG  40   7.542  -6.187  11.774
  266    H61  NAG  40           H61      NAG  40   7.585  -3.536  12.990
  267    H62  NAG  40           H62      NAG  40   7.426  -3.447  11.221
  268    H81  NAG  40           H81      NAG  40  13.306  -9.733  12.252
  269    H82  NAG  40           H82      NAG  40  14.731  -8.799  11.708
  270    H83  NAG  40           H83      NAG  40  13.497  -9.320  10.522
  271    HN2  NAG  40           HN2      NAG  40  11.246  -8.393  10.897
  272    HO3  NAG  40           HO3      NAG  40  11.312  -6.038  14.226
  273    HO4  NAG  40           HO4      NAG  40   7.452  -6.404  14.007
  274    HO6  NAG  40           HO6      NAG  40   5.418  -4.057  11.497
  Start of MODEL   13
    1    H1   ASP   1           H1       ASP   1  -2.862  12.484   6.988
    2    HA   ASP   1           HA       ASP   1  -0.716  10.792   6.361
    3    HB2  ASP   1           HB2      ASP   1  -1.452  11.596   8.663
    4    HB3  ASP   1           HB3      ASP   1  -2.665  10.321   8.615
    5    H    VAL   2           H        VAL   2  -4.176  10.309   6.225
    6    HA   VAL   2           HA       VAL   2  -3.879   7.462   5.688
    7    HB   VAL   2           HB       VAL   2  -6.355   7.454   5.544
    8   HG11  VAL   2          HG11      VAL   2  -5.879   8.879   8.080
    9   HG12  VAL   2          HG12      VAL   2  -4.811   7.515   7.751
   10   HG13  VAL   2          HG13      VAL   2  -6.558   7.278   7.784
   11   HG21  VAL   2          HG21      VAL   2  -6.401   9.905   4.778
   12   HG22  VAL   2          HG22      VAL   2  -6.311  10.300   6.494
   13   HG23  VAL   2          HG23      VAL   2  -7.668   9.357   5.875
   14    H    ASN   3           H        ASN   3  -4.437   6.467   3.750
   15    HA   ASN   3           HA       ASN   3  -5.474   7.845   1.506
   16    HB2  ASN   3           HB2      ASN   3  -3.033   8.710   1.761
   17    HB3  ASN   3           HB3      ASN   3  -2.581   7.132   1.126
   18   HD21  ASN   3          HD21      ASN   3  -2.161   9.714  -0.061
   19   HD22  ASN   3          HD22      ASN   3  -2.983   9.704  -1.581
   20    H    GLU   4           H        GLU   4  -2.960   5.345   1.925
   21    HA   GLU   4           HA       GLU   4  -4.850   3.377   0.837
   22    HB2  GLU   4           HB2      GLU   4  -2.092   4.024  -0.125
   23    HB3  GLU   4           HB3      GLU   4  -2.691   2.377  -0.266
   24    HG2  GLU   4           HG2      GLU   4  -4.194   4.744  -1.338
   25    HG3  GLU   4           HG3      GLU   4  -2.988   3.868  -2.280
   26    H    CYS   5           H        CYS   5  -1.817   3.909   2.579
   27    HA   CYS   5           HA       CYS   5  -1.914   1.228   3.698
   28    HB2  CYS   5           HB2      CYS   5   0.198   2.639   2.951
   29    HB3  CYS   5           HB3      CYS   5   0.077   3.246   4.598
   30    H    ILE   6           H        ILE   6  -3.663   1.205   5.070
   31    HA   ILE   6           HA       ILE   6  -3.415   2.904   7.457
   32    HB   ILE   6           HB       ILE   6  -6.050   2.012   6.339
   33   HG12  ILE   6          HG12      ILE   6  -5.000   3.504   4.711
   34   HG13  ILE   6          HG13      ILE   6  -6.341   4.319   5.513
   35   HG21  ILE   6          HG21      ILE   6  -6.191   2.483   8.656
   36   HG22  ILE   6          HG22      ILE   6  -6.867   3.877   7.815
   37   HG23  ILE   6          HG23      ILE   6  -5.237   3.956   8.482
   38   HD11  ILE   6          HD11      ILE   6  -3.769   5.273   5.202
   39   HD12  ILE   6          HD12      ILE   6  -3.839   4.766   6.889
   40   HD13  ILE   6          HD13      ILE   6  -5.014   5.925   6.268
   41    H    SER   7           H        SER   7  -5.364   0.138   6.376
   42    HA   SER   7           HA       SER   7  -4.865  -1.149   8.954
   43    HB2  SER   7           HB2      SER   7  -7.196  -1.034   8.451
   44    HB3  SER   7           HB3      SER   7  -6.938  -1.628   6.811
   45    HG   SER   7           HG       SER   7  -7.287  -3.522   7.631
   46    H    ASN   8           H        ASN   8  -2.629  -1.244   7.583
   47    HA   ASN   8           HA       ASN   8  -1.039  -2.573   6.637
   48    HB2  ASN   8           HB2      ASN   8  -1.529  -3.912   8.633
   49    HB3  ASN   8           HB3      ASN   8  -2.807  -4.752   7.766
   50   HD21  ASN   8          HD21      ASN   8  -1.206  -6.405   8.773
   51   HD22  ASN   8          HD22      ASN   8  -0.041  -7.018   7.663
   52    HA   PRO   9           HA       PRO   9  -3.399  -3.178   2.728
   53    HB2  PRO   9           HB2      PRO   9  -1.194  -2.626   1.167
   54    HB3  PRO   9           HB3      PRO   9  -2.362  -1.421   1.717
   55    HG2  PRO   9           HG2      PRO   9   0.324  -2.108   2.829
   56    HG3  PRO   9           HG3      PRO   9  -0.444  -0.521   2.648
   57    HD2  PRO   9           HD2      PRO   9  -0.324  -1.784   5.021
   58    HD3  PRO   9           HD3      PRO   9  -1.714  -0.778   4.565
   59    H    CYS  10           H        CYS  10   0.057  -4.072   2.925
   60    HA   CYS  10           HA       CYS  10   0.008  -6.243   1.238
   61    HB2  CYS  10           HB2      CYS  10   1.710  -5.496   3.574
   62    HB3  CYS  10           HB3      CYS  10   1.891  -7.106   2.883
   63    H    GLN  11           H        GLN  11  -0.712  -8.280   1.313
   64    HA   GLN  11           HA       GLN  11  -2.186  -9.107   3.696
   65    HB2  GLN  11           HB2      GLN  11  -2.279  -9.791   0.802
   66    HB3  GLN  11           HB3      GLN  11  -2.789 -11.026   1.945
   67    HG2  GLN  11           HG2      GLN  11  -3.896  -8.241   2.020
   68    HG3  GLN  11           HG3      GLN  11  -4.573  -9.492   0.978
   69   HE21  GLN  11          HE21      GLN  11  -6.535  -9.487   2.059
   70   HE22  GLN  11          HE22      GLN  11  -6.723 -10.160   3.639
   71    H    ASN  12           H        ASN  12   0.745  -9.224   3.644
   72    HA   ASN  12           HA       ASN  12   0.990 -12.016   4.413
   73    HB2  ASN  12           HB2      ASN  12   2.360 -10.812   2.072
   74    HB3  ASN  12           HB3      ASN  12   3.312 -11.888   3.087
   75   HD21  ASN  12          HD21      ASN  12   2.861 -12.545   0.533
   76   HD22  ASN  12          HD22      ASN  12   1.784 -13.884   0.450
   77    H    ASP  13           H        ASP  13   1.280  -9.047   5.424
   78    HA   ASP  13           HA       ASP  13   2.382  -8.070   7.158
   79    HB2  ASP  13           HB2      ASP  13   2.364 -10.481   8.042
   80    HB3  ASP  13           HB3      ASP  13   4.028 -10.577   7.473
   81    H    ALA  14           H        ALA  14   3.191  -6.979   5.109
   82    HA   ALA  14           HA       ALA  14   6.091  -7.329   4.820
   83    HB1  ALA  14           HB1      ALA  14   4.972  -5.636   2.807
   84    HB2  ALA  14           HB2      ALA  14   4.028  -7.122   2.921
   85    HB3  ALA  14           HB3      ALA  14   5.765  -7.202   2.631
   86    H    THR  15           H        THR  15   7.067  -5.102   3.967
   87    HA   THR  15           HA       THR  15   6.595  -3.212   6.128
   88    HB   THR  15           HB       THR  15   8.721  -3.294   3.977
   89   HG21  THR  15          HG21      THR  15   8.961  -1.121   4.500
   90   HG22  THR  15          HG22      THR  15   9.813  -1.785   5.893
   91   HG23  THR  15          HG23      THR  15   8.130  -1.284   6.046
   92    H    CYS  16           H        CYS  16   5.871  -1.140   5.882
   93    HA   CYS  16           HA       CYS  16   5.208  -0.232   3.169
   94    HB2  CYS  16           HB2      CYS  16   3.163  -1.172   4.136
   95    HB3  CYS  16           HB3      CYS  16   3.344  -0.140   5.550
   96    H    LEU  17           H        LEU  17   6.869   1.262   3.176
   97    HA   LEU  17           HA       LEU  17   7.337   3.061   5.334
   98    HB2  LEU  17           HB2      LEU  17   8.327   2.763   2.544
   99    HB3  LEU  17           HB3      LEU  17   8.557   4.313   3.331
  100    HG   LEU  17           HG       LEU  17   9.495   2.659   5.257
  101   HD11  LEU  17          HD11      LEU  17  10.757   1.380   2.922
  102   HD12  LEU  17          HD12      LEU  17   9.114   0.861   3.297
  103   HD13  LEU  17          HD13      LEU  17  10.382   0.725   4.516
  104   HD21  LEU  17          HD21      LEU  17  10.573   4.661   4.248
  105   HD22  LEU  17          HD22      LEU  17  11.135   3.639   2.925
  106   HD23  LEU  17          HD23      LEU  17  11.691   3.336   4.572
  107    H    ASP  18           H        ASP  18   6.272   4.848   5.847
  108    HA   ASP  18           HA       ASP  18   4.021   5.745   4.399
  109    HB2  ASP  18           HB2      ASP  18   4.341   6.026   6.858
  110    HB3  ASP  18           HB3      ASP  18   5.563   7.249   6.523
  111    H    GLN  19           H        GLN  19   4.097   6.738   2.498
  112    HA   GLN  19           HA       GLN  19   6.169   8.791   2.076
  113    HB2  GLN  19           HB2      GLN  19   5.883   6.450   0.638
  114    HB3  GLN  19           HB3      GLN  19   5.046   7.629  -0.362
  115    HG2  GLN  19           HG2      GLN  19   7.413   8.881   0.408
  116    HG3  GLN  19           HG3      GLN  19   7.867   7.220   0.028
  117   HE21  GLN  19          HE21      GLN  19   5.994   6.683  -1.958
  118   HE22  GLN  19          HE22      GLN  19   6.359   7.650  -3.342
  119    H    ILE  20           H        ILE  20   5.556  10.500   0.541
  120    HA   ILE  20           HA       ILE  20   2.801  11.317   1.013
  121    HB   ILE  20           HB       ILE  20   5.012  12.897  -0.301
  122   HG12  ILE  20          HG12      ILE  20   4.171  13.469   2.487
  123   HG13  ILE  20          HG13      ILE  20   5.150  12.027   2.244
  124   HG21  ILE  20          HG21      ILE  20   2.923  13.854  -0.845
  125   HG22  ILE  20          HG22      ILE  20   3.569  14.821   0.479
  126   HG23  ILE  20          HG23      ILE  20   2.309  13.628   0.791
  127   HD11  ILE  20          HD11      ILE  20   6.557  13.896   2.799
  128   HD12  ILE  20          HD12      ILE  20   5.880  14.842   1.473
  129   HD13  ILE  20          HD13      ILE  20   6.853  13.411   1.130
  130    H    GLY  21           H        GLY  21   1.609  10.077  -0.429
  131    HA2  GLY  21           HA2      GLY  21   0.771  10.933  -2.775
  132    HA3  GLY  21           HA3      GLY  21   2.295  10.213  -3.270
  133    H    GLU  22           H        GLU  22   2.606   7.904  -2.743
  134    HA   GLU  22           HA       GLU  22   0.043   6.451  -2.703
  135    HB2  GLU  22           HB2      GLU  22   2.517   5.669  -4.255
  136    HB3  GLU  22           HB3      GLU  22   0.972   4.830  -4.256
  137    HG2  GLU  22           HG2      GLU  22  -0.066   6.865  -5.231
  138    HG3  GLU  22           HG3      GLU  22   1.545   7.571  -5.353
  139    H    PHE  23           H        PHE  23   0.626   3.962  -2.351
  140    HA   PHE  23           HA       PHE  23   2.095   3.898   0.171
  141    HB2  PHE  23           HB2      PHE  23   0.927   1.824   0.625
  142    HB3  PHE  23           HB3      PHE  23  -0.230   3.057   0.136
  143    HD1  PHE  23           HD1      PHE  23  -1.209   2.994  -2.130
  144    HD2  PHE  23           HD2      PHE  23   1.237  -0.146  -0.632
  145    HE1  PHE  23           HE1      PHE  23  -2.066   1.496  -3.888
  146    HE2  PHE  23           HE2      PHE  23   0.386  -1.653  -2.385
  147    HZ   PHE  23           HZ       PHE  23  -1.267  -0.831  -4.017
  148    H    GLN  24           H        GLN  24   3.987   2.883   0.408
  149    HA   GLN  24           HA       GLN  24   4.991   1.322  -1.875
  150    HB2  GLN  24           HB2      GLN  24   6.662   2.533   0.323
  151    HB3  GLN  24           HB3      GLN  24   7.200   1.938  -1.241
  152    HG2  GLN  24           HG2      GLN  24   5.299   4.238  -1.042
  153    HG3  GLN  24           HG3      GLN  24   7.037   4.471  -0.869
  154   HE21  GLN  24          HE21      GLN  24   4.501   3.374  -3.025
  155   HE22  GLN  24          HE22      GLN  24   5.390   3.588  -4.490
  156    H    CYS  25           H        CYS  25   4.044  -0.646  -1.242
  157    HA   CYS  25           HA       CYS  25   4.798  -1.760   1.342
  158    HB2  CYS  25           HB2      CYS  25   2.513  -1.986  -0.149
  159    HB3  CYS  25           HB3      CYS  25   3.339  -3.491  -0.533
  160    H    ILE  26           H        ILE  26   6.675  -2.774   1.529
  161    HA   ILE  26           HA       ILE  26   7.978  -3.903  -0.816
  162    HB   ILE  26           HB       ILE  26   9.022  -3.834   2.013
  163   HG12  ILE  26          HG12      ILE  26   9.416  -1.821  -0.213
  164   HG13  ILE  26          HG13      ILE  26   8.488  -1.558   1.261
  165   HG21  ILE  26          HG21      ILE  26  10.992  -4.588   1.210
  166   HG22  ILE  26          HG22      ILE  26  10.817  -3.736  -0.324
  167   HG23  ILE  26          HG23      ILE  26   9.967  -5.258  -0.059
  168   HD11  ILE  26          HD11      ILE  26  10.331  -0.753   2.177
  169   HD12  ILE  26          HD12      ILE  26  11.300  -1.249   0.790
  170   HD13  ILE  26          HD13      ILE  26  11.013  -2.378   2.114
  171    H    CYS  27           H        CYS  27   7.826  -5.976  -1.343
  172    HA   CYS  27           HA       CYS  27   6.556  -7.844   0.458
  173    HB2  CYS  27           HB2      CYS  27   6.785  -7.575  -2.344
  174    HB3  CYS  27           HB3      CYS  27   7.565  -9.096  -1.925
  175    H    MET  28           H        MET  28   7.473 -10.059   0.718
  176    HA   MET  28           HA       MET  28   9.975  -9.943   1.987
  177    HB2  MET  28           HB2      MET  28   7.911 -11.916   1.522
  178    HB3  MET  28           HB3      MET  28   9.506 -12.638   1.367
  179    HG2  MET  28           HG2      MET  28   9.912 -11.306   3.620
  180    HG3  MET  28           HG3      MET  28   8.163 -11.483   3.740
  181    HE1  MET  28           HE1      MET  28  11.400 -12.569   4.245
  182    HE2  MET  28           HE2      MET  28  11.529 -14.320   4.086
  183    HE3  MET  28           HE3      MET  28  10.947 -13.611   5.592
  184    HA   PRO  29           HA       PRO  29  12.895 -10.893  -1.184
  185    HB2  PRO  29           HB2      PRO  29  14.572 -12.663  -0.091
  186    HB3  PRO  29           HB3      PRO  29  14.450 -11.008   0.516
  187    HG2  PRO  29           HG2      PRO  29  13.230 -13.518   1.603
  188    HG3  PRO  29           HG3      PRO  29  14.022 -12.192   2.474
  189    HD2  PRO  29           HD2      PRO  29  11.308 -12.450   2.251
  190    HD3  PRO  29           HD3      PRO  29  12.132 -10.893   2.461
  191    H    GLY  30           H        GLY  30  11.161 -11.926  -2.511
  192    HA2  GLY  30           HA2      GLY  30  11.461 -13.745  -4.172
  193    HA3  GLY  30           HA3      GLY  30  11.670 -14.824  -2.801
  194    H    TYR  31           H        TYR  31   9.282 -12.243  -3.104
  195    HA   TYR  31           HA       TYR  31   7.178 -14.292  -2.923
  196    HB2  TYR  31           HB2      TYR  31   7.506 -11.593  -1.739
  197    HB3  TYR  31           HB3      TYR  31   5.881 -12.028  -2.250
  198    HD1  TYR  31           HD1      TYR  31   8.643 -13.945  -0.612
  199    HD2  TYR  31           HD2      TYR  31   4.606 -12.618  -0.422
  200    HE1  TYR  31           HE1      TYR  31   8.332 -15.208   1.475
  201    HE2  TYR  31           HE2      TYR  31   4.284 -13.876   1.666
  202    HH   TYR  31           HH       TYR  31   6.137 -16.266   2.677
  203    H    GLU  32           H        GLU  32   4.973 -13.038  -3.691
  204    HA   GLU  32           HA       GLU  32   5.450 -11.724  -6.252
  205    HB2  GLU  32           HB2      GLU  32   4.157 -14.406  -5.899
  206    HB3  GLU  32           HB3      GLU  32   3.645 -13.351  -7.209
  207    HG2  GLU  32           HG2      GLU  32   5.477 -13.759  -8.414
  208    HG3  GLU  32           HG3      GLU  32   6.540 -13.650  -7.011
  209    H    GLY  33           H        GLY  33   3.070 -11.437  -7.299
  210    HA2  GLY  33           HA2      GLY  33   0.880 -10.677  -7.015
  211    HA3  GLY  33           HA3      GLY  33   1.069 -10.852  -5.277
  212    H    VAL  34           H        VAL  34  -0.201  -8.656  -6.166
  213    HA   VAL  34           HA       VAL  34   1.709  -6.472  -6.380
  214    HB   VAL  34           HB       VAL  34  -1.299  -6.280  -6.238
  215   HG11  VAL  34          HG11      VAL  34   0.916  -4.379  -6.732
  216   HG12  VAL  34          HG12      VAL  34  -0.649  -4.125  -5.959
  217   HG13  VAL  34          HG13      VAL  34  -0.534  -4.193  -7.718
  218   HG21  VAL  34          HG21      VAL  34  -1.081  -7.553  -8.137
  219   HG22  VAL  34          HG22      VAL  34   0.522  -6.919  -8.510
  220   HG23  VAL  34          HG23      VAL  34  -0.909  -5.932  -8.811
  221    H    TYR  35           H        TYR  35  -0.889  -7.516  -4.186
  222    HA   TYR  35           HA       TYR  35   0.068  -5.601  -2.187
  223    HB2  TYR  35           HB2      TYR  35  -2.519  -6.882  -2.772
  224    HB3  TYR  35           HB3      TYR  35  -2.132  -6.758  -1.060
  225    HD1  TYR  35           HD1      TYR  35  -2.407  -4.742  -4.173
  226    HD2  TYR  35           HD2      TYR  35  -2.449  -4.735   0.081
  227    HE1  TYR  35           HE1      TYR  35  -3.129  -2.392  -4.190
  228    HE2  TYR  35           HE2      TYR  35  -3.172  -2.386   0.076
  229    HH   TYR  35           HH       TYR  35  -2.890  -0.377  -1.728
  230    H    CYS  36           H        CYS  36   1.483  -8.100  -2.875
  231    HA   CYS  36           HA       CYS  36   2.534  -9.847  -1.861
  232    HB2  CYS  36           HB2      CYS  36   1.943  -8.086   0.517
  233    HB3  CYS  36           HB3      CYS  36   2.917  -9.547   0.632
  234    H    GLU  37           H        GLU  37   1.309 -11.629  -2.186
  235    HA   GLU  37           HA       GLU  37   0.014 -12.837   0.002
  236    HB2  GLU  37           HB2      GLU  37  -1.780 -11.280  -0.397
  237    HB3  GLU  37           HB3      GLU  37  -1.793 -11.656  -2.113
  238    HG2  GLU  37           HG2      GLU  37  -3.651 -12.751  -1.151
  239    HG3  GLU  37           HG3      GLU  37  -2.451 -13.996  -1.498
  240    H    ILE  38           H        ILE  38   0.322 -12.649  -3.508
  241    HA   ILE  38           HA       ILE  38  -0.106 -15.513  -3.785
  242    HB   ILE  38           HB       ILE  38   0.458 -13.365  -5.832
  243   HG12  ILE  38          HG12      ILE  38  -1.860 -13.887  -6.561
  244   HG13  ILE  38          HG13      ILE  38  -2.009 -15.003  -5.207
  245   HG21  ILE  38          HG21      ILE  38   0.436 -16.319  -6.064
  246   HG22  ILE  38          HG22      ILE  38   1.346 -15.115  -6.978
  247   HG23  ILE  38          HG23      ILE  38  -0.355 -15.400  -7.346
  248   HD11  ILE  38          HD11      ILE  38  -1.256 -12.183  -4.655
  249   HD12  ILE  38          HD12      ILE  38  -2.164 -13.328  -3.667
  250   HD13  ILE  38          HD13      ILE  38  -2.930 -12.562  -5.059
  251    H1   FUC  39           H1       FUC  39  10.937  -3.344   5.287
  252    H2   FUC  39           H2       FUC  39  12.176  -5.162   6.366
  253    H3   FUC  39           H3       FUC  39   9.441  -6.149   7.292
  254    H4   FUC  39           H4       FUC  39   9.830  -8.070   5.868
  255    H5   FUC  39           H5       FUC  39   8.699  -6.130   4.855
  256    H61  FUC  39           H61      FUC  39  10.738  -7.361   2.932
  257    H62  FUC  39           H62      FUC  39   9.135  -8.046   3.343
  258    H63  FUC  39           H63      FUC  39   9.246  -6.490   2.461
  259    HO2  FUC  39           HO2      FUC  39  11.529  -4.600   8.529
  260    HO4  FUC  39           HO4      FUC  39  12.155  -8.008   5.965
  261    H1   NAG  40           H1       NAG  40   9.797  -8.385   8.455
  262    H2   NAG  40           H2       NAG  40  12.111  -7.569  10.306
  263    H3   NAG  40           H3       NAG  40  10.024  -9.792  10.663
  264    H4   NAG  40           H4       NAG  40  10.318  -7.151  12.200
  265    H5   NAG  40           H5       NAG  40   8.166  -8.000  10.166
  266    H61  NAG  40           H61      NAG  40   7.613  -5.508  10.302
  267    H62  NAG  40           H62      NAG  40   8.583  -5.481  11.793
  268    H81  NAG  40           H81      NAG  40  13.792 -11.451   8.661
  269    H82  NAG  40           H82      NAG  40  15.292 -10.580   9.098
  270    H83  NAG  40           H83      NAG  40  14.343 -10.067   7.671
  271    HN2  NAG  40           HN2      NAG  40  11.810  -9.839   8.503
  272    HO3  NAG  40           HO3      NAG  40  12.026  -8.737  12.398
  273    HO4  NAG  40           HO4      NAG  40   9.095  -8.194  13.529
  274    HO6  NAG  40           HO6      NAG  40   7.117  -6.756  12.790
  Start of MODEL   14
    1    H1   ASP   1           H1       ASP   1 -11.587   7.040  -1.560
    2    HA   ASP   1           HA       ASP   1 -10.495   9.012  -2.494
    3    HB2  ASP   1           HB2      ASP   1  -9.797   9.339   0.409
    4    HB3  ASP   1           HB3      ASP   1  -8.810  10.097  -0.837
    5    H    VAL   2           H        VAL   2 -10.032   6.250  -2.536
    6    HA   VAL   2           HA       VAL   2  -8.426   4.756  -3.146
    7    HB   VAL   2           HB       VAL   2  -6.503   7.082  -3.174
    8   HG11  VAL   2          HG11      VAL   2  -6.417   4.274  -4.074
    9   HG12  VAL   2          HG12      VAL   2  -5.115   5.339  -3.543
   10   HG13  VAL   2          HG13      VAL   2  -5.745   5.467  -5.185
   11   HG21  VAL   2          HG21      VAL   2  -7.963   7.933  -4.675
   12   HG22  VAL   2          HG22      VAL   2  -8.719   6.372  -4.989
   13   HG23  VAL   2          HG23      VAL   2  -7.185   6.779  -5.758
   14    H    ASN   3           H        ASN   3  -7.900   3.353  -1.607
   15    HA   ASN   3           HA       ASN   3  -6.709   4.214   0.877
   16    HB2  ASN   3           HB2      ASN   3  -8.242   1.986   0.003
   17    HB3  ASN   3           HB3      ASN   3  -6.716   1.360   0.620
   18   HD21  ASN   3          HD21      ASN   3  -8.117   0.407   2.251
   19   HD22  ASN   3          HD22      ASN   3  -8.552   1.349   3.633
   20    H    GLU   4           H        GLU   4  -4.643   3.908   1.556
   21    HA   GLU   4           HA       GLU   4  -2.771   2.706  -0.375
   22    HB2  GLU   4           HB2      GLU   4  -2.620   5.236   1.194
   23    HB3  GLU   4           HB3      GLU   4  -1.128   4.348   0.912
   24    HG2  GLU   4           HG2      GLU   4  -0.977   5.200  -1.118
   25    HG3  GLU   4           HG3      GLU   4  -2.544   4.514  -1.545
   26    H    CYS   5           H        CYS   5  -2.319   3.865   2.938
   27    HA   CYS   5           HA       CYS   5  -1.832   1.115   3.822
   28    HB2  CYS   5           HB2      CYS   5   0.258   2.771   3.230
   29    HB3  CYS   5           HB3      CYS   5   0.037   3.086   4.945
   30    H    ILE   6           H        ILE   6  -3.964   1.490   4.760
   31    HA   ILE   6           HA       ILE   6  -3.901   3.205   7.146
   32    HB   ILE   6           HB       ILE   6  -6.361   2.035   5.894
   33   HG12  ILE   6          HG12      ILE   6  -5.259   3.452   4.233
   34   HG13  ILE   6          HG13      ILE   6  -6.720   4.230   4.833
   35   HG21  ILE   6          HG21      ILE   6  -7.137   4.302   7.117
   36   HG22  ILE   6          HG22      ILE   6  -5.781   3.838   8.144
   37   HG23  ILE   6          HG23      ILE   6  -7.123   2.721   7.900
   38   HD11  ILE   6          HD11      ILE   6  -5.103   5.917   4.713
   39   HD12  ILE   6          HD12      ILE   6  -3.866   4.900   5.453
   40   HD13  ILE   6          HD13      ILE   6  -5.212   5.499   6.423
   41    H    SER   7           H        SER   7  -5.587   0.232   6.175
   42    HA   SER   7           HA       SER   7  -5.093  -0.829   8.868
   43    HB2  SER   7           HB2      SER   7  -7.486  -0.546   7.738
   44    HB3  SER   7           HB3      SER   7  -7.070  -2.111   7.041
   45    HG   SER   7           HG       SER   7  -8.178  -2.260   9.069
   46    H    ASN   8           H        ASN   8  -2.894  -1.086   7.498
   47    HA   ASN   8           HA       ASN   8  -1.346  -2.523   6.656
   48    HB2  ASN   8           HB2      ASN   8  -1.947  -3.821   8.642
   49    HB3  ASN   8           HB3      ASN   8  -3.266  -4.581   7.764
   50   HD21  ASN   8          HD21      ASN   8  -1.793  -6.330   8.807
   51   HD22  ASN   8          HD22      ASN   8  -0.655  -7.027   7.720
   52    HA   PRO   9           HA       PRO   9  -3.647  -3.079   2.706
   53    HB2  PRO   9           HB2      PRO   9  -1.475  -2.453   1.158
   54    HB3  PRO   9           HB3      PRO   9  -2.616  -1.259   1.785
   55    HG2  PRO   9           HG2      PRO   9   0.074  -2.044   2.827
   56    HG3  PRO   9           HG3      PRO   9  -0.650  -0.431   2.697
   57    HD2  PRO   9           HD2      PRO   9  -0.547  -1.771   5.033
   58    HD3  PRO   9           HD3      PRO   9  -1.901  -0.700   4.622
   59    H    CYS  10           H        CYS  10  -0.359  -4.148   3.514
   60    HA   CYS  10           HA       CYS  10  -0.302  -6.244   1.593
   61    HB2  CYS  10           HB2      CYS  10   1.352  -6.219   4.107
   62    HB3  CYS  10           HB3      CYS  10   1.765  -6.868   2.525
   63    H    GLN  11           H        GLN  11  -0.443  -8.498   1.935
   64    HA   GLN  11           HA       GLN  11  -2.049  -9.250   4.286
   65    HB2  GLN  11           HB2      GLN  11  -2.282  -9.923   1.396
   66    HB3  GLN  11           HB3      GLN  11  -2.739 -11.148   2.565
   67    HG2  GLN  11           HG2      GLN  11  -3.838  -8.364   2.685
   68    HG3  GLN  11           HG3      GLN  11  -4.561  -9.609   1.666
   69   HE21  GLN  11          HE21      GLN  11  -6.199  -8.623   3.435
   70   HE22  GLN  11          HE22      GLN  11  -6.434  -9.677   4.783
   71    H    ASN  12           H        ASN  12   0.905  -9.327   3.942
   72    HA   ASN  12           HA       ASN  12   1.241 -12.118   4.701
   73    HB2  ASN  12           HB2      ASN  12   2.392 -10.875   2.269
   74    HB3  ASN  12           HB3      ASN  12   3.460 -11.913   3.202
   75   HD21  ASN  12          HD21      ASN  12   2.807 -12.568   0.680
   76   HD22  ASN  12          HD22      ASN  12   1.791 -13.956   0.684
   77    H    ASP  13           H        ASP  13   1.516  -9.200   5.767
   78    HA   ASP  13           HA       ASP  13   2.709  -8.253   7.461
   79    HB2  ASP  13           HB2      ASP  13   2.995 -10.750   8.125
   80    HB3  ASP  13           HB3      ASP  13   4.622 -10.572   7.476
   81    H    ALA  14           H        ALA  14   3.190  -7.366   5.009
   82    HA   ALA  14           HA       ALA  14   6.048  -7.370   4.485
   83    HB1  ALA  14           HB1      ALA  14   3.622  -6.740   2.997
   84    HB2  ALA  14           HB2      ALA  14   5.180  -7.325   2.424
   85    HB3  ALA  14           HB3      ALA  14   4.938  -5.602   2.711
   86    H    THR  15           H        THR  15   6.972  -5.129   3.856
   87    HA   THR  15           HA       THR  15   6.477  -3.353   6.130
   88    HB   THR  15           HB       THR  15   8.779  -3.513   4.175
   89   HG21  THR  15          HG21      THR  15   8.401  -1.660   6.511
   90   HG22  THR  15          HG22      THR  15   8.608  -1.217   4.817
   91   HG23  THR  15          HG23      THR  15   9.941  -1.956   5.706
   92    H    CYS  16           H        CYS  16   5.641  -1.364   5.921
   93    HA   CYS  16           HA       CYS  16   4.877  -0.496   3.229
   94    HB2  CYS  16           HB2      CYS  16   3.166  -0.741   5.097
   95    HB3  CYS  16           HB3      CYS  16   3.916   0.666   5.842
   96    H    LEU  17           H        LEU  17   5.706   1.273   2.296
   97    HA   LEU  17           HA       LEU  17   7.436   3.004   3.938
   98    HB2  LEU  17           HB2      LEU  17   8.163   1.432   1.762
   99    HB3  LEU  17           HB3      LEU  17   8.024   3.045   1.090
  100    HG   LEU  17           HG       LEU  17  10.311   2.600   1.775
  101   HD11  LEU  17          HD11      LEU  17  10.714   4.600   2.915
  102   HD12  LEU  17          HD12      LEU  17   9.184   4.515   3.789
  103   HD13  LEU  17          HD13      LEU  17   9.195   4.881   2.065
  104   HD21  LEU  17          HD21      LEU  17  10.379   1.082   3.467
  105   HD22  LEU  17          HD22      LEU  17   8.978   1.767   4.290
  106   HD23  LEU  17          HD23      LEU  17  10.549   2.557   4.418
  107    H    ASP  18           H        ASP  18   7.314   5.206   3.649
  108    HA   ASP  18           HA       ASP  18   4.963   6.137   2.168
  109    HB2  ASP  18           HB2      ASP  18   6.380   7.023   4.605
  110    HB3  ASP  18           HB3      ASP  18   5.777   8.314   3.569
  111    H    GLN  19           H        GLN  19   5.269   6.994   0.231
  112    HA   GLN  19           HA       GLN  19   7.889   8.142  -0.420
  113    HB2  GLN  19           HB2      GLN  19   5.660   7.088  -2.157
  114    HB3  GLN  19           HB3      GLN  19   7.043   7.961  -2.803
  115    HG2  GLN  19           HG2      GLN  19   8.321   6.099  -1.358
  116    HG3  GLN  19           HG3      GLN  19   6.850   5.213  -1.758
  117   HE21  GLN  19          HE21      GLN  19   6.236   5.930  -4.225
  118   HE22  GLN  19          HE22      GLN  19   7.505   5.556  -5.336
  119    H    ILE  20           H        ILE  20   4.689   8.791  -1.785
  120    HA   ILE  20           HA       ILE  20   4.868  11.574  -0.913
  121    HB   ILE  20           HB       ILE  20   4.268  10.867  -3.780
  122   HG12  ILE  20          HG12      ILE  20   6.583  12.249  -3.921
  123   HG13  ILE  20          HG13      ILE  20   6.830  11.411  -2.393
  124   HG21  ILE  20          HG21      ILE  20   4.603  13.452  -2.286
  125   HG22  ILE  20          HG22      ILE  20   3.213  12.896  -3.218
  126   HG23  ILE  20          HG23      ILE  20   4.703  13.353  -4.044
  127   HD11  ILE  20          HD11      ILE  20   5.900   9.436  -4.077
  128   HD12  ILE  20          HD12      ILE  20   7.575   9.712  -3.604
  129   HD13  ILE  20          HD13      ILE  20   6.955  10.409  -5.101
  130    H    GLY  21           H        GLY  21   2.846   9.640  -3.111
  131    HA2  GLY  21           HA2      GLY  21   0.557  10.122  -1.331
  132    HA3  GLY  21           HA3      GLY  21   0.432  10.585  -3.021
  133    H    GLU  22           H        GLU  22   2.198   7.745  -2.029
  134    HA   GLU  22           HA       GLU  22  -0.041   6.014  -2.765
  135    HB2  GLU  22           HB2      GLU  22   1.630   4.643  -4.148
  136    HB3  GLU  22           HB3      GLU  22   1.005   6.125  -4.859
  137    HG2  GLU  22           HG2      GLU  22   3.076   7.279  -4.089
  138    HG3  GLU  22           HG3      GLU  22   3.700   5.706  -3.593
  139    H    PHE  23           H        PHE  23   0.618   3.639  -2.421
  140    HA   PHE  23           HA       PHE  23   2.021   3.494   0.144
  141    HB2  PHE  23           HB2      PHE  23   0.812   1.421   0.528
  142    HB3  PHE  23           HB3      PHE  23  -0.314   2.707   0.107
  143    HD1  PHE  23           HD1      PHE  23   1.278  -0.384  -1.026
  144    HD2  PHE  23           HD2      PHE  23  -1.552   2.656  -1.940
  145    HE1  PHE  23           HE1      PHE  23   0.362  -1.788  -2.831
  146    HE2  PHE  23           HE2      PHE  23  -2.476   1.260  -3.746
  147    HZ   PHE  23           HZ       PHE  23  -1.518  -0.965  -4.194
  148    H    GLN  24           H        GLN  24   3.785   2.236   0.449
  149    HA   GLN  24           HA       GLN  24   4.769   0.736  -1.890
  150    HB2  GLN  24           HB2      GLN  24   6.075   2.676  -0.106
  151    HB3  GLN  24           HB3      GLN  24   7.012   1.216  -0.396
  152    HG2  GLN  24           HG2      GLN  24   5.808   2.692  -2.693
  153    HG3  GLN  24           HG3      GLN  24   7.296   3.275  -1.946
  154   HE21  GLN  24          HE21      GLN  24   9.178   2.277  -2.389
  155   HE22  GLN  24          HE22      GLN  24   9.338   0.906  -3.430
  156    H    CYS  25           H        CYS  25   3.951  -1.255  -1.312
  157    HA   CYS  25           HA       CYS  25   4.547  -2.336   1.323
  158    HB2  CYS  25           HB2      CYS  25   2.331  -2.749   0.367
  159    HB3  CYS  25           HB3      CYS  25   3.064  -3.538  -1.024
  160    H    ILE  26           H        ILE  26   6.368  -3.392   1.722
  161    HA   ILE  26           HA       ILE  26   8.007  -4.343  -0.486
  162    HB   ILE  26           HB       ILE  26   8.669  -4.460   2.453
  163   HG12  ILE  26          HG12      ILE  26   9.382  -2.269   0.492
  164   HG13  ILE  26          HG13      ILE  26   8.111  -2.138   1.703
  165   HG21  ILE  26          HG21      ILE  26  10.867  -4.848   1.818
  166   HG22  ILE  26          HG22      ILE  26  10.611  -4.227   0.187
  167   HG23  ILE  26          HG23      ILE  26   9.947  -5.794   0.648
  168   HD11  ILE  26          HD11      ILE  26  10.372  -2.937   3.114
  169   HD12  ILE  26          HD12      ILE  26   9.637  -1.334   3.085
  170   HD13  ILE  26          HD13      ILE  26  10.941  -1.725   1.965
  171    H    CYS  27           H        CYS  27   7.686  -6.328  -1.228
  172    HA   CYS  27           HA       CYS  27   6.332  -8.343   0.272
  173    HB2  CYS  27           HB2      CYS  27   7.863  -8.758  -2.290
  174    HB3  CYS  27           HB3      CYS  27   6.487  -9.670  -1.688
  175    H    MET  28           H        MET  28   7.336 -10.643   0.207
  176    HA   MET  28           HA       MET  28   9.620 -10.602   1.905
  177    HB2  MET  28           HB2      MET  28   7.645 -12.520   1.029
  178    HB3  MET  28           HB3      MET  28   9.253 -13.231   0.975
  179    HG2  MET  28           HG2      MET  28   9.426 -12.149   3.375
  180    HG3  MET  28           HG3      MET  28   7.670 -12.276   3.297
  181    HE1  MET  28           HE1      MET  28  11.071 -14.696   3.338
  182    HE2  MET  28           HE2      MET  28  10.364 -15.249   4.856
  183    HE3  MET  28           HE3      MET  28  10.563 -13.523   4.554
  184    HA   PRO  29           HA       PRO  29  12.948 -11.233  -0.920
  185    HB2  PRO  29           HB2      PRO  29  14.384 -13.280   0.061
  186    HB3  PRO  29           HB3      PRO  29  14.296 -11.716   0.876
  187    HG2  PRO  29           HG2      PRO  29  12.804 -14.244   1.466
  188    HG3  PRO  29           HG3      PRO  29  13.571 -13.109   2.592
  189    HD2  PRO  29           HD2      PRO  29  10.901 -13.120   2.085
  190    HD3  PRO  29           HD3      PRO  29  11.793 -11.652   2.530
  191    H    GLY  30           H        GLY  30  11.014 -12.063  -2.361
  192    HA2  GLY  30           HA2      GLY  30  11.513 -13.529  -4.367
  193    HA3  GLY  30           HA3      GLY  30  11.602 -14.834  -3.195
  194    H    TYR  31           H        TYR  31   9.284 -12.156  -3.319
  195    HA   TYR  31           HA       TYR  31   7.145 -14.154  -3.631
  196    HB2  TYR  31           HB2      TYR  31   7.405 -11.730  -1.938
  197    HB3  TYR  31           HB3      TYR  31   5.819 -12.051  -2.623
  198    HD1  TYR  31           HD1      TYR  31   8.499 -14.194  -1.132
  199    HD2  TYR  31           HD2      TYR  31   4.409 -13.020  -1.079
  200    HE1  TYR  31           HE1      TYR  31   8.063 -15.818   0.662
  201    HE2  TYR  31           HE2      TYR  31   3.962 -14.639   0.715
  202    HH   TYR  31           HH       TYR  31   5.494 -15.766   2.604
  203    H    GLU  32           H        GLU  32   5.024 -12.758  -4.318
  204    HA   GLU  32           HA       GLU  32   5.653 -10.894  -6.454
  205    HB2  GLU  32           HB2      GLU  32   4.301 -12.237  -8.101
  206    HB3  GLU  32           HB3      GLU  32   5.866 -12.921  -7.684
  207    HG2  GLU  32           HG2      GLU  32   4.298 -14.135  -5.855
  208    HG3  GLU  32           HG3      GLU  32   3.158 -13.943  -7.185
  209    H    GLY  33           H        GLY  33   3.379 -10.514  -7.697
  210    HA2  GLY  33           HA2      GLY  33   1.032 -10.197  -7.443
  211    HA3  GLY  33           HA3      GLY  33   1.219 -10.423  -5.711
  212    H    VAL  34           H        VAL  34  -0.264  -8.421  -6.037
  213    HA   VAL  34           HA       VAL  34   1.225  -5.965  -6.497
  214    HB   VAL  34           HB       VAL  34  -1.667  -6.270  -5.684
  215   HG11  VAL  34          HG11      VAL  34  -1.905  -4.004  -6.561
  216   HG12  VAL  34          HG12      VAL  34  -0.180  -3.961  -6.932
  217   HG13  VAL  34          HG13      VAL  34  -0.720  -4.059  -5.256
  218   HG21  VAL  34          HG21      VAL  34  -0.634  -7.214  -8.008
  219   HG22  VAL  34          HG22      VAL  34  -1.037  -5.558  -8.462
  220   HG23  VAL  34          HG23      VAL  34  -2.285  -6.624  -7.817
  221    H    TYR  35           H        TYR  35  -0.769  -7.351  -3.885
  222    HA   TYR  35           HA       TYR  35   0.475  -5.503  -1.990
  223    HB2  TYR  35           HB2      TYR  35  -2.010  -7.174  -1.968
  224    HB3  TYR  35           HB3      TYR  35  -1.288  -6.699  -0.435
  225    HD1  TYR  35           HD1      TYR  35  -0.430  -4.007  -0.752
  226    HD2  TYR  35           HD2      TYR  35  -3.866  -5.884  -2.417
  227    HE1  TYR  35           HE1      TYR  35  -1.543  -1.819  -0.908
  228    HE2  TYR  35           HE2      TYR  35  -4.987  -3.702  -2.577
  229    HH   TYR  35           HH       TYR  35  -3.434  -0.817  -2.388
  230    H    CYS  36           H        CYS  36   1.851  -7.863  -3.177
  231    HA   CYS  36           HA       CYS  36   3.183  -9.606  -2.557
  232    HB2  CYS  36           HB2      CYS  36   3.203  -8.346   0.183
  233    HB3  CYS  36           HB3      CYS  36   4.482  -9.272  -0.597
  234    H    GLU  37           H        GLU  37   0.339  -9.971  -2.278
  235    HA   GLU  37           HA       GLU  37   0.104 -11.687   0.081
  236    HB2  GLU  37           HB2      GLU  37  -2.270 -11.629  -0.283
  237    HB3  GLU  37           HB3      GLU  37  -1.658  -9.988  -0.404
  238    HG2  GLU  37           HG2      GLU  37  -2.194  -9.795  -2.582
  239    HG3  GLU  37           HG3      GLU  37  -1.838 -11.485  -2.935
  240    H    ILE  38           H        ILE  38   1.716 -12.436  -2.246
  241    HA   ILE  38           HA       ILE  38   0.211 -14.814  -3.128
  242    HB   ILE  38           HB       ILE  38   2.548 -13.591  -4.588
  243   HG12  ILE  38          HG12      ILE  38   0.720 -11.967  -4.540
  244   HG13  ILE  38          HG13      ILE  38   0.898 -12.644  -6.155
  245   HG21  ILE  38          HG21      ILE  38   1.442 -14.920  -6.482
  246   HG22  ILE  38          HG22      ILE  38   0.563 -15.753  -5.199
  247   HG23  ILE  38          HG23      ILE  38   2.325 -15.819  -5.248
  248   HD11  ILE  38          HD11      ILE  38  -1.036 -13.961  -5.922
  249   HD12  ILE  38          HD12      ILE  38  -1.455 -12.363  -5.301
  250   HD13  ILE  38          HD13      ILE  38  -1.108 -13.681  -4.182
  251    H1   FUC  39           H1       FUC  39  10.868  -3.719   5.642
  252    H2   FUC  39           H2       FUC  39  11.869  -5.613   6.838
  253    H3   FUC  39           H3       FUC  39   8.998  -6.337   7.575
  254    H4   FUC  39           H4       FUC  39   9.322  -8.320   6.230
  255    H5   FUC  39           H5       FUC  39   8.442  -6.319   5.087
  256    H61  FUC  39           H61      FUC  39   8.818  -8.294   3.640
  257    H62  FUC  39           H62      FUC  39  10.506  -7.769   3.351
  258    H63  FUC  39           H63      FUC  39   9.152  -6.776   2.749
  259    HO2  FUC  39           HO2      FUC  39  11.268  -3.694   8.007
  260    HO4  FUC  39           HO4      FUC  39  11.270  -8.534   5.002
  261    H1   NAG  40           H1       NAG  40   9.036  -8.517   8.816
  262    H2   NAG  40           H2       NAG  40  11.332  -7.973  10.788
  263    H3   NAG  40           H3       NAG  40   8.965  -9.910  11.042
  264    H4   NAG  40           H4       NAG  40   9.505  -7.307  12.578
  265    H5   NAG  40           H5       NAG  40   7.374  -7.910  10.438
  266    H61  NAG  40           H61      NAG  40   8.032  -5.414  12.031
  267    H62  NAG  40           H62      NAG  40   6.509  -6.330  12.006
  268    H81  NAG  40           H81      NAG  40  12.307 -11.834   8.832
  269    H82  NAG  40           H82      NAG  40  12.949 -12.357  10.417
  270    H83  NAG  40           H83      NAG  40  13.936 -11.311   9.352
  271    HN2  NAG  40           HN2      NAG  40  10.971 -10.076   8.875
  272    HO3  NAG  40           HO3      NAG  40  10.690 -10.598  12.226
  273    HO4  NAG  40           HO4      NAG  40   7.398  -9.211  12.581
  274    HO6  NAG  40           HO6      NAG  40   6.657  -4.345  10.627
  Start of MODEL   15
    1    H1   ASP   1           H1       ASP   1 -10.951  11.896  -0.927
    2    HA   ASP   1           HA       ASP   1 -10.931  10.819   1.412
    3    HB2  ASP   1           HB2      ASP   1 -11.800   8.475   1.332
    4    HB3  ASP   1           HB3      ASP   1 -13.054   9.702   1.181
    5    H    VAL   2           H        VAL   2  -9.187   9.467   1.861
    6    HA   VAL   2           HA       VAL   2  -7.553   8.780  -0.488
    7    HB   VAL   2           HB       VAL   2  -6.590   9.128   2.351
    8   HG11  VAL   2          HG11      VAL   2  -5.118   7.770   1.010
    9   HG12  VAL   2          HG12      VAL   2  -4.384   9.356   1.249
   10   HG13  VAL   2          HG13      VAL   2  -5.147   8.961  -0.291
   11   HG21  VAL   2          HG21      VAL   2  -6.714  11.111   0.088
   12   HG22  VAL   2          HG22      VAL   2  -5.689  11.317   1.508
   13   HG23  VAL   2          HG23      VAL   2  -7.442  11.249   1.688
   14    H    ASN   3           H        ASN   3  -6.309   6.826  -0.445
   15    HA   ASN   3           HA       ASN   3  -6.824   4.827   1.553
   16    HB2  ASN   3           HB2      ASN   3  -8.347   4.865  -0.981
   17    HB3  ASN   3           HB3      ASN   3  -7.639   3.312  -0.548
   18   HD21  ASN   3          HD21      ASN   3 -10.404   3.909  -0.690
   19   HD22  ASN   3          HD22      ASN   3 -11.064   3.703   0.892
   20    H    GLU   4           H        GLU   4  -4.636   4.575   1.757
   21    HA   GLU   4           HA       GLU   4  -3.295   3.273  -0.501
   22    HB2  GLU   4           HB2      GLU   4  -1.206   4.599   0.625
   23    HB3  GLU   4           HB3      GLU   4  -2.089   5.158  -0.788
   24    HG2  GLU   4           HG2      GLU   4  -3.320   6.708   0.451
   25    HG3  GLU   4           HG3      GLU   4  -2.914   5.939   1.984
   26    H    CYS   5           H        CYS   5  -2.061   4.273   2.661
   27    HA   CYS   5           HA       CYS   5  -1.860   1.433   3.407
   28    HB2  CYS   5           HB2      CYS   5   0.298   2.995   2.769
   29    HB3  CYS   5           HB3      CYS   5   0.220   3.183   4.517
   30    H    ILE   6           H        ILE   6  -3.767   1.660   4.642
   31    HA   ILE   6           HA       ILE   6  -3.698   3.519   6.888
   32    HB   ILE   6           HB       ILE   6  -5.913   1.631   6.156
   33   HG12  ILE   6          HG12      ILE   6  -5.420   3.149   4.278
   34   HG13  ILE   6          HG13      ILE   6  -6.980   3.508   5.012
   35   HG21  ILE   6          HG21      ILE   6  -5.571   2.968   8.462
   36   HG22  ILE   6          HG22      ILE   6  -7.152   2.590   7.777
   37   HG23  ILE   6          HG23      ILE   6  -6.440   4.183   7.525
   38   HD11  ILE   6          HD11      ILE   6  -4.757   5.227   4.600
   39   HD12  ILE   6          HD12      ILE   6  -5.060   5.092   6.332
   40   HD13  ILE   6          HD13      ILE   6  -6.352   5.609   5.249
   41    H    SER   7           H        SER   7  -4.766   0.143   6.601
   42    HA   SER   7           HA       SER   7  -3.407  -0.409   9.147
   43    HB2  SER   7           HB2      SER   7  -5.984  -0.504   9.023
   44    HB3  SER   7           HB3      SER   7  -5.746  -1.990   8.105
   45    HG   SER   7           HG       SER   7  -5.991  -2.191  10.466
   46    H    ASN   8           H        ASN   8  -1.746  -0.632   7.143
   47    HA   ASN   8           HA       ASN   8  -0.359  -2.008   5.976
   48    HB2  ASN   8           HB2      ASN   8  -0.065  -3.020   8.188
   49    HB3  ASN   8           HB3      ASN   8  -1.454  -4.061   7.910
   50   HD21  ASN   8          HD21      ASN   8   0.550  -5.429   8.577
   51   HD22  ASN   8          HD22      ASN   8   1.370  -6.159   7.251
   52    HA   PRO   9           HA       PRO   9  -3.673  -3.474   3.155
   53    HB2  PRO   9           HB2      PRO   9  -2.271  -2.901   0.884
   54    HB3  PRO   9           HB3      PRO   9  -3.271  -1.721   1.737
   55    HG2  PRO   9           HG2      PRO   9  -0.308  -2.123   1.840
   56    HG3  PRO   9           HG3      PRO   9  -1.232  -0.610   1.770
   57    HD2  PRO   9           HD2      PRO   9  -0.179  -1.547   4.070
   58    HD3  PRO   9           HD3      PRO   9  -1.711  -0.650   4.028
   59    H    CYS  10           H        CYS  10  -0.242  -4.196   3.281
   60    HA   CYS  10           HA       CYS  10  -0.096  -6.299   1.471
   61    HB2  CYS  10           HB2      CYS  10   1.396  -6.241   4.095
   62    HB3  CYS  10           HB3      CYS  10   1.904  -6.976   2.580
   63    H    GLN  11           H        GLN  11  -0.647  -8.405   1.489
   64    HA   GLN  11           HA       GLN  11  -2.238  -9.334   3.773
   65    HB2  GLN  11           HB2      GLN  11  -2.350  -9.730   0.861
   66    HB3  GLN  11           HB3      GLN  11  -2.624 -11.192   1.799
   67    HG2  GLN  11           HG2      GLN  11  -4.160  -8.612   1.971
   68    HG3  GLN  11           HG3      GLN  11  -4.726 -10.150   1.320
   69   HE21  GLN  11          HE21      GLN  11  -4.708 -11.986   2.879
   70   HE22  GLN  11          HE22      GLN  11  -5.182 -11.654   4.507
   71    H    ASN  12           H        ASN  12   0.668  -9.369   3.828
   72    HA   ASN  12           HA       ASN  12   0.999 -12.207   4.391
   73    HB2  ASN  12           HB2      ASN  12   2.452 -10.715   2.281
   74    HB3  ASN  12           HB3      ASN  12   3.406 -11.811   3.271
   75   HD21  ASN  12          HD21      ASN  12   3.185 -12.257   0.641
   76   HD22  ASN  12          HD22      ASN  12   2.221 -13.654   0.360
   77    H    ASP  13           H        ASP  13   1.010  -9.365   5.706
   78    HA   ASP  13           HA       ASP  13   1.925  -8.484   7.595
   79    HB2  ASP  13           HB2      ASP  13   2.186 -11.147   8.005
   80    HB3  ASP  13           HB3      ASP  13   3.881 -10.671   8.008
   81    H    ALA  14           H        ALA  14   2.881  -7.696   5.169
   82    HA   ALA  14           HA       ALA  14   5.783  -7.667   5.271
   83    HB1  ALA  14           HB1      ALA  14   5.005  -7.946   3.100
   84    HB2  ALA  14           HB2      ALA  14   5.419  -6.233   3.165
   85    HB3  ALA  14           HB3      ALA  14   3.736  -6.740   3.297
   86    H    THR  15           H        THR  15   6.694  -5.372   4.569
   87    HA   THR  15           HA       THR  15   5.831  -3.528   6.676
   88    HB   THR  15           HB       THR  15   8.381  -3.631   5.050
   89   HG21  THR  15          HG21      THR  15   8.832  -2.123   7.331
   90   HG22  THR  15          HG22      THR  15   7.312  -1.509   6.680
   91   HG23  THR  15          HG23      THR  15   8.756  -1.541   5.668
   92    H    CYS  16           H        CYS  16   5.357  -1.371   6.270
   93    HA   CYS  16           HA       CYS  16   4.739  -0.756   3.461
   94    HB2  CYS  16           HB2      CYS  16   2.793  -0.754   4.943
   95    HB3  CYS  16           HB3      CYS  16   3.582   0.407   6.005
   96    H    LEU  17           H        LEU  17   5.548   1.038   2.487
   97    HA   LEU  17           HA       LEU  17   7.149   2.886   4.118
   98    HB2  LEU  17           HB2      LEU  17   8.341   1.000   2.619
   99    HB3  LEU  17           HB3      LEU  17   8.153   2.252   1.405
  100    HG   LEU  17           HG       LEU  17  10.336   2.450   2.381
  101   HD11  LEU  17          HD11      LEU  17  10.331   4.703   2.689
  102   HD12  LEU  17          HD12      LEU  17   8.943   4.666   3.777
  103   HD13  LEU  17          HD13      LEU  17   8.705   4.507   2.036
  104   HD21  LEU  17          HD21      LEU  17   9.293   1.410   4.631
  105   HD22  LEU  17          HD22      LEU  17   9.373   3.112   5.088
  106   HD23  LEU  17          HD23      LEU  17  10.833   2.266   4.574
  107    H    ASP  18           H        ASP  18   6.414   4.880   3.866
  108    HA   ASP  18           HA       ASP  18   4.604   5.608   1.806
  109    HB2  ASP  18           HB2      ASP  18   4.944   7.933   2.768
  110    HB3  ASP  18           HB3      ASP  18   4.361   6.714   3.893
  111    H    GLN  19           H        GLN  19   5.036   6.236  -0.199
  112    HA   GLN  19           HA       GLN  19   7.781   6.945  -0.902
  113    HB2  GLN  19           HB2      GLN  19   5.719   5.474  -2.187
  114    HB3  GLN  19           HB3      GLN  19   6.059   6.882  -3.183
  115    HG2  GLN  19           HG2      GLN  19   8.328   5.249  -2.161
  116    HG3  GLN  19           HG3      GLN  19   7.371   4.648  -3.515
  117   HE21  GLN  19          HE21      GLN  19  10.177   5.870  -3.061
  118   HE22  GLN  19          HE22      GLN  19  10.325   6.989  -4.370
  119    H    ILE  20           H        ILE  20   4.714   8.049  -2.290
  120    HA   ILE  20           HA       ILE  20   5.372  10.809  -1.621
  121    HB   ILE  20           HB       ILE  20   4.728  10.054  -4.465
  122   HG12  ILE  20          HG12      ILE  20   7.431  10.779  -3.312
  123   HG13  ILE  20          HG13      ILE  20   6.941   9.151  -3.769
  124   HG21  ILE  20          HG21      ILE  20   4.787  12.255  -4.954
  125   HG22  ILE  20          HG22      ILE  20   6.069  12.588  -3.790
  126   HG23  ILE  20          HG23      ILE  20   4.401  12.430  -3.242
  127   HD11  ILE  20          HD11      ILE  20   8.205  11.018  -5.369
  128   HD12  ILE  20          HD12      ILE  20   6.532  11.026  -5.926
  129   HD13  ILE  20          HD13      ILE  20   7.443   9.516  -5.895
  130    H    GLY  21           H        GLY  21   3.098   8.652  -3.275
  131    HA2  GLY  21           HA2      GLY  21   0.902  10.033  -1.912
  132    HA3  GLY  21           HA3      GLY  21   0.848   9.936  -3.665
  133    H    GLU  22           H        GLU  22   1.924   7.297  -3.908
  134    HA   GLU  22           HA       GLU  22  -0.470   5.807  -3.197
  135    HB2  GLU  22           HB2      GLU  22   1.905   4.840  -4.790
  136    HB3  GLU  22           HB3      GLU  22   0.296   4.137  -4.740
  137    HG2  GLU  22           HG2      GLU  22  -0.555   5.632  -6.199
  138    HG3  GLU  22           HG3      GLU  22   0.464   6.947  -5.617
  139    H    PHE  23           H        PHE  23   0.100   3.342  -2.736
  140    HA   PHE  23           HA       PHE  23   1.746   3.384  -0.320
  141    HB2  PHE  23           HB2      PHE  23   0.548   1.291   0.264
  142    HB3  PHE  23           HB3      PHE  23  -0.531   2.664   0.038
  143    HD1  PHE  23           HD1      PHE  23  -1.983   2.797  -1.903
  144    HD2  PHE  23           HD2      PHE  23   0.526  -0.572  -1.237
  145    HE1  PHE  23           HE1      PHE  23  -3.285   1.508  -3.550
  146    HE2  PHE  23           HE2      PHE  23  -0.769  -1.870  -2.882
  147    HZ   PHE  23           HZ       PHE  23  -2.677  -0.827  -4.041
  148    H    GLN  24           H        GLN  24   3.186   1.645   0.153
  149    HA   GLN  24           HA       GLN  24   4.034   0.065  -2.176
  150    HB2  GLN  24           HB2      GLN  24   5.454   2.202  -1.514
  151    HB3  GLN  24           HB3      GLN  24   6.110   1.109  -0.301
  152    HG2  GLN  24           HG2      GLN  24   6.415  -0.481  -2.366
  153    HG3  GLN  24           HG3      GLN  24   6.368   1.037  -3.260
  154   HE21  GLN  24          HE21      GLN  24   8.253  -1.070  -1.416
  155   HE22  GLN  24          HE22      GLN  24   9.664  -0.084  -1.276
  156    H    CYS  25           H        CYS  25   3.738  -1.992  -1.649
  157    HA   CYS  25           HA       CYS  25   3.904  -2.837   1.131
  158    HB2  CYS  25           HB2      CYS  25   2.638  -3.839  -1.316
  159    HB3  CYS  25           HB3      CYS  25   3.374  -5.105  -0.341
  160    H    ILE  26           H        ILE  26   5.862  -3.292   1.894
  161    HA   ILE  26           HA       ILE  26   7.854  -4.509   0.120
  162    HB   ILE  26           HB       ILE  26   8.278  -3.441   2.911
  163   HG12  ILE  26          HG12      ILE  26   8.721  -2.084   0.242
  164   HG13  ILE  26          HG13      ILE  26   7.504  -1.645   1.435
  165   HG21  ILE  26          HG21      ILE  26  10.029  -4.915   2.388
  166   HG22  ILE  26          HG22      ILE  26  10.666  -3.307   2.036
  167   HG23  ILE  26          HG23      ILE  26  10.120  -4.348   0.720
  168   HD11  ILE  26          HD11      ILE  26  10.435  -1.600   2.060
  169   HD12  ILE  26          HD12      ILE  26   9.112  -0.820   2.926
  170   HD13  ILE  26          HD13      ILE  26   9.599  -0.226   1.338
  171    H    CYS  27           H        CYS  27   7.139  -6.638   0.085
  172    HA   CYS  27           HA       CYS  27   6.938  -8.055   2.638
  173    HB2  CYS  27           HB2      CYS  27   6.154  -9.966   1.162
  174    HB3  CYS  27           HB3      CYS  27   5.111  -8.551   1.206
  175    H    MET  28           H        MET  28   7.715 -10.528   2.189
  176    HA   MET  28           HA       MET  28  10.457 -10.539   2.458
  177    HB2  MET  28           HB2      MET  28   8.370 -12.482   2.288
  178    HB3  MET  28           HB3      MET  28   9.713 -13.027   1.292
  179    HG2  MET  28           HG2      MET  28  11.049 -12.272   3.496
  180    HG3  MET  28           HG3      MET  28   9.509 -12.738   4.215
  181    HE1  MET  28           HE1      MET  28  12.909 -14.736   2.560
  182    HE2  MET  28           HE2      MET  28  12.727 -15.154   4.263
  183    HE3  MET  28           HE3      MET  28  12.669 -13.465   3.758
  184    HA   PRO  29           HA       PRO  29  12.152 -10.434  -1.621
  185    HB2  PRO  29           HB2      PRO  29  14.300 -11.998  -1.470
  186    HB3  PRO  29           HB3      PRO  29  14.174 -10.527  -0.498
  187    HG2  PRO  29           HG2      PRO  29  13.730 -13.374   0.307
  188    HG3  PRO  29           HG3      PRO  29  14.552 -12.075   1.191
  189    HD2  PRO  29           HD2      PRO  29  11.947 -12.872   1.639
  190    HD3  PRO  29           HD3      PRO  29  12.595 -11.275   2.056
  191    H    GLY  30           H        GLY  30  11.848 -11.327  -3.590
  192    HA2  GLY  30           HA2      GLY  30  11.552 -12.952  -5.214
  193    HA3  GLY  30           HA3      GLY  30  11.856 -14.179  -3.993
  194    H    TYR  31           H        TYR  31   9.435 -11.767  -3.407
  195    HA   TYR  31           HA       TYR  31   7.395 -13.842  -3.432
  196    HB2  TYR  31           HB2      TYR  31   7.674 -11.149  -2.206
  197    HB3  TYR  31           HB3      TYR  31   6.043 -11.678  -2.600
  198    HD1  TYR  31           HD1      TYR  31   8.786 -13.913  -1.510
  199    HD2  TYR  31           HD2      TYR  31   5.205 -11.905  -0.390
  200    HE1  TYR  31           HE1      TYR  31   8.707 -15.223   0.569
  201    HE2  TYR  31           HE2      TYR  31   5.118 -13.210   1.692
  202    HH   TYR  31           HH       TYR  31   6.606 -14.456   3.148
  203    H    GLU  32           H        GLU  32   5.103 -12.688  -4.052
  204    HA   GLU  32           HA       GLU  32   5.344 -11.197  -6.533
  205    HB2  GLU  32           HB2      GLU  32   4.224 -13.995  -6.400
  206    HB3  GLU  32           HB3      GLU  32   3.863 -12.884  -7.715
  207    HG2  GLU  32           HG2      GLU  32   6.144 -12.815  -8.387
  208    HG3  GLU  32           HG3      GLU  32   6.654 -13.691  -6.945
  209    H    GLY  33           H        GLY  33   2.930 -11.128  -7.521
  210    HA2  GLY  33           HA2      GLY  33   0.610 -10.886  -7.026
  211    HA3  GLY  33           HA3      GLY  33   1.017 -10.779  -5.320
  212    H    VAL  34           H        VAL  34  -0.685  -8.950  -6.078
  213    HA   VAL  34           HA       VAL  34   0.701  -6.551  -6.967
  214    HB   VAL  34           HB       VAL  34  -2.190  -6.825  -6.136
  215   HG11  VAL  34          HG11      VAL  34  -0.554  -4.679  -7.401
  216   HG12  VAL  34          HG12      VAL  34  -1.809  -4.563  -6.167
  217   HG13  VAL  34          HG13      VAL  34  -2.253  -4.837  -7.852
  218   HG21  VAL  34          HG21      VAL  34  -2.284  -8.202  -7.928
  219   HG22  VAL  34          HG22      VAL  34  -0.794  -7.572  -8.629
  220   HG23  VAL  34          HG23      VAL  34  -2.302  -6.678  -8.816
  221    H    TYR  35           H        TYR  35  -1.124  -7.663  -4.124
  222    HA   TYR  35           HA       TYR  35  -0.089  -5.378  -2.606
  223    HB2  TYR  35           HB2      TYR  35  -2.472  -7.132  -2.371
  224    HB3  TYR  35           HB3      TYR  35  -1.758  -6.572  -0.863
  225    HD1  TYR  35           HD1      TYR  35  -2.124  -4.842  -4.147
  226    HD2  TYR  35           HD2      TYR  35  -3.196  -4.944  -0.031
  227    HE1  TYR  35           HE1      TYR  35  -3.289  -2.692  -4.403
  228    HE2  TYR  35           HE2      TYR  35  -4.364  -2.795  -0.275
  229    HH   TYR  35           HH       TYR  35  -5.366  -1.428  -1.989
  230    H    CYS  36           H        CYS  36   1.538  -7.698  -3.371
  231    HA   CYS  36           HA       CYS  36   3.112  -9.072  -2.485
  232    HB2  CYS  36           HB2      CYS  36   2.696  -6.976  -0.457
  233    HB3  CYS  36           HB3      CYS  36   3.445  -8.448   0.150
  234    H    GLU  37           H        GLU  37   0.798 -10.333  -2.704
  235    HA   GLU  37           HA       GLU  37   0.429 -11.760  -0.154
  236    HB2  GLU  37           HB2      GLU  37  -1.628 -10.714  -0.805
  237    HB3  GLU  37           HB3      GLU  37  -1.482 -11.314  -2.450
  238    HG2  GLU  37           HG2      GLU  37  -3.156 -12.553  -1.205
  239    HG3  GLU  37           HG3      GLU  37  -1.808 -13.593  -1.663
  240    H    ILE  38           H        ILE  38   0.998 -12.076  -3.598
  241    HA   ILE  38           HA       ILE  38   1.042 -14.982  -3.446
  242    HB   ILE  38           HB       ILE  38   1.729 -13.253  -5.821
  243   HG12  ILE  38          HG12      ILE  38  -0.544 -12.746  -5.011
  244   HG13  ILE  38          HG13      ILE  38  -0.578 -13.574  -6.564
  245   HG21  ILE  38          HG21      ILE  38   2.485 -15.343  -6.376
  246   HG22  ILE  38          HG22      ILE  38   0.812 -15.453  -6.925
  247   HG23  ILE  38          HG23      ILE  38   1.281 -16.163  -5.380
  248   HD11  ILE  38          HD11      ILE  38  -0.735 -15.650  -4.797
  249   HD12  ILE  38          HD12      ILE  38  -2.100 -14.888  -5.612
  250   HD13  ILE  38          HD13      ILE  38  -1.653 -14.383  -3.983
  251    H1   FUC  39           H1       FUC  39  10.232  -3.633   6.824
  252    H2   FUC  39           H2       FUC  39  11.214  -5.355   8.262
  253    H3   FUC  39           H3       FUC  39   8.358  -6.386   8.560
  254    H4   FUC  39           H4       FUC  39   9.123  -8.362   7.376
  255    H5   FUC  39           H5       FUC  39   8.226  -6.516   6.016
  256    H61  FUC  39           H61      FUC  39   9.064  -8.487   4.762
  257    H62  FUC  39           H62      FUC  39  10.702  -7.767   4.717
  258    H63  FUC  39           H63      FUC  39   9.354  -6.977   3.847
  259    HO2  FUC  39           HO2      FUC  39  10.219  -3.482   9.216
  260    HO4  FUC  39           HO4      FUC  39  11.353  -8.211   8.031
  261    H1   NAG  40           H1       NAG  40   8.555  -8.651   9.807
  262    H2   NAG  40           H2       NAG  40  10.179  -7.615  12.200
  263    H3   NAG  40           H3       NAG  40   8.283 -10.024  12.027
  264    H4   NAG  40           H4       NAG  40   7.901  -7.362  13.509
  265    H5   NAG  40           H5       NAG  40   6.488  -8.412  10.981
  266    H61  NAG  40           H61      NAG  40   5.472  -6.210  10.844
  267    H62  NAG  40           H62      NAG  40   6.314  -5.691  12.321
  268    H81  NAG  40           H81      NAG  40  13.520 -10.721  12.153
  269    H82  NAG  40           H82      NAG  40  13.648  -9.852  10.596
  270    H83  NAG  40           H83      NAG  40  12.444 -11.160  10.794
  271    HN2  NAG  40           HN2      NAG  40  10.454 -10.190  10.754
  272    HO3  NAG  40           HO3      NAG  40   9.692  -8.799  14.177
  273    HO4  NAG  40           HO4      NAG  40   5.733  -8.252  13.687
  274    HO6  NAG  40           HO6      NAG  40   4.043  -7.249  12.041
  Start of MODEL   16
    1    H1   ASP   1           H1       ASP   1  -7.656  13.555  -0.435
    2    HA   ASP   1           HA       ASP   1  -6.892  12.436   2.006
    3    HB2  ASP   1           HB2      ASP   1  -9.198  12.929   2.746
    4    HB3  ASP   1           HB3      ASP   1  -8.484  14.278   1.869
    5    H    VAL   2           H        VAL   2  -6.767  10.449  -0.059
    6    HA   VAL   2           HA       VAL   2  -8.910   8.575   0.609
    7    HB   VAL   2           HB       VAL   2  -7.784   7.119  -1.125
    8   HG11  VAL   2          HG11      VAL   2  -8.432   9.621  -2.537
    9   HG12  VAL   2          HG12      VAL   2  -9.645   9.049  -1.392
   10   HG13  VAL   2          HG13      VAL   2  -9.117   8.006  -2.713
   11   HG21  VAL   2          HG21      VAL   2  -5.662   8.770  -0.830
   12   HG22  VAL   2          HG22      VAL   2  -6.415   9.461  -2.267
   13   HG23  VAL   2          HG23      VAL   2  -5.941   7.763  -2.251
   14    H    ASN   3           H        ASN   3  -8.537   6.540   1.499
   15    HA   ASN   3           HA       ASN   3  -6.340   6.410   3.339
   16    HB2  ASN   3           HB2      ASN   3  -8.796   4.828   2.805
   17    HB3  ASN   3           HB3      ASN   3  -7.463   3.980   3.583
   18   HD21  ASN   3          HD21      ASN   3  -9.939   4.441   4.785
   19   HD22  ASN   3          HD22      ASN   3  -9.706   5.497   6.131
   20    H    GLU   4           H        GLU   4  -4.486   5.287   3.184
   21    HA   GLU   4           HA       GLU   4  -4.166   3.464   0.894
   22    HB2  GLU   4           HB2      GLU   4  -2.309   5.620   1.871
   23    HB3  GLU   4           HB3      GLU   4  -1.727   4.271   0.905
   24    HG2  GLU   4           HG2      GLU   4  -2.406   5.238  -0.963
   25    HG3  GLU   4           HG3      GLU   4  -4.040   5.432  -0.329
   26    H    CYS   5           H        CYS   5  -1.924   4.390   3.472
   27    HA   CYS   5           HA       CYS   5  -1.673   1.559   4.176
   28    HB2  CYS   5           HB2      CYS   5   0.353   2.949   3.552
   29    HB3  CYS   5           HB3      CYS   5   0.115   3.799   5.072
   30    H    ILE   6           H        ILE   6  -3.623   1.478   5.406
   31    HA   ILE   6           HA       ILE   6  -3.600   3.008   7.905
   32    HB   ILE   6           HB       ILE   6  -5.802   1.474   6.554
   33   HG12  ILE   6          HG12      ILE   6  -6.887   3.714   6.493
   34   HG13  ILE   6          HG13      ILE   6  -5.417   4.408   7.169
   35   HG21  ILE   6          HG21      ILE   6  -6.172   1.091   8.852
   36   HG22  ILE   6          HG22      ILE   6  -7.234   2.429   8.415
   37   HG23  ILE   6          HG23      ILE   6  -5.726   2.744   9.275
   38   HD11  ILE   6          HD11      ILE   6  -5.777   4.568   4.651
   39   HD12  ILE   6          HD12      ILE   6  -5.374   2.851   4.614
   40   HD13  ILE   6          HD13      ILE   6  -4.202   4.019   5.223
   41    H    SER   7           H        SER   7  -4.877  -0.204   7.131
   42    HA   SER   7           HA       SER   7  -3.526  -1.233   9.526
   43    HB2  SER   7           HB2      SER   7  -6.113  -1.305   9.246
   44    HB3  SER   7           HB3      SER   7  -5.791  -2.649   8.150
   45    HG   SER   7           HG       SER   7  -4.749  -2.539  10.779
   46    H    ASN   8           H        ASN   8  -1.774  -1.105   7.609
   47    HA   ASN   8           HA       ASN   8  -0.296  -2.271   6.335
   48    HB2  ASN   8           HB2      ASN   8  -0.235  -3.762   8.272
   49    HB3  ASN   8           HB3      ASN   8  -1.629  -4.640   7.660
   50   HD21  ASN   8          HD21      ASN   8   0.267  -6.221   8.166
   51   HD22  ASN   8          HD22      ASN   8   1.171  -6.690   6.778
   52    HA   PRO   9           HA       PRO   9  -3.374  -2.677   2.930
   53    HB2  PRO   9           HB2      PRO   9  -0.851  -2.156   1.463
   54    HB3  PRO   9           HB3      PRO   9  -2.442  -1.431   1.248
   55    HG2  PRO   9           HG2      PRO   9  -0.469  -0.087   2.430
   56    HG3  PRO   9           HG3      PRO   9  -2.143   0.051   2.988
   57    HD2  PRO   9           HD2      PRO   9   0.139  -1.436   4.197
   58    HD3  PRO   9           HD3      PRO   9  -1.203  -0.586   4.991
   59    H    CYS  10           H        CYS  10  -0.096  -4.019   3.132
   60    HA   CYS  10           HA       CYS  10  -0.326  -5.982   1.169
   61    HB2  CYS  10           HB2      CYS  10   1.364  -5.651   3.607
   62    HB3  CYS  10           HB3      CYS  10   1.359  -7.215   2.801
   63    H    GLN  11           H        GLN  11  -0.329  -8.395   1.636
   64    HA   GLN  11           HA       GLN  11  -2.348  -9.042   3.678
   65    HB2  GLN  11           HB2      GLN  11  -2.429  -9.434   0.776
   66    HB3  GLN  11           HB3      GLN  11  -2.796 -10.889   1.691
   67    HG2  GLN  11           HG2      GLN  11  -4.149  -8.379   2.495
   68    HG3  GLN  11           HG3      GLN  11  -4.654  -9.142   0.989
   69   HE21  GLN  11          HE21      GLN  11  -6.483 -10.169   1.372
   70   HE22  GLN  11          HE22      GLN  11  -6.795 -11.225   2.704
   71    H    ASN  12           H        ASN  12   0.610  -9.309   3.648
   72    HA   ASN  12           HA       ASN  12   0.686 -12.123   4.395
   73    HB2  ASN  12           HB2      ASN  12   2.220 -10.915   2.155
   74    HB3  ASN  12           HB3      ASN  12   3.067 -12.065   3.180
   75   HD21  ASN  12          HD21      ASN  12   2.841 -12.737   0.674
   76   HD22  ASN  12          HD22      ASN  12   1.663 -13.970   0.449
   77    H    ASP  13           H        ASP  13   0.953  -9.277   5.572
   78    HA   ASP  13           HA       ASP  13   1.998  -8.383   7.383
   79    HB2  ASP  13           HB2      ASP  13   2.626 -11.207   7.562
   80    HB3  ASP  13           HB3      ASP  13   3.958 -10.232   8.172
   81    H    ALA  14           H        ALA  14   2.810  -7.464   5.076
   82    HA   ALA  14           HA       ALA  14   5.723  -7.614   4.942
   83    HB1  ALA  14           HB1      ALA  14   4.618  -5.878   2.967
   84    HB2  ALA  14           HB2      ALA  14   3.672  -7.367   3.020
   85    HB3  ALA  14           HB3      ALA  14   5.414  -7.438   2.754
   86    H    THR  15           H        THR  15   6.708  -5.373   4.238
   87    HA   THR  15           HA       THR  15   6.103  -3.543   6.417
   88    HB   THR  15           HB       THR  15   8.358  -3.602   4.403
   89   HG21  THR  15          HG21      THR  15   9.336  -2.062   6.339
   90   HG22  THR  15          HG22      THR  15   7.642  -1.580   6.429
   91   HG23  THR  15          HG23      THR  15   8.527  -1.412   4.912
   92    H    CYS  16           H        CYS  16   5.688  -1.324   6.128
   93    HA   CYS  16           HA       CYS  16   4.792  -0.561   3.427
   94    HB2  CYS  16           HB2      CYS  16   2.847  -1.041   4.845
   95    HB3  CYS  16           HB3      CYS  16   3.432   0.103   6.048
   96    H    LEU  17           H        LEU  17   5.305   1.464   2.739
   97    HA   LEU  17           HA       LEU  17   6.732   3.206   4.637
   98    HB2  LEU  17           HB2      LEU  17   7.960   1.862   2.627
   99    HB3  LEU  17           HB3      LEU  17   7.537   3.351   1.803
  100    HG   LEU  17           HG       LEU  17   9.825   3.363   2.761
  101   HD11  LEU  17          HD11      LEU  17   9.725   5.579   3.163
  102   HD12  LEU  17          HD12      LEU  17   8.433   5.416   4.352
  103   HD13  LEU  17          HD13      LEU  17   8.055   5.383   2.629
  104   HD21  LEU  17          HD21      LEU  17   8.801   2.087   4.880
  105   HD22  LEU  17          HD22      LEU  17   8.768   3.739   5.494
  106   HD23  LEU  17          HD23      LEU  17  10.288   3.031   4.950
  107    H    ASP  18           H        ASP  18   5.940   5.197   4.780
  108    HA   ASP  18           HA       ASP  18   3.683   6.026   3.303
  109    HB2  ASP  18           HB2      ASP  18   4.755   6.797   5.652
  110    HB3  ASP  18           HB3      ASP  18   5.335   8.105   4.625
  111    H    GLN  19           H        GLN  19   3.448   7.325   1.555
  112    HA   GLN  19           HA       GLN  19   5.740   8.736   0.461
  113    HB2  GLN  19           HB2      GLN  19   4.891   6.190  -0.548
  114    HB3  GLN  19           HB3      GLN  19   4.608   7.425  -1.769
  115    HG2  GLN  19           HG2      GLN  19   7.227   7.010  -0.350
  116    HG3  GLN  19           HG3      GLN  19   6.822   6.327  -1.921
  117   HE21  GLN  19          HE21      GLN  19   8.212   7.393  -3.204
  118   HE22  GLN  19          HE22      GLN  19   8.250   9.108  -3.399
  119    H    ILE  20           H        ILE  20   5.123  10.097  -1.421
  120    HA   ILE  20           HA       ILE  20   2.501  11.263  -0.941
  121    HB   ILE  20           HB       ILE  20   4.631  12.270  -2.822
  122   HG12  ILE  20          HG12      ILE  20   4.662  13.876  -0.553
  123   HG13  ILE  20          HG13      ILE  20   4.550  12.243   0.094
  124   HG21  ILE  20          HG21      ILE  20   3.382  14.132  -3.089
  125   HG22  ILE  20          HG22      ILE  20   2.766  14.089  -1.437
  126   HG23  ILE  20          HG23      ILE  20   2.064  13.038  -2.668
  127   HD11  ILE  20          HD11      ILE  20   6.486  11.852  -1.695
  128   HD12  ILE  20          HD12      ILE  20   6.794  12.390  -0.045
  129   HD13  ILE  20          HD13      ILE  20   6.749  13.564  -1.360
  130    H    GLY  21           H        GLY  21   1.100   9.787  -1.921
  131    HA2  GLY  21           HA2      GLY  21  -0.024  10.103  -4.244
  132    HA3  GLY  21           HA3      GLY  21   1.449   9.326  -4.800
  133    H    GLU  22           H        GLU  22   1.882   7.145  -4.084
  134    HA   GLU  22           HA       GLU  22  -0.599   5.683  -3.461
  135    HB2  GLU  22           HB2      GLU  22   0.568   3.738  -4.589
  136    HB3  GLU  22           HB3      GLU  22   0.091   5.062  -5.642
  137    HG2  GLU  22           HG2      GLU  22   2.260   5.752  -5.986
  138    HG3  GLU  22           HG3      GLU  22   2.844   5.005  -4.500
  139    H    PHE  23           H        PHE  23   0.059   3.352  -2.612
  140    HA   PHE  23           HA       PHE  23   1.556   3.846  -0.171
  141    HB2  PHE  23           HB2      PHE  23   0.628   1.730   0.604
  142    HB3  PHE  23           HB3      PHE  23  -0.647   2.765  -0.032
  143    HD1  PHE  23           HD1      PHE  23  -1.748   2.236  -2.124
  144    HD2  PHE  23           HD2      PHE  23   1.249  -0.304  -0.497
  145    HE1  PHE  23           HE1      PHE  23  -2.463   0.431  -3.641
  146    HE2  PHE  23           HE2      PHE  23   0.543  -2.116  -2.009
  147    HZ   PHE  23           HZ       PHE  23  -1.315  -1.747  -3.585
  148    H    GLN  24           H        GLN  24   3.389   2.765   0.456
  149    HA   GLN  24           HA       GLN  24   4.737   1.230  -1.662
  150    HB2  GLN  24           HB2      GLN  24   5.752   3.419  -0.833
  151    HB3  GLN  24           HB3      GLN  24   6.078   2.579   0.677
  152    HG2  GLN  24           HG2      GLN  24   7.682   1.231  -0.255
  153    HG3  GLN  24           HG3      GLN  24   7.014   1.378  -1.880
  154   HE21  GLN  24          HE21      GLN  24   9.598   1.645  -1.798
  155   HE22  GLN  24          HE22      GLN  24  10.104   3.293  -1.918
  156    H    CYS  25           H        CYS  25   4.125  -0.842  -1.212
  157    HA   CYS  25           HA       CYS  25   4.626  -1.847   1.505
  158    HB2  CYS  25           HB2      CYS  25   2.397  -2.148  -0.055
  159    HB3  CYS  25           HB3      CYS  25   3.270  -3.638  -0.395
  160    H    ILE  26           H        ILE  26   6.443  -2.932   1.813
  161    HA   ILE  26           HA       ILE  26   7.924  -3.971  -0.467
  162    HB   ILE  26           HB       ILE  26   8.751  -4.021   2.433
  163   HG12  ILE  26          HG12      ILE  26   9.337  -1.913   0.341
  164   HG13  ILE  26          HG13      ILE  26   8.249  -1.712   1.710
  165   HG21  ILE  26          HG21      ILE  26  10.690  -3.830   0.207
  166   HG22  ILE  26          HG22      ILE  26   9.857  -5.370   0.414
  167   HG23  ILE  26          HG23      ILE  26  10.801  -4.693   1.741
  168   HD11  ILE  26          HD11      ILE  26  10.812  -0.929   1.707
  169   HD12  ILE  26          HD12      ILE  26  10.989  -2.554   2.369
  170   HD13  ILE  26          HD13      ILE  26   9.930  -1.389   3.164
  171    H    CYS  27           H        CYS  27   7.613  -5.988  -1.129
  172    HA   CYS  27           HA       CYS  27   6.244  -7.927   0.448
  173    HB2  CYS  27           HB2      CYS  27   7.774  -8.433  -2.102
  174    HB3  CYS  27           HB3      CYS  27   6.421  -9.348  -1.457
  175    H    MET  28           H        MET  28   7.291 -10.273   0.345
  176    HA   MET  28           HA       MET  28   9.558 -10.157   2.094
  177    HB2  MET  28           HB2      MET  28   7.569 -12.106   1.317
  178    HB3  MET  28           HB3      MET  28   9.174 -12.824   1.304
  179    HG2  MET  28           HG2      MET  28   9.322 -11.586   3.648
  180    HG3  MET  28           HG3      MET  28   7.572 -11.789   3.565
  181    HE1  MET  28           HE1      MET  28  11.065 -14.091   3.830
  182    HE2  MET  28           HE2      MET  28  10.319 -14.523   5.368
  183    HE3  MET  28           HE3      MET  28  10.485 -12.827   4.915
  184    HA   PRO  29           HA       PRO  29  12.853 -10.950  -0.730
  185    HB2  PRO  29           HB2      PRO  29  14.368 -12.817   0.451
  186    HB3  PRO  29           HB3      PRO  29  14.202 -11.190   1.121
  187    HG2  PRO  29           HG2      PRO  29  12.818 -13.720   1.933
  188    HG3  PRO  29           HG3      PRO  29  13.532 -12.458   2.955
  189    HD2  PRO  29           HD2      PRO  29  10.861 -12.628   2.430
  190    HD3  PRO  29           HD3      PRO  29  11.690 -11.098   2.773
  191    H    GLY  30           H        GLY  30  11.089 -11.936  -2.185
  192    HA2  GLY  30           HA2      GLY  30  11.609 -13.622  -3.969
  193    HA3  GLY  30           HA3      GLY  30  11.707 -14.787  -2.658
  194    H    TYR  31           H        TYR  31   9.323 -12.203  -3.036
  195    HA   TYR  31           HA       TYR  31   7.241 -14.278  -3.201
  196    HB2  TYR  31           HB2      TYR  31   7.409 -11.687  -1.759
  197    HB3  TYR  31           HB3      TYR  31   5.843 -12.128  -2.422
  198    HD1  TYR  31           HD1      TYR  31   8.584 -13.939  -0.633
  199    HD2  TYR  31           HD2      TYR  31   4.428 -13.059  -0.861
  200    HE1  TYR  31           HE1      TYR  31   8.178 -15.385   1.314
  201    HE2  TYR  31           HE2      TYR  31   4.010 -14.502   1.087
  202    HH   TYR  31           HH       TYR  31   5.873 -16.759   2.137
  203    H    GLU  32           H        GLU  32   5.096 -12.993  -4.053
  204    HA   GLU  32           HA       GLU  32   5.731 -11.345  -6.357
  205    HB2  GLU  32           HB2      GLU  32   4.309 -12.919  -7.812
  206    HB3  GLU  32           HB3      GLU  32   5.970 -13.387  -7.473
  207    HG2  GLU  32           HG2      GLU  32   4.112 -14.402  -5.491
  208    HG3  GLU  32           HG3      GLU  32   3.721 -14.940  -7.123
  209    H    GLY  33           H        GLY  33   3.509 -11.039  -7.644
  210    HA2  GLY  33           HA2      GLY  33   1.152 -10.727  -7.473
  211    HA3  GLY  33           HA3      GLY  33   1.297 -10.832  -5.726
  212    H    VAL  34           H        VAL  34  -0.189  -8.857  -6.286
  213    HA   VAL  34           HA       VAL  34   1.336  -6.441  -6.833
  214    HB   VAL  34           HB       VAL  34  -1.597  -6.659  -6.149
  215   HG11  VAL  34          HG11      VAL  34  -0.460  -4.431  -5.942
  216   HG12  VAL  34          HG12      VAL  34  -1.805  -4.480  -7.081
  217   HG13  VAL  34          HG13      VAL  34  -0.144  -4.507  -7.676
  218   HG21  VAL  34          HG21      VAL  34  -0.163  -6.953  -8.767
  219   HG22  VAL  34          HG22      VAL  34  -1.824  -6.368  -8.696
  220   HG23  VAL  34          HG23      VAL  34  -1.426  -7.968  -8.071
  221    H    TYR  35           H        TYR  35  -0.724  -7.723  -4.227
  222    HA   TYR  35           HA       TYR  35   0.347  -5.692  -2.411
  223    HB2  TYR  35           HB2      TYR  35  -2.112  -7.351  -2.489
  224    HB3  TYR  35           HB3      TYR  35  -1.457  -6.997  -0.894
  225    HD1  TYR  35           HD1      TYR  35  -0.898  -4.470  -0.448
  226    HD2  TYR  35           HD2      TYR  35  -3.554  -5.835  -3.480
  227    HE1  TYR  35           HE1      TYR  35  -1.962  -2.254  -0.506
  228    HE2  TYR  35           HE2      TYR  35  -4.625  -3.622  -3.546
  229    HH   TYR  35           HH       TYR  35  -4.180  -1.292  -1.172
  230    H    CYS  36           H        CYS  36   1.917  -8.003  -3.347
  231    HA   CYS  36           HA       CYS  36   3.329  -9.601  -2.542
  232    HB2  CYS  36           HB2      CYS  36   2.971  -8.338   0.171
  233    HB3  CYS  36           HB3      CYS  36   4.398  -9.134  -0.483
  234    H    GLU  37           H        GLU  37   0.470 -10.149  -2.511
  235    HA   GLU  37           HA       GLU  37   0.189 -11.900  -0.179
  236    HB2  GLU  37           HB2      GLU  37  -2.154 -11.963  -0.652
  237    HB3  GLU  37           HB3      GLU  37  -1.638 -10.288  -0.769
  238    HG2  GLU  37           HG2      GLU  37  -1.479 -10.623  -3.256
  239    HG3  GLU  37           HG3      GLU  37  -2.276 -12.177  -3.014
  240    H    ILE  38           H        ILE  38   0.719 -11.961  -3.592
  241    HA   ILE  38           HA       ILE  38   0.019 -14.774  -3.834
  242    HB   ILE  38           HB       ILE  38   1.285 -13.011  -5.928
  243   HG12  ILE  38          HG12      ILE  38  -0.850 -12.050  -5.089
  244   HG13  ILE  38          HG13      ILE  38  -0.944 -12.562  -6.771
  245   HG21  ILE  38          HG21      ILE  38   0.157 -15.746  -5.870
  246   HG22  ILE  38          HG22      ILE  38   1.497 -15.090  -6.809
  247   HG23  ILE  38          HG23      ILE  38  -0.166 -14.769  -7.303
  248   HD11  ILE  38          HD11      ILE  38  -1.737 -14.725  -5.095
  249   HD12  ILE  38          HD12      ILE  38  -2.675 -13.849  -6.304
  250   HD13  ILE  38          HD13      ILE  38  -2.627 -13.273  -4.638
  251    H1   FUC  39           H1       FUC  39  10.486  -3.739   5.722
  252    H2   FUC  39           H2       FUC  39  11.640  -5.519   6.950
  253    H3   FUC  39           H3       FUC  39   8.858  -6.323   7.910
  254    H4   FUC  39           H4       FUC  39   9.187  -8.362   6.642
  255    H5   FUC  39           H5       FUC  39   8.145  -6.466   5.464
  256    H61  FUC  39           H61      FUC  39  10.162  -7.912   3.677
  257    H62  FUC  39           H62      FUC  39   8.529  -8.508   4.109
  258    H63  FUC  39           H63      FUC  39   8.714  -7.027   3.115
  259    HO2  FUC  39           HO2      FUC  39  11.026  -3.565   8.053
  260    HO4  FUC  39           HO4      FUC  39  11.650  -7.157   5.797
  261    H1   NAG  40           H1       NAG  40   9.099  -8.462   9.245
  262    H2   NAG  40           H2       NAG  40  11.443  -7.635  11.057
  263    H3   NAG  40           H3       NAG  40   9.240  -9.717  11.551
  264    H4   NAG  40           H4       NAG  40   9.657  -6.992  12.899
  265    H5   NAG  40           H5       NAG  40   7.479  -7.874  10.909
  266    H61  NAG  40           H61      NAG  40   7.335  -5.908  12.847
  267    H62  NAG  40           H62      NAG  40   7.884  -5.006  11.417
  268    H81  NAG  40           H81      NAG  40  13.217 -10.320   7.836
  269    H82  NAG  40           H82      NAG  40  14.348 -10.558   9.200
  270    H83  NAG  40           H83      NAG  40  12.776 -11.410   9.184
  271    HN2  NAG  40           HN2      NAG  40  10.974 -10.350   9.994
  272    HO3  NAG  40           HO3      NAG  40  11.435  -9.837  12.551
  273    HO4  NAG  40           HO4      NAG  40   8.620  -8.448  14.218
  274    HO6  NAG  40           HO6      NAG  40   5.455  -5.519  11.824
  Start of MODEL   17
    1    H1   ASP   1           H1       ASP   1  -1.449  14.108   2.953
    2    HA   ASP   1           HA       ASP   1  -3.068  12.970   4.177
    3    HB2  ASP   1           HB2      ASP   1  -5.298  13.886   3.611
    4    HB3  ASP   1           HB3      ASP   1  -4.049  15.127   3.629
    5    H    VAL   2           H        VAL   2  -3.202  12.436   0.726
    6    HA   VAL   2           HA       VAL   2  -5.113  10.293   0.884
    7    HB   VAL   2           HB       VAL   2  -3.257  10.947  -1.406
    8   HG11  VAL   2          HG11      VAL   2  -4.263   8.752  -1.582
    9   HG12  VAL   2          HG12      VAL   2  -4.992   9.841  -2.763
   10   HG13  VAL   2          HG13      VAL   2  -5.862   9.432  -1.283
   11   HG21  VAL   2          HG21      VAL   2  -6.049  11.824  -1.574
   12   HG22  VAL   2          HG22      VAL   2  -4.567  12.651  -2.053
   13   HG23  VAL   2          HG23      VAL   2  -5.086  12.677  -0.369
   14    H    ASN   3           H        ASN   3  -4.225   8.822   2.357
   15    HA   ASN   3           HA       ASN   3  -1.891   7.337   1.344
   16    HB2  ASN   3           HB2      ASN   3  -2.200   8.625   3.850
   17    HB3  ASN   3           HB3      ASN   3  -2.261   6.892   4.155
   18   HD21  ASN   3          HD21      ASN   3  -0.221   8.444   5.122
   19   HD22  ASN   3          HD22      ASN   3   1.249   8.036   4.312
   20    H    GLU   4           H        GLU   4  -1.952   5.095   1.459
   21    HA   GLU   4           HA       GLU   4  -4.605   3.954   2.052
   22    HB2  GLU   4           HB2      GLU   4  -2.569   2.962   0.050
   23    HB3  GLU   4           HB3      GLU   4  -4.158   2.268   0.343
   24    HG2  GLU   4           HG2      GLU   4  -4.852   4.804  -0.219
   25    HG3  GLU   4           HG3      GLU   4  -3.385   4.659  -1.186
   26    H    CYS   5           H        CYS   5  -1.391   4.007   3.028
   27    HA   CYS   5           HA       CYS   5  -1.338   1.262   3.972
   28    HB2  CYS   5           HB2      CYS   5   0.639   3.513   4.009
   29    HB3  CYS   5           HB3      CYS   5   0.904   2.056   4.955
   30    H    ILE   6           H        ILE   6  -3.282   1.671   5.322
   31    HA   ILE   6           HA       ILE   6  -2.701   3.144   7.787
   32    HB   ILE   6           HB       ILE   6  -5.343   1.970   6.988
   33   HG12  ILE   6          HG12      ILE   6  -4.609   3.572   5.273
   34   HG13  ILE   6          HG13      ILE   6  -5.972   4.200   6.194
   35   HG21  ILE   6          HG21      ILE   6  -6.274   3.169   8.725
   36   HG22  ILE   6          HG22      ILE   6  -4.934   4.315   8.787
   37   HG23  ILE   6          HG23      ILE   6  -4.723   2.678   9.407
   38   HD11  ILE   6          HD11      ILE   6  -3.219   5.179   5.986
   39   HD12  ILE   6          HD12      ILE   6  -3.905   5.206   7.610
   40   HD13  ILE   6          HD13      ILE   6  -4.720   6.051   6.293
   41    H    SER   7           H        SER   7  -4.514   0.183   7.023
   42    HA   SER   7           HA       SER   7  -3.412  -1.016   9.464
   43    HB2  SER   7           HB2      SER   7  -6.007  -0.747   8.878
   44    HB3  SER   7           HB3      SER   7  -5.711  -2.279   8.057
   45    HG   SER   7           HG       SER   7  -6.061  -3.025  10.009
   46    H    ASN   8           H        ASN   8  -1.598  -1.095   7.574
   47    HA   ASN   8           HA       ASN   8  -0.301  -2.393   6.220
   48    HB2  ASN   8           HB2      ASN   8  -0.145  -3.641   8.336
   49    HB3  ASN   8           HB3      ASN   8  -1.551  -4.592   7.878
   50   HD21  ASN   8          HD21      ASN   8   0.376  -6.100   8.462
   51   HD22  ASN   8          HD22      ASN   8   1.234  -6.699   7.095
   52    HA   PRO   9           HA       PRO   9  -3.607  -3.326   3.166
   53    HB2  PRO   9           HB2      PRO   9  -1.988  -2.772   1.016
   54    HB3  PRO   9           HB3      PRO   9  -2.972  -1.568   1.853
   55    HG2  PRO   9           HG2      PRO   9  -0.059  -2.174   2.146
   56    HG3  PRO   9           HG3      PRO   9  -0.882  -0.602   2.124
   57    HD2  PRO   9           HD2      PRO   9  -0.052  -1.744   4.415
   58    HD3  PRO   9           HD3      PRO   9  -1.535  -0.771   4.336
   59    H    CYS  10           H        CYS  10  -0.185  -4.265   3.043
   60    HA   CYS  10           HA       CYS  10  -0.277  -6.324   1.229
   61    HB2  CYS  10           HB2      CYS  10   1.403  -5.748   3.616
   62    HB3  CYS  10           HB3      CYS  10   1.508  -7.362   2.924
   63    H    GLN  11           H        GLN  11  -0.512  -8.596   1.394
   64    HA   GLN  11           HA       GLN  11  -2.280  -9.432   3.597
   65    HB2  GLN  11           HB2      GLN  11  -2.344  -9.887   0.676
   66    HB3  GLN  11           HB3      GLN  11  -2.766 -11.271   1.674
   67    HG2  GLN  11           HG2      GLN  11  -4.078  -8.565   1.721
   68    HG3  GLN  11           HG3      GLN  11  -4.746 -10.048   1.043
   69   HE21  GLN  11          HE21      GLN  11  -4.114  -8.239   3.908
   70   HE22  GLN  11          HE22      GLN  11  -4.965  -9.268   5.004
   71    H    ASN  12           H        ASN  12   0.636  -9.547   3.647
   72    HA   ASN  12           HA       ASN  12   0.875 -12.375   4.267
   73    HB2  ASN  12           HB2      ASN  12   2.341 -11.031   2.057
   74    HB3  ASN  12           HB3      ASN  12   3.234 -12.187   3.036
   75   HD21  ASN  12          HD21      ASN  12   2.942 -12.714   0.459
   76   HD22  ASN  12          HD22      ASN  12   1.830 -14.006   0.224
   77    H    ASP  13           H        ASP  13   1.008  -9.570   5.542
   78    HA   ASP  13           HA       ASP  13   2.018  -8.699   7.388
   79    HB2  ASP  13           HB2      ASP  13   2.253 -11.269   7.894
   80    HB3  ASP  13           HB3      ASP  13   3.952 -10.985   7.532
   81    H    ALA  14           H        ALA  14   2.748  -7.508   5.247
   82    HA   ALA  14           HA       ALA  14   5.681  -7.484   5.139
   83    HB1  ALA  14           HB1      ALA  14   5.410  -7.470   2.940
   84    HB2  ALA  14           HB2      ALA  14   4.603  -5.906   3.064
   85    HB3  ALA  14           HB3      ALA  14   3.660  -7.393   3.132
   86    H    THR  15           H        THR  15   6.305  -5.083   4.228
   87    HA   THR  15           HA       THR  15   5.371  -3.270   6.344
   88    HB   THR  15           HB       THR  15   7.915  -3.188   4.711
   89   HG21  THR  15          HG21      THR  15   7.608  -0.977   5.323
   90   HG22  THR  15          HG22      THR  15   8.607  -1.626   6.623
   91   HG23  THR  15          HG23      THR  15   6.875  -1.403   6.870
   92    H    CYS  16           H        CYS  16   5.231  -0.965   5.809
   93    HA   CYS  16           HA       CYS  16   4.427  -0.525   3.008
   94    HB2  CYS  16           HB2      CYS  16   2.889  -0.235   5.418
   95    HB3  CYS  16           HB3      CYS  16   3.069   1.337   4.650
   96    H    LEU  17           H        LEU  17   4.865   1.506   2.105
   97    HA   LEU  17           HA       LEU  17   6.442   3.385   3.691
   98    HB2  LEU  17           HB2      LEU  17   7.720   1.556   2.126
   99    HB3  LEU  17           HB3      LEU  17   7.535   2.891   1.005
  100    HG   LEU  17           HG       LEU  17   8.588   3.595   3.676
  101   HD11  LEU  17          HD11      LEU  17   9.696   1.423   3.140
  102   HD12  LEU  17          HD12      LEU  17  10.797   2.796   3.266
  103   HD13  LEU  17          HD13      LEU  17  10.338   2.176   1.680
  104   HD21  LEU  17          HD21      LEU  17   8.788   4.482   0.869
  105   HD22  LEU  17          HD22      LEU  17  10.231   4.698   1.861
  106   HD23  LEU  17          HD23      LEU  17   8.702   5.425   2.356
  107    H    ASP  18           H        ASP  18   6.723   5.475   2.623
  108    HA   ASP  18           HA       ASP  18   4.516   6.025   0.749
  109    HB2  ASP  18           HB2      ASP  18   4.764   7.064   3.222
  110    HB3  ASP  18           HB3      ASP  18   5.691   8.254   2.314
  111    H    GLN  19           H        GLN  19   4.859   7.774  -0.788
  112    HA   GLN  19           HA       GLN  19   7.661   8.379  -1.377
  113    HB2  GLN  19           HB2      GLN  19   5.795   6.805  -3.063
  114    HB3  GLN  19           HB3      GLN  19   6.798   7.989  -3.890
  115    HG2  GLN  19           HG2      GLN  19   8.385   6.465  -2.050
  116    HG3  GLN  19           HG3      GLN  19   7.487   5.391  -3.121
  117   HE21  GLN  19          HE21      GLN  19   7.643   5.868  -5.448
  118   HE22  GLN  19          HE22      GLN  19   9.148   6.452  -6.065
  119    H    ILE  20           H        ILE  20   4.683   8.828  -3.239
  120    HA   ILE  20           HA       ILE  20   4.991  11.733  -2.900
  121    HB   ILE  20           HB       ILE  20   3.981  10.382  -5.400
  122   HG12  ILE  20          HG12      ILE  20   6.518  11.843  -5.566
  123   HG13  ILE  20          HG13      ILE  20   6.605  10.412  -4.544
  124   HG21  ILE  20          HG21      ILE  20   4.546  12.745  -6.292
  125   HG22  ILE  20          HG22      ILE  20   4.467  13.222  -4.597
  126   HG23  ILE  20          HG23      ILE  20   3.057  12.506  -5.378
  127   HD11  ILE  20          HD11      ILE  20   6.655   9.080  -6.308
  128   HD12  ILE  20          HD12      ILE  20   6.812  10.523  -7.310
  129   HD13  ILE  20          HD13      ILE  20   5.218   9.835  -6.998
  130    H    GLY  21           H        GLY  21   2.586   9.513  -4.292
  131    HA2  GLY  21           HA2      GLY  21   0.613  10.441  -2.346
  132    HA3  GLY  21           HA3      GLY  21   0.273  10.763  -4.040
  133    H    GLU  22           H        GLU  22   1.960   7.876  -3.078
  134    HA   GLU  22           HA       GLU  22  -0.497   6.297  -3.366
  135    HB2  GLU  22           HB2      GLU  22   0.810   4.656  -4.760
  136    HB3  GLU  22           HB3      GLU  22   0.451   6.186  -5.549
  137    HG2  GLU  22           HG2      GLU  22   2.599   6.624  -5.862
  138    HG3  GLU  22           HG3      GLU  22   2.981   6.301  -4.172
  139    H    PHE  23           H        PHE  23   0.249   3.829  -3.010
  140    HA   PHE  23           HA       PHE  23   1.681   3.850  -0.450
  141    HB2  PHE  23           HB2      PHE  23   0.488   1.730   0.016
  142    HB3  PHE  23           HB3      PHE  23  -0.604   3.086  -0.251
  143    HD1  PHE  23           HD1      PHE  23  -1.878   3.258  -2.334
  144    HD2  PHE  23           HD2      PHE  23   0.543  -0.129  -1.460
  145    HE1  PHE  23           HE1      PHE  23  -3.047   1.978  -4.083
  146    HE2  PHE  23           HE2      PHE  23  -0.621  -1.419  -3.206
  147    HZ   PHE  23           HZ       PHE  23  -2.418  -0.363  -4.521
  148    H    GLN  24           H        GLN  24   3.429   2.580  -0.108
  149    HA   GLN  24           HA       GLN  24   4.265   0.810  -2.309
  150    HB2  GLN  24           HB2      GLN  24   5.517   3.139  -1.728
  151    HB3  GLN  24           HB3      GLN  24   6.386   2.048  -0.656
  152    HG2  GLN  24           HG2      GLN  24   7.265   0.819  -2.399
  153    HG3  GLN  24           HG3      GLN  24   6.008   1.327  -3.527
  154   HE21  GLN  24          HE21      GLN  24   6.545   2.816  -4.949
  155   HE22  GLN  24          HE22      GLN  24   7.874   3.913  -4.822
  156    H    CYS  25           H        CYS  25   3.624  -1.089  -1.359
  157    HA   CYS  25           HA       CYS  25   4.456  -1.684   1.365
  158    HB2  CYS  25           HB2      CYS  25   2.195  -2.325   0.134
  159    HB3  CYS  25           HB3      CYS  25   3.141  -3.719  -0.378
  160    H    ILE  26           H        ILE  26   6.163  -2.890   1.904
  161    HA   ILE  26           HA       ILE  26   7.876  -3.886  -0.228
  162    HB   ILE  26           HB       ILE  26   8.421  -3.917   2.740
  163   HG12  ILE  26          HG12      ILE  26   9.135  -1.809   0.688
  164   HG13  ILE  26          HG13      ILE  26   7.969  -1.622   1.994
  165   HG21  ILE  26          HG21      ILE  26  10.578  -3.699   0.736
  166   HG22  ILE  26          HG22      ILE  26   9.740  -5.248   0.823
  167   HG23  ILE  26          HG23      ILE  26  10.525  -4.589   2.258
  168   HD11  ILE  26          HD11      ILE  26  10.935  -1.664   2.090
  169   HD12  ILE  26          HD12      ILE  26  10.031  -2.241   3.490
  170   HD13  ILE  26          HD13      ILE  26   9.788  -0.597   2.900
  171    H    CYS  27           H        CYS  27   7.885  -5.933  -0.854
  172    HA   CYS  27           HA       CYS  27   6.388  -7.913   0.629
  173    HB2  CYS  27           HB2      CYS  27   7.496  -7.659  -2.092
  174    HB3  CYS  27           HB3      CYS  27   7.483  -9.293  -1.445
  175    H    MET  28           H        MET  28   7.571 -10.244   0.339
  176    HA   MET  28           HA       MET  28   9.827 -10.079   2.148
  177    HB2  MET  28           HB2      MET  28   7.809 -12.034   1.468
  178    HB3  MET  28           HB3      MET  28   9.408 -12.763   1.424
  179    HG2  MET  28           HG2      MET  28   9.569 -11.405   3.741
  180    HG3  MET  28           HG3      MET  28   7.842 -11.756   3.700
  181    HE1  MET  28           HE1      MET  28  11.457 -13.355   4.295
  182    HE2  MET  28           HE2      MET  28  10.732 -14.324   5.578
  183    HE3  MET  28           HE3      MET  28  10.452 -12.584   5.522
  184    HA   PRO  29           HA       PRO  29  13.050 -10.958  -0.735
  185    HB2  PRO  29           HB2      PRO  29  14.532 -12.890   0.388
  186    HB3  PRO  29           HB3      PRO  29  14.447 -11.262   1.066
  187    HG2  PRO  29           HG2      PRO  29  12.997 -13.742   1.912
  188    HG3  PRO  29           HG3      PRO  29  13.785 -12.511   2.916
  189    HD2  PRO  29           HD2      PRO  29  11.100 -12.580   2.482
  190    HD3  PRO  29           HD3      PRO  29  11.994 -11.076   2.783
  191    H    GLY  30           H        GLY  30  11.299 -11.846  -2.211
  192    HA2  GLY  30           HA2      GLY  30  11.702 -13.536  -4.003
  193    HA3  GLY  30           HA3      GLY  30  11.781 -14.720  -2.708
  194    H    TYR  31           H        TYR  31   9.486 -12.048  -3.009
  195    HA   TYR  31           HA       TYR  31   7.329 -14.046  -3.178
  196    HB2  TYR  31           HB2      TYR  31   7.617 -11.504  -1.667
  197    HB3  TYR  31           HB3      TYR  31   6.023 -11.870  -2.311
  198    HD1  TYR  31           HD1      TYR  31   8.577 -14.214  -0.962
  199    HD2  TYR  31           HD2      TYR  31   4.764 -12.409  -0.418
  200    HE1  TYR  31           HE1      TYR  31   8.154 -15.699   0.951
  201    HE2  TYR  31           HE2      TYR  31   4.330 -13.889   1.497
  202    HH   TYR  31           HH       TYR  31   5.614 -16.545   2.098
  203    H    GLU  32           H        GLU  32   5.213 -12.675  -3.949
  204    HA   GLU  32           HA       GLU  32   5.849 -10.978  -6.217
  205    HB2  GLU  32           HB2      GLU  32   4.517 -12.398  -7.778
  206    HB3  GLU  32           HB3      GLU  32   6.026 -13.136  -7.257
  207    HG2  GLU  32           HG2      GLU  32   4.717 -14.408  -5.551
  208    HG3  GLU  32           HG3      GLU  32   3.249 -13.780  -6.301
  209    H    GLY  33           H        GLY  33   3.555 -10.678  -7.468
  210    HA2  GLY  33           HA2      GLY  33   1.255 -10.212  -7.260
  211    HA3  GLY  33           HA3      GLY  33   1.380 -10.484  -5.529
  212    H    VAL  34           H        VAL  34  -0.051  -8.373  -6.198
  213    HA   VAL  34           HA       VAL  34   1.634  -6.003  -6.289
  214    HB   VAL  34           HB       VAL  34  -1.377  -6.146  -6.094
  215   HG11  VAL  34          HG11      VAL  34  -0.036  -3.870  -7.391
  216   HG12  VAL  34          HG12      VAL  34   0.205  -4.004  -5.649
  217   HG13  VAL  34          HG13      VAL  34  -1.427  -3.904  -6.308
  218   HG21  VAL  34          HG21      VAL  34   0.065  -7.124  -8.178
  219   HG22  VAL  34          HG22      VAL  34  -0.150  -5.444  -8.669
  220   HG23  VAL  34          HG23      VAL  34  -1.557  -6.447  -8.317
  221    H    TYR  35           H        TYR  35  -0.912  -7.318  -4.168
  222    HA   TYR  35           HA       TYR  35   0.010  -5.556  -2.018
  223    HB2  TYR  35           HB2      TYR  35  -2.526  -6.975  -2.632
  224    HB3  TYR  35           HB3      TYR  35  -2.116  -6.792  -0.931
  225    HD1  TYR  35           HD1      TYR  35  -1.805  -4.566  -3.924
  226    HD2  TYR  35           HD2      TYR  35  -3.311  -5.066   0.023
  227    HE1  TYR  35           HE1      TYR  35  -2.678  -2.268  -3.972
  228    HE2  TYR  35           HE2      TYR  35  -4.188  -2.769  -0.014
  229    HH   TYR  35           HH       TYR  35  -4.923  -1.115  -2.173
  230    H    CYS  36           H        CYS  36   1.454  -7.989  -2.958
  231    HA   CYS  36           HA       CYS  36   2.533  -9.810  -2.129
  232    HB2  CYS  36           HB2      CYS  36   2.776  -7.746  -0.298
  233    HB3  CYS  36           HB3      CYS  36   2.293  -9.116   0.692
  234    H    GLU  37           H        GLU  37   1.294 -11.562  -2.469
  235    HA   GLU  37           HA       GLU  37   0.126 -12.893  -0.277
  236    HB2  GLU  37           HB2      GLU  37  -1.686 -11.315  -0.511
  237    HB3  GLU  37           HB3      GLU  37  -1.798 -11.629  -2.236
  238    HG2  GLU  37           HG2      GLU  37  -3.592 -12.766  -1.200
  239    HG3  GLU  37           HG3      GLU  37  -2.415 -13.990  -1.671
  240    H    ILE  38           H        ILE  38   0.419 -12.530  -3.755
  241    HA   ILE  38           HA       ILE  38  -0.155 -15.343  -4.222
  242    HB   ILE  38           HB       ILE  38   0.833 -13.378  -6.277
  243   HG12  ILE  38          HG12      ILE  38  -1.129 -12.414  -5.112
  244   HG13  ILE  38          HG13      ILE  38  -1.481 -12.821  -6.788
  245   HG21  ILE  38          HG21      ILE  38   0.827 -15.339  -7.391
  246   HG22  ILE  38          HG22      ILE  38  -0.896 -14.998  -7.543
  247   HG23  ILE  38          HG23      ILE  38  -0.322 -16.089  -6.282
  248   HD11  ILE  38          HD11      ILE  38  -2.321 -15.067  -5.715
  249   HD12  ILE  38          HD12      ILE  38  -3.344 -13.632  -5.767
  250   HD13  ILE  38          HD13      ILE  38  -2.486 -14.049  -4.283
  251    H1   FUC  39           H1       FUC  39   9.829  -3.236   6.473
  252    H2   FUC  39           H2       FUC  39  10.866  -5.166   7.591
  253    H3   FUC  39           H3       FUC  39   8.012  -6.214   7.862
  254    H4   FUC  39           H4       FUC  39   8.697  -7.991   6.357
  255    H5   FUC  39           H5       FUC  39   7.761  -5.954   5.341
  256    H61  FUC  39           H61      FUC  39  10.154  -7.006   3.750
  257    H62  FUC  39           H62      FUC  39   8.776  -6.077   3.078
  258    H63  FUC  39           H63      FUC  39   8.508  -7.710   3.763
  259    HO2  FUC  39           HO2      FUC  39   9.945  -3.459   8.870
  260    HO4  FUC  39           HO4      FUC  39  11.188  -6.577   6.216
  261    H1   NAG  40           H1       NAG  40   8.239  -8.651   8.732
  262    H2   NAG  40           H2       NAG  40   9.980  -8.006  11.185
  263    H3   NAG  40           H3       NAG  40   8.048 -10.347  10.730
  264    H4   NAG  40           H4       NAG  40   7.754  -7.942  12.614
  265    H5   NAG  40           H5       NAG  40   6.227  -8.591  10.019
  266    H61  NAG  40           H61      NAG  40   5.174  -6.443  10.262
  267    H62  NAG  40           H62      NAG  40   6.141  -6.069  11.707
  268    H81  NAG  40           H81      NAG  40  12.206 -11.062   8.937
  269    H82  NAG  40           H82      NAG  40  12.904 -11.521  10.519
  270    H83  NAG  40           H83      NAG  40  13.531 -10.092   9.645
  271    HN2  NAG  40           HN2      NAG  40  10.198 -10.198   9.220
  272    HO3  NAG  40           HO3      NAG  40   9.465  -9.457  13.038
  273    HO4  NAG  40           HO4      NAG  40   6.747 -10.039  13.105
  274    HO6  NAG  40           HO6      NAG  40   3.922  -7.762  11.426
  Start of MODEL   18
    1    H1   ASP   1           H1       ASP   1  -6.661  13.778   1.016
    2    HA   ASP   1           HA       ASP   1  -7.286  12.399   3.499
    3    HB2  ASP   1           HB2      ASP   1  -8.890  12.786   1.485
    4    HB3  ASP   1           HB3      ASP   1  -8.053  11.412   0.769
    5    H    VAL   2           H        VAL   2  -5.239  11.622   4.101
    6    HA   VAL   2           HA       VAL   2  -3.540  10.131   2.416
    7    HB   VAL   2           HB       VAL   2  -2.579   9.254   4.599
    8   HG11  VAL   2          HG11      VAL   2  -1.763  11.570   5.274
    9   HG12  VAL   2          HG12      VAL   2  -2.807  12.189   3.995
   10   HG13  VAL   2          HG13      VAL   2  -1.491  11.084   3.600
   11   HG21  VAL   2          HG21      VAL   2  -3.487   9.751   6.605
   12   HG22  VAL   2          HG22      VAL   2  -4.971   9.899   5.665
   13   HG23  VAL   2          HG23      VAL   2  -4.042  11.340   6.081
   14    H    ASN   3           H        ASN   3  -4.657   8.532   1.328
   15    HA   ASN   3           HA       ASN   3  -5.644   6.314   2.999
   16    HB2  ASN   3           HB2      ASN   3  -7.228   7.759   1.367
   17    HB3  ASN   3           HB3      ASN   3  -6.654   6.552   0.221
   18   HD21  ASN   3          HD21      ASN   3  -9.206   6.450   0.552
   19   HD22  ASN   3          HD22      ASN   3  -9.706   5.169   1.596
   20    H    GLU   4           H        GLU   4  -3.513   5.420   2.960
   21    HA   GLU   4           HA       GLU   4  -3.002   3.914   0.505
   22    HB2  GLU   4           HB2      GLU   4  -0.453   4.374   1.194
   23    HB3  GLU   4           HB3      GLU   4  -1.330   5.384   0.054
   24    HG2  GLU   4           HG2      GLU   4  -1.591   6.164   2.874
   25    HG3  GLU   4           HG3      GLU   4   0.029   6.311   2.192
   26    H    CYS   5           H        CYS   5  -1.067   4.288   3.445
   27    HA   CYS   5           HA       CYS   5  -1.424   1.414   3.939
   28    HB2  CYS   5           HB2      CYS   5   0.852   3.256   4.187
   29    HB3  CYS   5           HB3      CYS   5   0.661   2.153   5.546
   30    H    ILE   6           H        ILE   6  -3.339   1.520   5.116
   31    HA   ILE   6           HA       ILE   6  -3.243   3.013   7.640
   32    HB   ILE   6           HB       ILE   6  -5.583   1.920   6.105
   33   HG12  ILE   6          HG12      ILE   6  -6.257   4.315   6.047
   34   HG13  ILE   6          HG13      ILE   6  -4.741   4.729   6.841
   35   HG21  ILE   6          HG21      ILE   6  -6.039   1.571   8.444
   36   HG22  ILE   6          HG22      ILE   6  -6.999   2.932   7.866
   37   HG23  ILE   6          HG23      ILE   6  -5.546   3.221   8.822
   38   HD11  ILE   6          HD11      ILE   6  -4.968   4.940   4.269
   39   HD12  ILE   6          HD12      ILE   6  -4.695   3.197   4.286
   40   HD13  ILE   6          HD13      ILE   6  -3.487   4.286   4.969
   41    H    SER   7           H        SER   7  -5.061   0.116   6.730
   42    HA   SER   7           HA       SER   7  -4.103  -1.165   9.185
   43    HB2  SER   7           HB2      SER   7  -6.642  -0.832   8.487
   44    HB3  SER   7           HB3      SER   7  -6.343  -2.317   7.583
   45    HG   SER   7           HG       SER   7  -6.556  -3.328   9.399
   46    H    ASN   8           H        ASN   8  -2.166  -1.254   7.425
   47    HA   ASN   8           HA       ASN   8  -0.778  -2.576   6.197
   48    HB2  ASN   8           HB2      ASN   8  -0.919  -3.949   8.228
   49    HB3  ASN   8           HB3      ASN   8  -2.336  -4.766   7.584
   50   HD21  ASN   8          HD21      ASN   8  -0.596  -6.447   8.262
   51   HD22  ASN   8          HD22      ASN   8   0.351  -7.042   6.954
   52    HA   PRO   9           HA       PRO   9  -3.858  -3.071   2.782
   53    HB2  PRO   9           HB2      PRO   9  -1.956  -2.448   0.871
   54    HB3  PRO   9           HB3      PRO   9  -3.046  -1.287   1.628
   55    HG2  PRO   9           HG2      PRO   9  -0.196  -1.909   2.261
   56    HG3  PRO   9           HG3      PRO   9  -1.029  -0.343   2.253
   57    HD2  PRO   9           HD2      PRO   9  -0.473  -1.637   4.540
   58    HD3  PRO   9           HD3      PRO   9  -1.962  -0.688   4.345
   59    H    CYS  10           H        CYS  10  -0.499  -4.186   2.985
   60    HA   CYS  10           HA       CYS  10  -0.578  -6.134   1.000
   61    HB2  CYS  10           HB2      CYS  10   1.098  -5.597   3.374
   62    HB3  CYS  10           HB3      CYS  10   1.131  -7.254   2.779
   63    H    GLN  11           H        GLN  11  -0.213  -8.583   1.674
   64    HA   GLN  11           HA       GLN  11  -2.303  -9.369   3.582
   65    HB2  GLN  11           HB2      GLN  11  -2.290  -9.757   0.693
   66    HB3  GLN  11           HB3      GLN  11  -2.472 -11.270   1.569
   67    HG2  GLN  11           HG2      GLN  11  -4.178  -8.845   2.059
   68    HG3  GLN  11           HG3      GLN  11  -4.603 -10.136   0.937
   69   HE21  GLN  11          HE21      GLN  11  -6.110  -9.342   3.200
   70   HE22  GLN  11          HE22      GLN  11  -6.166 -10.681   4.290
   71    H    ASN  12           H        ASN  12   0.659  -9.376   3.683
   72    HA   ASN  12           HA       ASN  12   0.953 -12.168   4.457
   73    HB2  ASN  12           HB2      ASN  12   2.477 -10.842   2.275
   74    HB3  ASN  12           HB3      ASN  12   3.366 -11.920   3.341
   75   HD21  ASN  12          HD21      ASN  12   3.331 -12.639   0.853
   76   HD22  ASN  12          HD22      ASN  12   2.251 -13.950   0.574
   77    H    ASP  13           H        ASP  13   0.951  -9.272   5.592
   78    HA   ASP  13           HA       ASP  13   1.843  -8.289   7.442
   79    HB2  ASP  13           HB2      ASP  13   2.219 -10.929   7.955
   80    HB3  ASP  13           HB3      ASP  13   3.888 -10.367   7.948
   81    H    ALA  14           H        ALA  14   2.706  -7.418   5.088
   82    HA   ALA  14           HA       ALA  14   5.610  -7.375   5.037
   83    HB1  ALA  14           HB1      ALA  14   4.598  -5.606   3.111
   84    HB2  ALA  14           HB2      ALA  14   3.493  -6.980   3.144
   85    HB3  ALA  14           HB3      ALA  14   5.213  -7.239   2.859
   86    H    THR  15           H        THR  15   6.546  -5.093   4.475
   87    HA   THR  15           HA       THR  15   5.839  -3.373   6.712
   88    HB   THR  15           HB       THR  15   8.140  -3.255   4.751
   89   HG21  THR  15          HG21      THR  15   9.182  -1.647   6.188
   90   HG22  THR  15          HG22      THR  15   7.816  -1.695   7.301
   91   HG23  THR  15          HG23      THR  15   7.609  -1.029   5.681
   92    H    CYS  16           H        CYS  16   5.513  -1.099   6.478
   93    HA   CYS  16           HA       CYS  16   4.350  -0.370   3.871
   94    HB2  CYS  16           HB2      CYS  16   3.454   0.040   6.653
   95    HB3  CYS  16           HB3      CYS  16   3.275   1.438   5.598
   96    H    LEU  17           H        LEU  17   5.153   1.342   2.814
   97    HA   LEU  17           HA       LEU  17   6.707   3.344   4.265
   98    HB2  LEU  17           HB2      LEU  17   8.021   1.315   3.032
   99    HB3  LEU  17           HB3      LEU  17   7.920   2.475   1.721
  100    HG   LEU  17           HG       LEU  17   8.847   3.586   4.288
  101   HD11  LEU  17          HD11      LEU  17  10.046   1.594   4.553
  102   HD12  LEU  17          HD12      LEU  17  11.183   2.699   3.778
  103   HD13  LEU  17          HD13      LEU  17  10.372   1.456   2.826
  104   HD21  LEU  17          HD21      LEU  17  10.572   4.529   2.665
  105   HD22  LEU  17          HD22      LEU  17   8.895   5.030   2.439
  106   HD23  LEU  17          HD23      LEU  17   9.596   3.799   1.388
  107    H    ASP  18           H        ASP  18   5.737   5.192   3.776
  108    HA   ASP  18           HA       ASP  18   4.292   5.537   1.306
  109    HB2  ASP  18           HB2      ASP  18   3.846   6.516   3.745
  110    HB3  ASP  18           HB3      ASP  18   4.822   7.841   3.120
  111    H    GLN  19           H        GLN  19   4.707   7.133  -0.275
  112    HA   GLN  19           HA       GLN  19   7.512   8.027  -0.369
  113    HB2  GLN  19           HB2      GLN  19   5.721   6.981  -2.547
  114    HB3  GLN  19           HB3      GLN  19   7.136   7.958  -2.913
  115    HG2  GLN  19           HG2      GLN  19   8.376   6.212  -1.428
  116    HG3  GLN  19           HG3      GLN  19   6.974   5.205  -1.787
  117   HE21  GLN  19          HE21      GLN  19   9.976   5.483  -2.639
  118   HE22  GLN  19          HE22      GLN  19   9.902   5.186  -4.340
  119    H    ILE  20           H        ILE  20   4.771   8.808  -2.464
  120    HA   ILE  20           HA       ILE  20   4.937  11.597  -1.559
  121    HB   ILE  20           HB       ILE  20   4.549  10.766  -4.432
  122   HG12  ILE  20          HG12      ILE  20   6.975  12.260  -3.661
  123   HG13  ILE  20          HG13      ILE  20   6.912  10.596  -3.090
  124   HG21  ILE  20          HG21      ILE  20   5.101  13.489  -3.267
  125   HG22  ILE  20          HG22      ILE  20   3.499  12.903  -3.714
  126   HG23  ILE  20          HG23      ILE  20   4.742  13.099  -4.949
  127   HD11  ILE  20          HD11      ILE  20   7.871  10.199  -5.083
  128   HD12  ILE  20          HD12      ILE  20   7.202  11.654  -5.820
  129   HD13  ILE  20          HD13      ILE  20   6.198  10.216  -5.640
  130    H    GLY  21           H        GLY  21   2.969   9.731  -3.860
  131    HA2  GLY  21           HA2      GLY  21   0.576  10.650  -2.387
  132    HA3  GLY  21           HA3      GLY  21   0.636  10.580  -4.141
  133    H    GLU  22           H        GLU  22   2.005   8.075  -4.333
  134    HA   GLU  22           HA       GLU  22  -0.257   6.324  -3.804
  135    HB2  GLU  22           HB2      GLU  22   2.309   5.815  -5.322
  136    HB3  GLU  22           HB3      GLU  22   0.941   4.713  -5.233
  137    HG2  GLU  22           HG2      GLU  22  -0.067   7.198  -6.098
  138    HG3  GLU  22           HG3      GLU  22   1.397   6.880  -7.028
  139    H    PHE  23           H        PHE  23   0.385   3.983  -3.203
  140    HA   PHE  23           HA       PHE  23   1.968   4.152  -0.753
  141    HB2  PHE  23           HB2      PHE  23   0.874   2.015  -0.158
  142    HB3  PHE  23           HB3      PHE  23  -0.285   3.300  -0.484
  143    HD1  PHE  23           HD1      PHE  23   1.170   0.177  -1.724
  144    HD2  PHE  23           HD2      PHE  23  -1.755   3.199  -2.363
  145    HE1  PHE  23           HE1      PHE  23   0.056  -1.261  -3.384
  146    HE2  PHE  23           HE2      PHE  23  -2.878   1.768  -4.024
  147    HZ   PHE  23           HZ       PHE  23  -1.972  -0.465  -4.535
  148    H    GLN  24           H        GLN  24   3.310   2.258  -0.164
  149    HA   GLN  24           HA       GLN  24   4.339   0.700  -2.396
  150    HB2  GLN  24           HB2      GLN  24   5.645   2.867  -2.271
  151    HB3  GLN  24           HB3      GLN  24   6.225   2.335  -0.698
  152    HG2  GLN  24           HG2      GLN  24   6.722   0.177  -2.354
  153    HG3  GLN  24           HG3      GLN  24   7.098   1.582  -3.352
  154   HE21  GLN  24          HE21      GLN  24   8.970  -0.324  -2.433
  155   HE22  GLN  24          HE22      GLN  24  10.082   0.486  -1.388
  156    H    CYS  25           H        CYS  25   3.722  -1.188  -1.434
  157    HA   CYS  25           HA       CYS  25   4.486  -1.729   1.320
  158    HB2  CYS  25           HB2      CYS  25   2.253  -2.393   0.130
  159    HB3  CYS  25           HB3      CYS  25   3.198  -3.745  -0.485
  160    H    ILE  26           H        ILE  26   6.177  -2.928   1.931
  161    HA   ILE  26           HA       ILE  26   7.945  -3.969  -0.143
  162    HB   ILE  26           HB       ILE  26   8.457  -3.893   2.829
  163   HG12  ILE  26          HG12      ILE  26   9.292  -1.838   0.772
  164   HG13  ILE  26          HG13      ILE  26   7.932  -1.631   1.871
  165   HG21  ILE  26          HG21      ILE  26  10.569  -3.742   0.738
  166   HG22  ILE  26          HG22      ILE  26   9.820  -5.302   1.077
  167   HG23  ILE  26          HG23      ILE  26  10.636  -4.418   2.366
  168   HD11  ILE  26          HD11      ILE  26  10.093  -0.526   2.535
  169   HD12  ILE  26          HD12      ILE  26  10.727  -2.145   2.834
  170   HD13  ILE  26          HD13      ILE  26   9.342  -1.556   3.755
  171    H    CYS  27           H        CYS  27   7.834  -6.026  -0.736
  172    HA   CYS  27           HA       CYS  27   6.630  -7.975   1.092
  173    HB2  CYS  27           HB2      CYS  27   5.832  -7.629  -1.333
  174    HB3  CYS  27           HB3      CYS  27   7.305  -8.475  -1.799
  175    H    MET  28           H        MET  28   7.571 -10.159   1.160
  176    HA   MET  28           HA       MET  28  10.270 -10.104   1.913
  177    HB2  MET  28           HB2      MET  28   8.131 -12.031   1.834
  178    HB3  MET  28           HB3      MET  28   9.623 -12.776   1.283
  179    HG2  MET  28           HG2      MET  28  10.539 -11.508   3.456
  180    HG3  MET  28           HG3      MET  28   8.870 -11.780   3.952
  181    HE1  MET  28           HE1      MET  28  11.797 -13.439   5.307
  182    HE2  MET  28           HE2      MET  28  12.231 -12.838   3.707
  183    HE3  MET  28           HE3      MET  28  12.303 -14.567   4.049
  184    HA   PRO  29           HA       PRO  29  12.503 -10.978  -1.796
  185    HB2  PRO  29           HB2      PRO  29  14.367 -12.752  -1.091
  186    HB3  PRO  29           HB3      PRO  29  14.353 -11.117  -0.422
  187    HG2  PRO  29           HG2      PRO  29  13.382 -13.672   0.802
  188    HG3  PRO  29           HG3      PRO  29  14.314 -12.359   1.546
  189    HD2  PRO  29           HD2      PRO  29  11.602 -12.656   1.822
  190    HD3  PRO  29           HD3      PRO  29  12.443 -11.099   1.946
  191    H    GLY  30           H        GLY  30  11.936 -12.038  -3.588
  192    HA2  GLY  30           HA2      GLY  30  11.575 -13.832  -5.012
  193    HA3  GLY  30           HA3      GLY  30  11.850 -14.920  -3.660
  194    H    TYR  31           H        TYR  31   9.509 -12.316  -3.578
  195    HA   TYR  31           HA       TYR  31   7.380 -14.336  -3.413
  196    HB2  TYR  31           HB2      TYR  31   7.862 -11.746  -2.062
  197    HB3  TYR  31           HB3      TYR  31   6.191 -12.090  -2.493
  198    HD1  TYR  31           HD1      TYR  31   9.118 -13.685  -0.809
  199    HD2  TYR  31           HD2      TYR  31   4.886 -13.309  -1.019
  200    HE1  TYR  31           HE1      TYR  31   8.900 -15.096   1.193
  201    HE2  TYR  31           HE2      TYR  31   4.656 -14.719   0.982
  202    HH   TYR  31           HH       TYR  31   5.976 -15.405   2.914
  203    H    GLU  32           H        GLU  32   5.149 -12.989  -3.913
  204    HA   GLU  32           HA       GLU  32   5.440 -11.483  -6.388
  205    HB2  GLU  32           HB2      GLU  32   4.303 -14.232  -6.194
  206    HB3  GLU  32           HB3      GLU  32   3.521 -13.090  -7.279
  207    HG2  GLU  32           HG2      GLU  32   5.905 -12.694  -8.193
  208    HG3  GLU  32           HG3      GLU  32   6.281 -14.224  -7.402
  209    H    GLY  33           H        GLY  33   2.970 -11.172  -7.242
  210    HA2  GLY  33           HA2      GLY  33   0.764 -10.568  -6.676
  211    HA3  GLY  33           HA3      GLY  33   1.192 -10.686  -4.977
  212    H    VAL  34           H        VAL  34  -0.277  -8.556  -5.907
  213    HA   VAL  34           HA       VAL  34   1.546  -6.324  -6.302
  214    HB   VAL  34           HB       VAL  34  -1.460  -6.252  -6.030
  215   HG11  VAL  34          HG11      VAL  34   0.604  -4.254  -6.897
  216   HG12  VAL  34          HG12      VAL  34  -0.657  -4.083  -5.676
  217   HG13  VAL  34          HG13      VAL  34  -1.085  -4.115  -7.388
  218   HG21  VAL  34          HG21      VAL  34  -0.270  -5.919  -8.693
  219   HG22  VAL  34          HG22      VAL  34  -1.719  -6.793  -8.197
  220   HG23  VAL  34          HG23      VAL  34  -0.132  -7.542  -8.019
  221    H    TYR  35           H        TYR  35  -0.431  -7.748  -3.804
  222    HA   TYR  35           HA       TYR  35   0.430  -5.617  -1.959
  223    HB2  TYR  35           HB2      TYR  35  -2.161  -7.044  -2.261
  224    HB3  TYR  35           HB3      TYR  35  -1.639  -6.678  -0.622
  225    HD1  TYR  35           HD1      TYR  35  -0.301  -4.053  -1.051
  226    HD2  TYR  35           HD2      TYR  35  -3.954  -5.587  -2.603
  227    HE1  TYR  35           HE1      TYR  35  -1.150  -1.761  -1.304
  228    HE2  TYR  35           HE2      TYR  35  -4.813  -3.298  -2.860
  229    HH   TYR  35           HH       TYR  35  -3.959  -1.025  -3.085
  230    H    CYS  36           H        CYS  36   1.998  -7.909  -2.619
  231    HA   CYS  36           HA       CYS  36   3.140  -9.649  -1.681
  232    HB2  CYS  36           HB2      CYS  36   3.633  -7.646  -0.157
  233    HB3  CYS  36           HB3      CYS  36   2.501  -8.378   0.975
  234    H    GLU  37           H        GLU  37   1.591 -11.246  -2.235
  235    HA   GLU  37           HA       GLU  37   0.528 -12.623   0.063
  236    HB2  GLU  37           HB2      GLU  37  -1.337 -11.171  -0.325
  237    HB3  GLU  37           HB3      GLU  37  -1.303 -11.485  -2.053
  238    HG2  GLU  37           HG2      GLU  37  -3.134 -12.679  -1.119
  239    HG3  GLU  37           HG3      GLU  37  -1.897 -13.852  -1.569
  240    H    ILE  38           H        ILE  38   0.706 -12.441  -3.473
  241    HA   ILE  38           HA       ILE  38   0.517 -15.335  -3.693
  242    HB   ILE  38           HB       ILE  38   0.776 -13.177  -5.791
  243   HG12  ILE  38          HG12      ILE  38  -1.518 -13.921  -6.391
  244   HG13  ILE  38          HG13      ILE  38  -1.493 -15.027  -5.022
  245   HG21  ILE  38          HG21      ILE  38   1.918 -15.133  -6.612
  246   HG22  ILE  38          HG22      ILE  38   0.368 -14.983  -7.439
  247   HG23  ILE  38          HG23      ILE  38   0.566 -16.165  -6.146
  248   HD11  ILE  38          HD11      ILE  38  -1.736 -13.354  -3.494
  249   HD12  ILE  38          HD12      ILE  38  -2.623 -12.671  -4.856
  250   HD13  ILE  38          HD13      ILE  38  -0.972 -12.147  -4.527
  251    H1   FUC  39           H1       FUC  39  10.234  -3.320   6.296
  252    H2   FUC  39           H2       FUC  39  11.422  -5.191   7.345
  253    H3   FUC  39           H3       FUC  39   8.644  -6.336   7.880
  254    H4   FUC  39           H4       FUC  39   9.256  -8.110   6.343
  255    H5   FUC  39           H5       FUC  39   8.163  -6.122   5.387
  256    H61  FUC  39           H61      FUC  39   8.979  -6.253   3.043
  257    H62  FUC  39           H62      FUC  39  10.444  -7.115   3.604
  258    H63  FUC  39           H63      FUC  39   8.836  -7.882   3.775
  259    HO2  FUC  39           HO2      FUC  39   9.194  -4.257   8.886
  260    HO4  FUC  39           HO4      FUC  39  11.671  -6.611   5.957
  261    H1   NAG  40           H1       NAG  40   9.056  -8.761   8.731
  262    H2   NAG  40           H2       NAG  40  10.942  -8.008  11.040
  263    H3   NAG  40           H3       NAG  40   9.104 -10.448  10.742
  264    H4   NAG  40           H4       NAG  40   8.835  -8.047  12.634
  265    H5   NAG  40           H5       NAG  40   7.146  -8.788  10.168
  266    H61  NAG  40           H61      NAG  40   6.094  -6.599  10.482
  267    H62  NAG  40           H62      NAG  40   5.813  -7.687  11.860
  268    H81  NAG  40           H81      NAG  40  13.254 -10.491   8.035
  269    H82  NAG  40           H82      NAG  40  14.587  -9.610   8.835
  270    H83  NAG  40           H83      NAG  40  13.789 -10.974   9.671
  271    HN2  NAG  40           HN2      NAG  40  11.196 -10.559   9.648
  272    HO3  NAG  40           HO3      NAG  40  11.097 -10.518  12.051
  273    HO4  NAG  40           HO4      NAG  40   7.346 -10.403  12.171
  274    HO6  NAG  40           HO6      NAG  40   6.711  -6.201  13.069
  Start of MODEL   19
    1    H1   ASP   1           H1       ASP   1  -6.169   6.963  -7.728
    2    HA   ASP   1           HA       ASP   1  -7.297   4.820  -7.306
    3    HB2  ASP   1           HB2      ASP   1  -4.505   5.320  -6.470
    4    HB3  ASP   1           HB3      ASP   1  -5.211   3.813  -5.894
    5    H    VAL   2           H        VAL   2  -6.442   6.740  -4.520
    6    HA   VAL   2           HA       VAL   2  -7.235   6.776  -2.386
    7    HB   VAL   2           HB       VAL   2  -9.334   4.806  -3.295
    8   HG11  VAL   2          HG11      VAL   2 -10.667   6.011  -1.524
    9   HG12  VAL   2          HG12      VAL   2  -9.154   6.758  -1.012
   10   HG13  VAL   2          HG13      VAL   2  -9.343   5.007  -0.935
   11   HG21  VAL   2          HG21      VAL   2 -10.727   6.894  -3.639
   12   HG22  VAL   2          HG22      VAL   2  -9.478   6.585  -4.845
   13   HG23  VAL   2          HG23      VAL   2  -9.214   7.798  -3.592
   14    H    ASN   3           H        ASN   3  -7.386   5.487  -0.415
   15    HA   ASN   3           HA       ASN   3  -6.647   3.866   0.995
   16    HB2  ASN   3           HB2      ASN   3  -7.913   2.495  -1.158
   17    HB3  ASN   3           HB3      ASN   3  -6.480   1.576  -0.705
   18   HD21  ASN   3          HD21      ASN   3  -9.280   0.903  -0.379
   19   HD22  ASN   3          HD22      ASN   3  -9.524   0.649   1.312
   20    H    GLU   4           H        GLU   4  -4.586   4.406   1.459
   21    HA   GLU   4           HA       GLU   4  -2.478   3.530  -0.390
   22    HB2  GLU   4           HB2      GLU   4  -2.768   5.996   0.486
   23    HB3  GLU   4           HB3      GLU   4  -1.944   5.369   1.906
   24    HG2  GLU   4           HG2      GLU   4  -0.569   4.558  -0.478
   25    HG3  GLU   4           HG3      GLU   4  -0.801   6.304  -0.463
   26    H    CYS   5           H        CYS   5  -2.551   4.098   3.115
   27    HA   CYS   5           HA       CYS   5  -1.903   1.320   3.634
   28    HB2  CYS   5           HB2      CYS   5   0.210   2.956   3.243
   29    HB3  CYS   5           HB3      CYS   5  -0.053   3.198   4.965
   30    H    ILE   6           H        ILE   6  -4.124   1.777   4.505
   31    HA   ILE   6           HA       ILE   6  -4.078   3.165   7.079
   32    HB   ILE   6           HB       ILE   6  -6.371   2.199   5.398
   33   HG12  ILE   6          HG12      ILE   6  -6.918   4.629   5.326
   34   HG13  ILE   6          HG13      ILE   6  -5.425   4.955   6.199
   35   HG21  ILE   6          HG21      ILE   6  -6.273   3.002   8.236
   36   HG22  ILE   6          HG22      ILE   6  -7.400   1.936   7.396
   37   HG23  ILE   6          HG23      ILE   6  -7.582   3.686   7.271
   38   HD11  ILE   6          HD11      ILE   6  -4.108   4.496   4.391
   39   HD12  ILE   6          HD12      ILE   6  -5.537   5.160   3.600
   40   HD13  ILE   6          HD13      ILE   6  -5.294   3.414   3.661
   41    H    SER   7           H        SER   7  -5.975   0.366   6.036
   42    HA   SER   7           HA       SER   7  -5.396  -0.927   8.583
   43    HB2  SER   7           HB2      SER   7  -7.746  -0.678   7.422
   44    HB3  SER   7           HB3      SER   7  -7.230  -2.113   6.535
   45    HG   SER   7           HG       SER   7  -8.031  -1.856   9.137
   46    H    ASN   8           H        ASN   8  -3.122  -0.990   7.308
   47    HA   ASN   8           HA       ASN   8  -1.476  -2.283   6.411
   48    HB2  ASN   8           HB2      ASN   8  -2.026  -3.668   8.356
   49    HB3  ASN   8           HB3      ASN   8  -3.266  -4.499   7.428
   50   HD21  ASN   8          HD21      ASN   8  -1.685  -6.159   8.462
   51   HD22  ASN   8          HD22      ASN   8  -0.479  -6.742   7.382
   52    HA   PRO   9           HA       PRO   9  -3.605  -2.869   2.386
   53    HB2  PRO   9           HB2      PRO   9  -1.359  -2.275   0.926
   54    HB3  PRO   9           HB3      PRO   9  -2.520  -1.069   1.493
   55    HG2  PRO   9           HG2      PRO   9   0.118  -1.861   2.655
   56    HG3  PRO   9           HG3      PRO   9  -0.596  -0.246   2.492
   57    HD2  PRO   9           HD2      PRO   9  -0.593  -1.581   4.832
   58    HD3  PRO   9           HD3      PRO   9  -1.929  -0.510   4.362
   59    H    CYS  10           H        CYS  10  -0.268  -3.892   3.119
   60    HA   CYS  10           HA       CYS  10  -0.148  -5.982   1.261
   61    HB2  CYS  10           HB2      CYS  10   1.273  -6.014   3.920
   62    HB3  CYS  10           HB3      CYS  10   1.795  -6.728   2.400
   63    H    GLN  11           H        GLN  11  -0.090  -8.322   1.743
   64    HA   GLN  11           HA       GLN  11  -1.968  -9.079   3.875
   65    HB2  GLN  11           HB2      GLN  11  -2.213  -9.445   0.973
   66    HB3  GLN  11           HB3      GLN  11  -2.486 -10.911   1.902
   67    HG2  GLN  11           HG2      GLN  11  -3.854  -8.458   2.824
   68    HG3  GLN  11           HG3      GLN  11  -4.417  -9.182   1.318
   69   HE21  GLN  11          HE21      GLN  11  -3.110 -10.782   4.177
   70   HE22  GLN  11          HE22      GLN  11  -4.537 -11.684   4.546
   71    H    ASN  12           H        ASN  12   0.975  -9.215   3.700
   72    HA   ASN  12           HA       ASN  12   1.223 -12.027   4.395
   73    HB2  ASN  12           HB2      ASN  12   2.461 -10.800   2.005
   74    HB3  ASN  12           HB3      ASN  12   3.514 -11.821   2.975
   75   HD21  ASN  12          HD21      ASN  12   3.101 -12.626   0.533
   76   HD22  ASN  12          HD22      ASN  12   2.025 -13.968   0.478
   77    H    ASP  13           H        ASP  13   1.472  -9.192   5.573
   78    HA   ASP  13           HA       ASP  13   2.616  -8.297   7.328
   79    HB2  ASP  13           HB2      ASP  13   2.963 -10.866   7.819
   80    HB3  ASP  13           HB3      ASP  13   4.620 -10.522   7.332
   81    H    ALA  14           H        ALA  14   3.131  -7.300   4.929
   82    HA   ALA  14           HA       ALA  14   6.000  -7.241   4.461
   83    HB1  ALA  14           HB1      ALA  14   4.783  -5.387   2.778
   84    HB2  ALA  14           HB2      ALA  14   3.621  -6.704   2.925
   85    HB3  ALA  14           HB3      ALA  14   5.260  -7.036   2.374
   86    H    THR  15           H        THR  15   6.925  -4.982   3.970
   87    HA   THR  15           HA       THR  15   6.381  -3.316   6.307
   88    HB   THR  15           HB       THR  15   8.663  -3.265   4.323
   89   HG21  THR  15          HG21      THR  15   8.151  -1.055   5.442
   90   HG22  THR  15          HG22      THR  15   9.779  -1.698   5.658
   91   HG23  THR  15          HG23      THR  15   8.596  -1.839   6.958
   92    H    CYS  16           H        CYS  16   5.627  -1.263   6.208
   93    HA   CYS  16           HA       CYS  16   4.946  -0.229   3.534
   94    HB2  CYS  16           HB2      CYS  16   2.969  -0.786   4.864
   95    HB3  CYS  16           HB3      CYS  16   3.544   0.238   6.175
   96    H    LEU  17           H        LEU  17   6.082   1.477   2.921
   97    HA   LEU  17           HA       LEU  17   7.232   3.227   4.990
   98    HB2  LEU  17           HB2      LEU  17   8.437   1.927   2.826
   99    HB3  LEU  17           HB3      LEU  17   8.330   3.608   2.338
  100    HG   LEU  17           HG       LEU  17   9.516   2.785   4.979
  101   HD11  LEU  17          HD11      LEU  17  10.779   2.900   2.266
  102   HD12  LEU  17          HD12      LEU  17  10.927   1.662   3.513
  103   HD13  LEU  17          HD13      LEU  17  11.718   3.224   3.723
  104   HD21  LEU  17          HD21      LEU  17   9.948   5.249   3.301
  105   HD22  LEU  17          HD22      LEU  17  10.507   4.960   4.948
  106   HD23  LEU  17          HD23      LEU  17   8.784   5.145   4.621
  107    H    ASP  18           H        ASP  18   6.703   5.332   5.047
  108    HA   ASP  18           HA       ASP  18   4.471   6.299   3.657
  109    HB2  ASP  18           HB2      ASP  18   5.459   7.132   5.869
  110    HB3  ASP  18           HB3      ASP  18   6.583   8.065   4.886
  111    H    GLN  19           H        GLN  19   4.258   7.003   1.646
  112    HA   GLN  19           HA       GLN  19   6.673   7.832   0.186
  113    HB2  GLN  19           HB2      GLN  19   4.586   6.035  -0.476
  114    HB3  GLN  19           HB3      GLN  19   4.426   7.418  -1.549
  115    HG2  GLN  19           HG2      GLN  19   7.154   6.367  -1.224
  116    HG3  GLN  19           HG3      GLN  19   6.008   5.299  -2.034
  117   HE21  GLN  19          HE21      GLN  19   8.124   7.863  -2.399
  118   HE22  GLN  19          HE22      GLN  19   7.645   8.377  -3.976
  119    H    ILE  20           H        ILE  20   5.467   9.126  -1.950
  120    HA   ILE  20           HA       ILE  20   4.675  11.619  -0.673
  121    HB   ILE  20           HB       ILE  20   4.975  12.544  -3.001
  122   HG12  ILE  20          HG12      ILE  20   6.685  10.324  -3.818
  123   HG13  ILE  20          HG13      ILE  20   4.984   9.876  -3.731
  124   HG21  ILE  20          HG21      ILE  20   6.776  13.117  -1.768
  125   HG22  ILE  20          HG22      ILE  20   7.591  11.972  -2.832
  126   HG23  ILE  20          HG23      ILE  20   7.065  11.463  -1.228
  127   HD11  ILE  20          HD11      ILE  20   5.066  12.351  -5.038
  128   HD12  ILE  20          HD12      ILE  20   4.709  10.769  -5.730
  129   HD13  ILE  20          HD13      ILE  20   6.363  11.379  -5.731
  130    H    GLY  21           H        GLY  21   2.828   9.258  -1.079
  131    HA2  GLY  21           HA2      GLY  21   0.421  10.351  -1.332
  132    HA3  GLY  21           HA3      GLY  21   0.915  10.302  -3.017
  133    H    GLU  22           H        GLU  22   2.343   7.829  -2.889
  134    HA   GLU  22           HA       GLU  22   0.047   6.012  -2.753
  135    HB2  GLU  22           HB2      GLU  22   1.533   4.488  -4.102
  136    HB3  GLU  22           HB3      GLU  22   1.078   5.989  -4.898
  137    HG2  GLU  22           HG2      GLU  22   3.203   6.888  -4.703
  138    HG3  GLU  22           HG3      GLU  22   3.654   5.793  -3.398
  139    H    PHE  23           H        PHE  23   0.858   3.626  -2.317
  140    HA   PHE  23           HA       PHE  23   2.208   3.724   0.279
  141    HB2  PHE  23           HB2      PHE  23   1.122   1.612   0.769
  142    HB3  PHE  23           HB3      PHE  23  -0.073   2.781   0.221
  143    HD1  PHE  23           HD1      PHE  23   1.832  -0.218  -0.703
  144    HD2  PHE  23           HD2      PHE  23  -1.290   2.459  -1.789
  145    HE1  PHE  23           HE1      PHE  23   1.086  -1.800  -2.437
  146    HE2  PHE  23           HE2      PHE  23  -2.045   0.884  -3.526
  147    HZ   PHE  23           HZ       PHE  23  -0.855  -1.250  -3.851
  148    H    GLN  24           H        GLN  24   3.891   2.320   0.800
  149    HA   GLN  24           HA       GLN  24   5.166   1.011  -1.512
  150    HB2  GLN  24           HB2      GLN  24   6.416   2.970  -0.690
  151    HB3  GLN  24           HB3      GLN  24   6.500   2.239   0.907
  152    HG2  GLN  24           HG2      GLN  24   7.993   0.601   0.219
  153    HG3  GLN  24           HG3      GLN  24   7.589   0.812  -1.484
  154   HE21  GLN  24          HE21      GLN  24  10.198   0.809  -0.304
  155   HE22  GLN  24          HE22      GLN  24  10.901   2.354  -0.621
  156    H    CYS  25           H        CYS  25   4.289  -1.020  -1.185
  157    HA   CYS  25           HA       CYS  25   4.633  -2.309   1.404
  158    HB2  CYS  25           HB2      CYS  25   2.512  -2.604   0.171
  159    HB3  CYS  25           HB3      CYS  25   3.395  -3.365  -1.147
  160    H    ILE  26           H        ILE  26   6.522  -3.223   1.847
  161    HA   ILE  26           HA       ILE  26   8.257  -4.133  -0.305
  162    HB   ILE  26           HB       ILE  26   8.849  -4.262   2.647
  163   HG12  ILE  26          HG12      ILE  26   9.410  -1.973   0.746
  164   HG13  ILE  26          HG13      ILE  26   8.202  -1.955   2.027
  165   HG21  ILE  26          HG21      ILE  26  10.220  -5.434   0.747
  166   HG22  ILE  26          HG22      ILE  26  11.042  -4.603   2.067
  167   HG23  ILE  26          HG23      ILE  26  10.865  -3.811   0.500
  168   HD11  ILE  26          HD11      ILE  26   9.845  -0.947   3.173
  169   HD12  ILE  26          HD12      ILE  26  11.118  -1.637   2.167
  170   HD13  ILE  26          HD13      ILE  26  10.388  -2.603   3.450
  171    H    CYS  27           H        CYS  27   8.201  -6.153  -1.006
  172    HA   CYS  27           HA       CYS  27   6.938  -8.217   0.615
  173    HB2  CYS  27           HB2      CYS  27   7.243  -7.702  -2.206
  174    HB3  CYS  27           HB3      CYS  27   7.808  -9.325  -1.825
  175    H    MET  28           H        MET  28   7.983 -10.474   0.356
  176    HA   MET  28           HA       MET  28  10.546 -10.355   1.604
  177    HB2  MET  28           HB2      MET  28   8.475 -12.315   1.180
  178    HB3  MET  28           HB3      MET  28  10.043 -13.010   0.794
  179    HG2  MET  28           HG2      MET  28  10.703 -11.892   3.093
  180    HG3  MET  28           HG3      MET  28   8.973 -12.051   3.388
  181    HE1  MET  28           HE1      MET  28  12.157 -13.172   3.690
  182    HE2  MET  28           HE2      MET  28  12.329 -14.770   2.964
  183    HE3  MET  28           HE3      MET  28  11.902 -14.616   4.669
  184    HA   PRO  29           HA       PRO  29  13.252 -11.017  -1.822
  185    HB2  PRO  29           HB2      PRO  29  14.989 -12.889  -1.022
  186    HB3  PRO  29           HB3      PRO  29  14.929 -11.294  -0.264
  187    HG2  PRO  29           HG2      PRO  29  13.765 -13.885   0.684
  188    HG3  PRO  29           HG3      PRO  29  14.635 -12.645   1.607
  189    HD2  PRO  29           HD2      PRO  29  11.912 -12.869   1.574
  190    HD3  PRO  29           HD3      PRO  29  12.764 -11.336   1.842
  191    H    GLY  30           H        GLY  30  11.052 -12.112  -2.684
  192    HA2  GLY  30           HA2      GLY  30  11.311 -13.705  -4.687
  193    HA3  GLY  30           HA3      GLY  30  11.641 -14.897  -3.438
  194    H    TYR  31           H        TYR  31   9.245 -12.280  -3.471
  195    HA   TYR  31           HA       TYR  31   7.157 -14.320  -3.101
  196    HB2  TYR  31           HB2      TYR  31   7.591 -11.612  -1.964
  197    HB3  TYR  31           HB3      TYR  31   5.928 -12.068  -2.308
  198    HD1  TYR  31           HD1      TYR  31   8.694 -14.252  -1.128
  199    HD2  TYR  31           HD2      TYR  31   5.015 -12.345  -0.166
  200    HE1  TYR  31           HE1      TYR  31   8.606 -15.501   0.989
  201    HE2  TYR  31           HE2      TYR  31   4.917 -13.588   1.953
  202    HH   TYR  31           HH       TYR  31   7.132 -14.805   3.475
  203    H    GLU  32           H        GLU  32   4.899 -13.063  -3.681
  204    HA   GLU  32           HA       GLU  32   5.165 -11.749  -6.274
  205    HB2  GLU  32           HB2      GLU  32   3.381 -14.160  -5.937
  206    HB3  GLU  32           HB3      GLU  32   3.726 -13.282  -7.421
  207    HG2  GLU  32           HG2      GLU  32   6.042 -14.038  -7.338
  208    HG3  GLU  32           HG3      GLU  32   5.707 -14.907  -5.841
  209    H    GLY  33           H        GLY  33   2.816 -11.263  -7.120
  210    HA2  GLY  33           HA2      GLY  33   0.615 -10.564  -6.634
  211    HA3  GLY  33           HA3      GLY  33   0.974 -10.701  -4.919
  212    H    VAL  34           H        VAL  34  -0.356  -8.507  -5.855
  213    HA   VAL  34           HA       VAL  34   1.572  -6.359  -6.216
  214    HB   VAL  34           HB       VAL  34  -1.426  -6.122  -5.969
  215   HG11  VAL  34          HG11      VAL  34  -1.131  -3.993  -7.073
  216   HG12  VAL  34          HG12      VAL  34   0.604  -4.278  -7.222
  217   HG13  VAL  34          HG13      VAL  34  -0.120  -4.056  -5.629
  218   HG21  VAL  34          HG21      VAL  34   0.116  -6.216  -8.548
  219   HG22  VAL  34          HG22      VAL  34  -1.629  -6.302  -8.309
  220   HG23  VAL  34          HG23      VAL  34  -0.606  -7.654  -7.824
  221    H    TYR  35           H        TYR  35  -0.613  -7.622  -3.779
  222    HA   TYR  35           HA       TYR  35   0.331  -5.547  -1.911
  223    HB2  TYR  35           HB2      TYR  35  -2.285  -6.959  -2.199
  224    HB3  TYR  35           HB3      TYR  35  -1.774  -6.461  -0.590
  225    HD1  TYR  35           HD1      TYR  35  -0.921  -3.937  -0.465
  226    HD2  TYR  35           HD2      TYR  35  -3.541  -5.477  -3.442
  227    HE1  TYR  35           HE1      TYR  35  -1.741  -1.662  -0.915
  228    HE2  TYR  35           HE2      TYR  35  -4.366  -3.207  -3.900
  229    HH   TYR  35           HH       TYR  35  -3.976  -0.671  -1.898
  230    H    CYS  36           H        CYS  36   1.791  -7.948  -2.567
  231    HA   CYS  36           HA       CYS  36   2.849  -9.726  -1.603
  232    HB2  CYS  36           HB2      CYS  36   2.372  -7.900   0.748
  233    HB3  CYS  36           HB3      CYS  36   3.297  -9.390   0.895
  234    H    GLU  37           H        GLU  37   1.296 -11.314  -2.052
  235    HA   GLU  37           HA       GLU  37   0.197 -12.579   0.270
  236    HB2  GLU  37           HB2      GLU  37  -1.597 -11.022  -0.044
  237    HB3  GLU  37           HB3      GLU  37  -1.658 -11.346  -1.769
  238    HG2  GLU  37           HG2      GLU  37  -2.626 -13.460  -1.447
  239    HG3  GLU  37           HG3      GLU  37  -2.218 -13.477   0.268
  240    H    ILE  38           H        ILE  38   0.208 -12.410  -3.270
  241    HA   ILE  38           HA       ILE  38  -0.147 -15.291  -3.473
  242    HB   ILE  38           HB       ILE  38   0.337 -13.345  -5.726
  243   HG12  ILE  38          HG12      ILE  38  -1.625 -12.634  -4.434
  244   HG13  ILE  38          HG13      ILE  38  -2.102 -13.269  -6.006
  245   HG21  ILE  38          HG21      ILE  38  -0.116 -15.034  -7.154
  246   HG22  ILE  38          HG22      ILE  38  -1.294 -15.777  -6.073
  247   HG23  ILE  38          HG23      ILE  38   0.431 -16.028  -5.803
  248   HD11  ILE  38          HD11      ILE  38  -2.536 -14.392  -3.291
  249   HD12  ILE  38          HD12      ILE  38  -2.389 -15.499  -4.657
  250   HD13  ILE  38          HD13      ILE  38  -3.646 -14.261  -4.655
  251    H1   FUC  39           H1       FUC  39  10.753  -3.450   5.831
  252    H2   FUC  39           H2       FUC  39  11.896  -5.330   6.906
  253    H3   FUC  39           H3       FUC  39   9.093  -6.409   7.445
  254    H4   FUC  39           H4       FUC  39   9.678  -8.218   5.937
  255    H5   FUC  39           H5       FUC  39   8.624  -6.225   4.951
  256    H61  FUC  39           H61      FUC  39  10.889  -7.276   3.182
  257    H62  FUC  39           H62      FUC  39   9.273  -8.022   3.367
  258    H63  FUC  39           H63      FUC  39   9.433  -6.406   2.612
  259    HO2  FUC  39           HO2      FUC  39  10.998  -4.940   9.020
  260    HO4  FUC  39           HO4      FUC  39  11.975  -8.133   6.301
  261    H1   NAG  40           H1       NAG  40   9.368  -8.737   8.467
  262    H2   NAG  40           H2       NAG  40  11.420  -8.014  10.640
  263    H3   NAG  40           H3       NAG  40   9.371 -10.299  10.578
  264    H4   NAG  40           H4       NAG  40   9.399  -7.775  12.323
  265    H5   NAG  40           H5       NAG  40   7.535  -8.515   9.986
  266    H61  NAG  40           H61      NAG  40   7.729  -5.991  11.666
  267    H62  NAG  40           H62      NAG  40   6.422  -7.196  11.722
  268    H81  NAG  40           H81      NAG  40  13.681 -11.381   9.332
  269    H82  NAG  40           H82      NAG  40  13.681 -10.718   7.671
  270    H83  NAG  40           H83      NAG  40  14.896 -10.159   8.857
  271    HN2  NAG  40           HN2      NAG  40  11.408 -10.662   9.436
  272    HO3  NAG  40           HO3      NAG  40  11.220 -10.710  11.809
  273    HO4  NAG  40           HO4      NAG  40   8.100  -8.990  13.421
  274    HO6  NAG  40           HO6      NAG  40   7.146  -5.527   9.511
  Start of MODEL   20
    1    H1   ASP   1           H1       ASP   1 -14.541   5.586   1.217
    2    HA   ASP   1           HA       ASP   1 -14.307   5.642  -1.124
    3    HB2  ASP   1           HB2      ASP   1 -13.731   8.324   0.098
    4    HB3  ASP   1           HB3      ASP   1 -13.767   8.135  -1.652
    5    H    VAL   2           H        VAL   2 -11.447   6.630   0.642
    6    HA   VAL   2           HA       VAL   2  -9.798   5.626  -1.552
    7    HB   VAL   2           HB       VAL   2  -9.907   8.053  -1.905
    8   HG11  VAL   2          HG11      VAL   2  -9.618   9.611  -0.306
    9   HG12  VAL   2          HG12      VAL   2  -8.347   8.695   0.504
   10   HG13  VAL   2          HG13      VAL   2 -10.041   8.290   0.783
   11   HG21  VAL   2          HG21      VAL   2  -7.171   7.485  -0.829
   12   HG22  VAL   2          HG22      VAL   2  -7.638   8.363  -2.287
   13   HG23  VAL   2          HG23      VAL   2  -7.790   6.606  -2.227
   14    H    ASN   3           H        ASN   3  -7.892   4.685  -0.909
   15    HA   ASN   3           HA       ASN   3  -6.959   4.970   1.818
   16    HB2  ASN   3           HB2      ASN   3  -7.068   2.556   2.305
   17    HB3  ASN   3           HB3      ASN   3  -8.672   3.243   2.070
   18   HD21  ASN   3          HD21      ASN   3  -8.023   0.510   1.873
   19   HD22  ASN   3          HD22      ASN   3  -8.314   0.009   0.246
   20    H    GLU   4           H        GLU   4  -4.842   4.215   2.131
   21    HA   GLU   4           HA       GLU   4  -3.456   3.134  -0.208
   22    HB2  GLU   4           HB2      GLU   4  -1.547   4.814   0.542
   23    HB3  GLU   4           HB3      GLU   4  -2.789   5.284  -0.609
   24    HG2  GLU   4           HG2      GLU   4  -3.571   6.866   0.737
   25    HG3  GLU   4           HG3      GLU   4  -3.604   5.782   2.126
   26    H    CYS   5           H        CYS   5  -2.800   4.281   3.095
   27    HA   CYS   5           HA       CYS   5  -1.769   1.641   3.778
   28    HB2  CYS   5           HB2      CYS   5   0.148   3.064   2.989
   29    HB3  CYS   5           HB3      CYS   5  -0.176   4.126   4.350
   30    H    ILE   6           H        ILE   6  -3.769   1.615   4.985
   31    HA   ILE   6           HA       ILE   6  -3.661   3.239   7.434
   32    HB   ILE   6           HB       ILE   6  -6.043   2.087   6.013
   33   HG12  ILE   6          HG12      ILE   6  -6.759   4.469   5.949
   34   HG13  ILE   6          HG13      ILE   6  -5.218   4.919   6.672
   35   HG21  ILE   6          HG21      ILE   6  -5.840   3.315   8.747
   36   HG22  ILE   6          HG22      ILE   6  -6.517   1.750   8.300
   37   HG23  ILE   6          HG23      ILE   6  -7.355   3.234   7.849
   38   HD11  ILE   6          HD11      ILE   6  -5.035   3.292   4.236
   39   HD12  ILE   6          HD12      ILE   6  -4.108   4.708   4.737
   40   HD13  ILE   6          HD13      ILE   6  -5.711   4.908   4.029
   41    H    SER   7           H        SER   7  -5.433   0.288   6.606
   42    HA   SER   7           HA       SER   7  -4.455  -0.924   9.080
   43    HB2  SER   7           HB2      SER   7  -6.982  -0.765   8.210
   44    HB3  SER   7           HB3      SER   7  -6.526  -2.280   7.429
   45    HG   SER   7           HG       SER   7  -6.214  -1.724  10.195
   46    H    ASN   8           H        ASN   8  -2.425  -0.928   7.443
   47    HA   ASN   8           HA       ASN   8  -0.904  -2.176   6.297
   48    HB2  ASN   8           HB2      ASN   8  -1.082  -3.564   8.312
   49    HB3  ASN   8           HB3      ASN   8  -2.429  -4.442   7.601
   50   HD21  ASN   8          HD21      ASN   8  -0.655  -6.047   8.363
   51   HD22  ASN   8          HD22      ASN   8   0.383  -6.597   7.103
   52    HA   PRO   9           HA       PRO   9  -3.683  -2.792   2.679
   53    HB2  PRO   9           HB2      PRO   9  -1.155  -2.126   1.307
   54    HB3  PRO   9           HB3      PRO   9  -2.764  -1.442   1.087
   55    HG2  PRO   9           HG2      PRO   9  -0.823  -0.074   2.315
   56    HG3  PRO   9           HG3      PRO   9  -2.513   0.039   2.834
   57    HD2  PRO   9           HD2      PRO   9  -0.249  -1.471   4.067
   58    HD3  PRO   9           HD3      PRO   9  -1.572  -0.585   4.851
   59    H    CYS  10           H        CYS  10  -0.349  -3.901   3.143
   60    HA   CYS  10           HA       CYS  10  -0.322  -5.897   1.184
   61    HB2  CYS  10           HB2      CYS  10   1.136  -6.042   3.826
   62    HB3  CYS  10           HB3      CYS  10   1.602  -6.782   2.299
   63    H    GLN  11           H        GLN  11  -0.119  -8.298   1.734
   64    HA   GLN  11           HA       GLN  11  -2.154  -9.084   3.707
   65    HB2  GLN  11           HB2      GLN  11  -2.164  -9.472   0.806
   66    HB3  GLN  11           HB3      GLN  11  -2.411 -10.962   1.704
   67    HG2  GLN  11           HG2      GLN  11  -4.033  -8.440   1.952
   68    HG3  GLN  11           HG3      GLN  11  -4.526  -9.929   1.148
   69   HE21  GLN  11          HE21      GLN  11  -6.019  -8.762   3.165
   70   HE22  GLN  11          HE22      GLN  11  -5.998  -9.793   4.551
   71    H    ASN  12           H        ASN  12   0.826  -9.132   3.709
   72    HA   ASN  12           HA       ASN  12   1.094 -11.903   4.540
   73    HB2  ASN  12           HB2      ASN  12   2.263 -10.855   2.087
   74    HB3  ASN  12           HB3      ASN  12   3.479 -11.526   3.166
   75   HD21  ASN  12          HD21      ASN  12   3.271 -12.749   0.906
   76   HD22  ASN  12          HD22      ASN  12   2.433 -14.245   1.046
   77    H    ASP  13           H        ASP  13   1.234  -9.016   5.601
   78    HA   ASP  13           HA       ASP  13   2.291  -8.003   7.347
   79    HB2  ASP  13           HB2      ASP  13   2.740 -10.637   7.854
   80    HB3  ASP  13           HB3      ASP  13   4.393 -10.056   7.686
   81    H    ALA  14           H        ALA  14   2.921  -7.183   4.892
   82    HA   ALA  14           HA       ALA  14   5.807  -7.114   4.574
   83    HB1  ALA  14           HB1      ALA  14   5.161  -7.092   2.445
   84    HB2  ALA  14           HB2      ALA  14   4.680  -5.413   2.691
   85    HB3  ALA  14           HB3      ALA  14   3.498  -6.708   2.884
   86    H    THR  15           H        THR  15   6.788  -4.927   4.034
   87    HA   THR  15           HA       THR  15   6.122  -3.094   6.194
   88    HB   THR  15           HB       THR  15   8.439  -3.121   4.247
   89   HG21  THR  15          HG21      THR  15   7.852  -0.857   5.215
   90   HG22  THR  15          HG22      THR  15   9.493  -1.443   5.487
   91   HG23  THR  15          HG23      THR  15   8.299  -1.531   6.782
   92    H    CYS  16           H        CYS  16   5.239  -1.121   5.942
   93    HA   CYS  16           HA       CYS  16   4.509  -0.321   3.212
   94    HB2  CYS  16           HB2      CYS  16   2.718  -0.705   4.980
   95    HB3  CYS  16           HB3      CYS  16   3.323   0.746   5.773
   96    H    LEU  17           H        LEU  17   4.930   1.723   2.440
   97    HA   LEU  17           HA       LEU  17   6.367   3.597   4.162
   98    HB2  LEU  17           HB2      LEU  17   7.827   1.955   2.624
   99    HB3  LEU  17           HB3      LEU  17   7.494   3.212   1.447
  100    HG   LEU  17           HG       LEU  17   9.646   3.557   2.572
  101   HD11  LEU  17          HD11      LEU  17   7.814   5.708   3.558
  102   HD12  LEU  17          HD12      LEU  17   8.047   5.443   1.829
  103   HD13  LEU  17          HD13      LEU  17   9.425   5.847   2.853
  104   HD21  LEU  17          HD21      LEU  17   9.857   3.938   4.880
  105   HD22  LEU  17          HD22      LEU  17   8.827   2.513   4.744
  106   HD23  LEU  17          HD23      LEU  17   8.113   4.086   5.101
  107    H    ASP  18           H        ASP  18   5.830   5.667   3.793
  108    HA   ASP  18           HA       ASP  18   4.405   6.303   1.295
  109    HB2  ASP  18           HB2      ASP  18   2.861   6.095   3.260
  110    HB3  ASP  18           HB3      ASP  18   3.728   7.425   4.021
  111    H    GLN  19           H        GLN  19   5.149   8.021   0.221
  112    HA   GLN  19           HA       GLN  19   6.909   9.901   1.648
  113    HB2  GLN  19           HB2      GLN  19   7.250   8.943  -1.197
  114    HB3  GLN  19           HB3      GLN  19   8.293  10.079  -0.352
  115    HG2  GLN  19           HG2      GLN  19   8.647   8.164   1.331
  116    HG3  GLN  19           HG3      GLN  19   7.993   7.132   0.059
  117   HE21  GLN  19          HE21      GLN  19  10.718   7.487   1.326
  118   HE22  GLN  19          HE22      GLN  19  11.791   7.643  -0.020
  119    H    ILE  20           H        ILE  20   5.263   9.589  -1.489
  120    HA   ILE  20           HA       ILE  20   4.625  12.433  -1.418
  121    HB   ILE  20           HB       ILE  20   4.061  10.476  -3.641
  122   HG12  ILE  20          HG12      ILE  20   6.374  12.402  -3.570
  123   HG13  ILE  20          HG13      ILE  20   6.524  10.771  -2.923
  124   HG21  ILE  20          HG21      ILE  20   3.797  13.411  -3.299
  125   HG22  ILE  20          HG22      ILE  20   2.782  12.276  -4.190
  126   HG23  ILE  20          HG23      ILE  20   4.317  12.811  -4.875
  127   HD11  ILE  20          HD11      ILE  20   5.604  10.074  -5.260
  128   HD12  ILE  20          HD12      ILE  20   7.304  10.495  -5.055
  129   HD13  ILE  20          HD13      ILE  20   6.180  11.671  -5.737
  130    H    GLY  21           H        GLY  21   2.804   9.550  -2.431
  131    HA2  GLY  21           HA2      GLY  21   0.666   9.991  -0.609
  132    HA3  GLY  21           HA3      GLY  21   0.265  10.634  -2.194
  133    H    GLU  22           H        GLU  22   2.260   7.796  -1.662
  134    HA   GLU  22           HA       GLU  22   0.042   6.076  -2.524
  135    HB2  GLU  22           HB2      GLU  22   2.825   6.081  -3.705
  136    HB3  GLU  22           HB3      GLU  22   1.596   4.870  -4.040
  137    HG2  GLU  22           HG2      GLU  22   0.142   6.760  -4.871
  138    HG3  GLU  22           HG3      GLU  22   1.579   7.778  -4.783
  139    H    PHE  23           H        PHE  23   0.377   3.797  -2.057
  140    HA   PHE  23           HA       PHE  23   1.893   3.453   0.411
  141    HB2  PHE  23           HB2      PHE  23   0.560   1.468   0.773
  142    HB3  PHE  23           HB3      PHE  23  -0.499   2.812   0.357
  143    HD1  PHE  23           HD1      PHE  23  -1.635   2.882  -1.782
  144    HD2  PHE  23           HD2      PHE  23   0.843  -0.400  -0.698
  145    HE1  PHE  23           HE1      PHE  23  -2.622   1.544  -3.600
  146    HE2  PHE  23           HE2      PHE  23  -0.136  -1.746  -2.514
  147    HZ   PHE  23           HZ       PHE  23  -1.871  -0.773  -3.968
  148    H    GLN  24           H        GLN  24   3.791   2.454   0.441
  149    HA   GLN  24           HA       GLN  24   4.554   0.834  -1.890
  150    HB2  GLN  24           HB2      GLN  24   6.231   2.265   0.176
  151    HB3  GLN  24           HB3      GLN  24   6.897   1.186  -1.042
  152    HG2  GLN  24           HG2      GLN  24   6.040   2.635  -2.805
  153    HG3  GLN  24           HG3      GLN  24   5.360   3.715  -1.589
  154   HE21  GLN  24          HE21      GLN  24   6.793   4.889  -0.239
  155   HE22  GLN  24          HE22      GLN  24   8.409   5.226  -0.746
  156    H    CYS  25           H        CYS  25   3.980  -1.221  -1.479
  157    HA   CYS  25           HA       CYS  25   4.370  -2.356   1.171
  158    HB2  CYS  25           HB2      CYS  25   2.293  -2.831  -0.087
  159    HB3  CYS  25           HB3      CYS  25   3.248  -3.623  -1.336
  160    H    ILE  26           H        ILE  26   6.041  -3.582   1.746
  161    HA   ILE  26           HA       ILE  26   7.932  -4.416  -0.348
  162    HB   ILE  26           HB       ILE  26   8.515  -4.228   2.603
  163   HG12  ILE  26          HG12      ILE  26   9.048  -2.152   0.466
  164   HG13  ILE  26          HG13      ILE  26   7.833  -2.016   1.733
  165   HG21  ILE  26          HG21      ILE  26   9.909  -5.507   0.696
  166   HG22  ILE  26          HG22      ILE  26  10.654  -4.746   2.102
  167   HG23  ILE  26          HG23      ILE  26  10.613  -3.896   0.558
  168   HD11  ILE  26          HD11      ILE  26   9.412  -0.913   2.850
  169   HD12  ILE  26          HD12      ILE  26  10.705  -1.537   1.825
  170   HD13  ILE  26          HD13      ILE  26  10.099  -2.507   3.167
  171    H    CYS  27           H        CYS  27   7.514  -6.456  -0.935
  172    HA   CYS  27           HA       CYS  27   6.550  -8.389   1.000
  173    HB2  CYS  27           HB2      CYS  27   5.885  -8.097  -1.542
  174    HB3  CYS  27           HB3      CYS  27   7.277  -9.144  -1.798
  175    H    MET  28           H        MET  28   7.552 -10.534   1.163
  176    HA   MET  28           HA       MET  28  10.223 -10.389   1.963
  177    HB2  MET  28           HB2      MET  28   8.148 -12.379   1.858
  178    HB3  MET  28           HB3      MET  28   9.673 -13.090   1.350
  179    HG2  MET  28           HG2      MET  28  10.503 -11.769   3.525
  180    HG3  MET  28           HG3      MET  28   8.830 -12.078   3.987
  181    HE1  MET  28           HE1      MET  28  12.274 -13.156   3.801
  182    HE2  MET  28           HE2      MET  28  12.270 -14.800   4.441
  183    HE3  MET  28           HE3      MET  28  11.702 -13.463   5.441
  184    HA   PRO  29           HA       PRO  29  12.602 -11.248  -1.656
  185    HB2  PRO  29           HB2      PRO  29  14.458 -13.012  -0.892
  186    HB3  PRO  29           HB3      PRO  29  14.413 -11.375  -0.233
  187    HG2  PRO  29           HG2      PRO  29  13.430 -13.929   0.977
  188    HG3  PRO  29           HG3      PRO  29  14.323 -12.601   1.740
  189    HD2  PRO  29           HD2      PRO  29  11.609 -12.930   1.936
  190    HD3  PRO  29           HD3      PRO  29  12.426 -11.362   2.076
  191    H    GLY  30           H        GLY  30  11.841 -12.246  -3.410
  192    HA2  GLY  30           HA2      GLY  30  11.690 -14.097  -4.859
  193    HA3  GLY  30           HA3      GLY  30  11.798 -15.167  -3.469
  194    H    TYR  31           H        TYR  31   9.591 -12.530  -3.265
  195    HA   TYR  31           HA       TYR  31   7.362 -14.424  -3.443
  196    HB2  TYR  31           HB2      TYR  31   7.829 -11.869  -1.979
  197    HB3  TYR  31           HB3      TYR  31   6.177 -12.265  -2.438
  198    HD1  TYR  31           HD1      TYR  31   8.993 -14.395  -1.218
  199    HD2  TYR  31           HD2      TYR  31   5.050 -12.952  -0.535
  200    HE1  TYR  31           HE1      TYR  31   8.806 -15.855   0.751
  201    HE2  TYR  31           HE2      TYR  31   4.852 -14.408   1.436
  202    HH   TYR  31           HH       TYR  31   7.080 -16.898   2.115
  203    H    GLU  32           H        GLU  32   5.233 -13.004  -4.039
  204    HA   GLU  32           HA       GLU  32   5.732 -11.286  -6.326
  205    HB2  GLU  32           HB2      GLU  32   4.272 -12.648  -7.810
  206    HB3  GLU  32           HB3      GLU  32   5.783 -13.444  -7.394
  207    HG2  GLU  32           HG2      GLU  32   3.276 -13.977  -5.852
  208    HG3  GLU  32           HG3      GLU  32   3.621 -14.817  -7.362
  209    H    GLY  33           H        GLY  33   3.352 -10.926  -7.393
  210    HA2  GLY  33           HA2      GLY  33   1.054 -10.504  -6.947
  211    HA3  GLY  33           HA3      GLY  33   1.394 -10.632  -5.228
  212    H    VAL  34           H        VAL  34  -0.116  -8.557  -6.056
  213    HA   VAL  34           HA       VAL  34   1.621  -6.238  -6.381
  214    HB   VAL  34           HB       VAL  34  -1.391  -6.277  -6.196
  215   HG11  VAL  34          HG11      VAL  34  -1.356  -4.085  -6.974
  216   HG12  VAL  34          HG12      VAL  34   0.300  -4.219  -7.570
  217   HG13  VAL  34          HG13      VAL  34  -0.010  -4.130  -5.835
  218   HG21  VAL  34          HG21      VAL  34   0.430  -6.946  -8.420
  219   HG22  VAL  34          HG22      VAL  34  -0.905  -5.860  -8.810
  220   HG23  VAL  34          HG23      VAL  34  -1.234  -7.450  -8.121
  221    H    TYR  35           H        TYR  35  -0.548  -7.697  -4.031
  222    HA   TYR  35           HA       TYR  35   0.186  -5.599  -2.099
  223    HB2  TYR  35           HB2      TYR  35  -2.296  -7.142  -2.570
  224    HB3  TYR  35           HB3      TYR  35  -1.866  -6.877  -0.884
  225    HD1  TYR  35           HD1      TYR  35  -0.960  -4.282  -0.556
  226    HD2  TYR  35           HD2      TYR  35  -3.831  -5.641  -3.387
  227    HE1  TYR  35           HE1      TYR  35  -1.914  -2.019  -0.668
  228    HE2  TYR  35           HE2      TYR  35  -4.791  -3.382  -3.506
  229    HH   TYR  35           HH       TYR  35  -3.948  -0.996  -3.071
  230    H    CYS  36           H        CYS  36   1.741  -8.025  -2.855
  231    HA   CYS  36           HA       CYS  36   2.918  -9.719  -1.885
  232    HB2  CYS  36           HB2      CYS  36   3.659  -7.757  -0.529
  233    HB3  CYS  36           HB3      CYS  36   2.419  -8.156   0.654
  234    H    GLU  37           H        GLU  37   1.529 -11.442  -2.187
  235    HA   GLU  37           HA       GLU  37   0.460 -12.611   0.203
  236    HB2  GLU  37           HB2      GLU  37  -1.397 -11.140  -0.334
  237    HB3  GLU  37           HB3      GLU  37  -1.443 -11.750  -1.982
  238    HG2  GLU  37           HG2      GLU  37  -2.413 -13.734  -1.371
  239    HG3  GLU  37           HG3      GLU  37  -1.778 -13.663   0.272
  240    H    ILE  38           H        ILE  38   0.741 -12.695  -3.315
  241    HA   ILE  38           HA       ILE  38   0.407 -15.584  -3.363
  242    HB   ILE  38           HB       ILE  38   1.190 -13.861  -5.704
  243   HG12  ILE  38          HG12      ILE  38  -0.827 -12.902  -4.634
  244   HG13  ILE  38          HG13      ILE  38  -1.171 -13.576  -6.225
  245   HG21  ILE  38          HG21      ILE  38  -0.316 -16.466  -5.522
  246   HG22  ILE  38          HG22      ILE  38   1.381 -16.287  -5.965
  247   HG23  ILE  38          HG23      ILE  38   0.123 -15.617  -7.004
  248   HD11  ILE  38          HD11      ILE  38  -2.070 -15.591  -5.156
  249   HD12  ILE  38          HD12      ILE  38  -2.932 -14.130  -4.674
  250   HD13  ILE  38          HD13      ILE  38  -1.766 -14.869  -3.575
  251    H1   FUC  39           H1       FUC  39  10.496  -3.146   5.776
  252    H2   FUC  39           H2       FUC  39  11.683  -4.869   7.042
  253    H3   FUC  39           H3       FUC  39   8.915  -5.997   7.652
  254    H4   FUC  39           H4       FUC  39   9.580  -7.915   6.329
  255    H5   FUC  39           H5       FUC  39   8.481  -6.058   5.135
  256    H61  FUC  39           H61      FUC  39   9.373  -6.426   2.835
  257    H62  FUC  39           H62      FUC  39  10.809  -7.226   3.529
  258    H63  FUC  39           H63      FUC  39   9.191  -7.970   3.730
  259    HO2  FUC  39           HO2      FUC  39   9.409  -3.808   8.430
  260    HO4  FUC  39           HO4      FUC  39  11.867  -7.724   6.710
  261    H1   NAG  40           H1       NAG  40   9.241  -8.179   8.898
  262    H2   NAG  40           H2       NAG  40  11.289  -7.241  10.988
  263    H3   NAG  40           H3       NAG  40   9.280  -9.559  11.132
  264    H4   NAG  40           H4       NAG  40   9.280  -6.898  12.662
  265    H5   NAG  40           H5       NAG  40   7.410  -7.858  10.410
  266    H61  NAG  40           H61      NAG  40   6.126  -6.454  11.768
  267    H62  NAG  40           H62      NAG  40   7.494  -5.376  12.125
  268    H81  NAG  40           H81      NAG  40  13.595 -10.253   8.743
  269    H82  NAG  40           H82      NAG  40  13.351 -11.191  10.245
  270    H83  NAG  40           H83      NAG  40  14.737 -10.067  10.107
  271    HN2  NAG  40           HN2      NAG  40  11.210  -9.745   9.411
  272    HO3  NAG  40           HO3      NAG  40  11.335  -9.585  12.347
  273    HO4  NAG  40           HO4      NAG  40   7.197  -7.663  13.290
  274    HO6  NAG  40           HO6      NAG  40   7.364  -4.531  10.067